Browse entries in the PDBbind-CN Database
HEADER 5XN3_COMPLEX COMPND 5XN3_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 199 LEU SER CYS PRO GLU GLY LEU GLU GLU LEU LEU SER ALA SEQRES 2 A 199 PRO PRO PRO ASP LEU GLY ALA GLN ARG ARG HIS GLY TRP SEQRES 3 A 199 ASN PRO LYS ASP CYS SER GLU ASN ILE GLU VAL LYS GLU SEQRES 4 A 199 GLY GLY LEU TYR PHE GLU ARG ARG PRO VAL ALA GLN SER SEQRES 5 A 199 THR ASP GLY ALA ARG GLY LYS ARG GLY TYR SER ARG GLY SEQRES 6 A 199 LEU HIS ALA TRP GLU ILE SER TRP PRO LEU GLU GLN ARG SEQRES 7 A 199 GLY THR HIS ALA VAL VAL GLY VAL ALA THR ALA LEU ALA SEQRES 8 A 199 PRO LEU GLN THR ASP HIS TYR ALA ALA LEU LEU GLY SER SEQRES 9 A 199 ASN SER GLU SER TRP GLY TRP ASP ILE GLY ARG GLY LYS SEQRES 10 A 199 LEU TYR HIS GLN SER LYS GLY PRO GLY ALA PRO GLN TYR SEQRES 11 A 199 PRO ALA GLY THR GLN GLY GLU GLN LEU GLU VAL PRO GLU SEQRES 12 A 199 ARG LEU LEU VAL VAL LEU ASP MET GLU GLU GLY THR LEU SEQRES 13 A 199 GLY TYR ALA ILE GLY GLY THR TYR LEU GLY PRO ALA PHE SEQRES 14 A 199 ARG GLY LEU LYS GLY ARG THR LEU TYR PRO ALA VAL SER SEQRES 15 A 199 ALA VAL TRP GLY GLN CYS GLN VAL ARG ILE ARG TYR LEU SEQRES 16 A 199 GLY GLU ARG GLY HET ARG A 254 119 ATOM 1 N LEU A 23 -10.442 16.717 2.639 1.00 28.45 N ATOM 2 CA LEU A 23 -9.429 17.216 1.720 1.00 23.14 C ATOM 3 C LEU A 23 -7.998 17.109 2.167 1.00 18.46 C ATOM 4 O LEU A 23 -7.128 17.739 1.633 1.00 16.17 O ATOM 5 HN3 LEU A 23 -10.386 17.243 3.534 1.00 0.00 H ATOM 6 HN2 LEU A 23 -10.277 15.706 2.819 1.00 0.00 H ATOM 7 HN1 LEU A 23 -11.384 16.846 2.218 1.00 0.00 H ATOM 8 N SER A 24 -7.709 16.263 3.162 1.00 18.40 N ATOM 9 CA SER A 24 -6.381 16.240 3.790 1.00 18.01 C ATOM 10 C SER A 24 -5.490 15.108 3.187 1.00 15.16 C ATOM 11 O SER A 24 -4.286 15.021 3.522 1.00 17.42 O ATOM 12 CB SER A 24 -6.471 16.076 5.305 1.00 20.72 C ATOM 13 OG SER A 24 -6.782 14.706 5.611 1.00 19.00 O ATOM 14 HG SER A 24 -6.842 14.594 6.593 1.00 0.00 H ATOM 15 H SER A 24 -8.442 15.606 3.499 1.00 0.00 H ATOM 16 N CYS A 25 -6.006 14.311 2.287 1.00 13.83 N ATOM 17 CA CYS A 25 -5.265 13.111 1.825 1.00 15.24 C ATOM 18 C CYS A 25 -3.965 13.433 1.124 1.00 13.66 C ATOM 19 O CYS A 25 -3.898 14.396 0.304 1.00 14.23 O ATOM 20 CB CYS A 25 -6.094 12.278 0.834 1.00 17.98 C ATOM 21 SG CYS A 25 -7.411 11.360 1.661 1.00 24.58 S ATOM 22 H CYS A 25 -6.945 14.520 1.891 1.00 0.00 H ATOM 23 N PRO A 26 -2.935 12.624 1.262 1.00 11.45 N ATOM 24 CA PRO A 26 -1.785 12.713 0.378 1.00 12.19 C ATOM 25 C PRO A 26 -2.212 12.620 -1.088 1.00 11.76 C ATOM 26 O PRO A 26 -3.145 11.884 -1.408 1.00 12.19 O ATOM 27 CB PRO A 26 -0.979 11.467 0.746 1.00 12.31 C ATOM 28 CG PRO A 26 -1.284 11.307 2.188 1.00 12.54 C ATOM 29 CD PRO A 26 -2.778 11.523 2.248 1.00 12.39 C ATOM 30 N GLU A 27 -1.462 13.328 -1.944 1.00 13.29 N ATOM 31 CA GLU A 27 -1.666 13.122 -3.348 1.00 14.77 C ATOM 32 C GLU A 27 -1.521 11.669 -3.781 1.00 15.95 C ATOM 33 O GLU A 27 -0.555 10.973 -3.291 1.00 17.56 O ATOM 34 CB GLU A 27 -0.693 13.997 -4.128 1.00 16.23 C ATOM 35 CG GLU A 27 -0.948 15.457 -3.966 1.00 16.07 C ATOM 36 CD GLU A 27 -0.229 16.348 -5.030 1.00 17.75 C ATOM 37 OE1 GLU A 27 -0.403 16.134 -6.252 1.00 17.65 O ATOM 38 OE2 GLU A 27 0.526 17.123 -4.525 1.00 19.56 O ATOM 39 H GLU A 27 -0.753 14.007 -1.600 1.00 0.00 H ATOM 40 N GLY A 28 -2.379 11.147 -4.625 1.00 16.89 N ATOM 41 CA GLY A 28 -2.319 9.796 -5.190 1.00 16.89 C ATOM 42 C GLY A 28 -2.776 8.680 -4.227 1.00 15.96 C ATOM 43 O GLY A 28 -2.710 7.532 -4.616 1.00 15.15 O ATOM 44 H GLY A 28 -3.175 11.747 -4.920 1.00 0.00 H ATOM 45 N LEU A 29 -3.318 9.010 -3.034 1.00 14.92 N ATOM 46 CA LEU A 29 -3.790 7.924 -2.108 1.00 13.97 C ATOM 47 C LEU A 29 -4.909 7.057 -2.708 1.00 15.12 C ATOM 48 O LEU A 29 -4.865 5.830 -2.609 1.00 17.10 O ATOM 49 CB LEU A 29 -4.184 8.471 -0.797 1.00 14.90 C ATOM 50 CG LEU A 29 -4.502 7.370 0.250 1.00 15.56 C ATOM 51 CD1 LEU A 29 -3.340 6.462 0.570 1.00 14.50 C ATOM 52 CD2 LEU A 29 -4.900 8.088 1.505 1.00 16.42 C ATOM 53 H LEU A 29 -3.408 10.009 -2.758 1.00 0.00 H ATOM 54 N GLU A 30 -5.891 7.682 -3.386 1.00 19.00 N ATOM 55 CA GLU A 30 -6.994 6.845 -3.960 1.00 22.49 C ATOM 56 C GLU A 30 -6.488 5.917 -5.038 1.00 20.65 C ATOM 57 O GLU A 30 -6.856 4.706 -5.079 1.00 22.74 O ATOM 58 CB GLU A 30 -8.195 7.705 -4.362 1.00 27.61 C ATOM 59 CG GLU A 30 -9.152 7.844 -3.176 1.00 36.35 C ATOM 60 CD GLU A 30 -10.379 8.732 -3.411 1.00 43.96 C ATOM 61 OE1 GLU A 30 -10.226 9.918 -3.781 1.00 47.30 O ATOM 62 OE2 GLU A 30 -11.519 8.236 -3.188 1.00 52.71 O ATOM 63 H GLU A 30 -5.884 8.715 -3.508 1.00 0.00 H ATOM 64 N GLU A 31 -5.549 6.392 -5.835 1.00 21.39 N ATOM 65 CA GLU A 31 -4.948 5.626 -6.932 1.00 24.36 C ATOM 66 C GLU A 31 -4.249 4.430 -6.330 1.00 22.52 C ATOM 67 O GLU A 31 -4.396 3.312 -6.790 1.00 25.75 O ATOM 68 CB GLU A 31 -3.979 6.470 -7.753 1.00 26.57 C ATOM 69 CG GLU A 31 -4.668 7.457 -8.690 1.00 31.15 C ATOM 70 CD GLU A 31 -5.233 8.702 -8.000 1.00 35.37 C ATOM 71 OE1 GLU A 31 -5.042 8.900 -6.746 1.00 30.73 O ATOM 72 OE2 GLU A 31 -5.887 9.494 -8.736 1.00 35.42 O ATOM 73 H GLU A 31 -5.216 7.365 -5.676 1.00 0.00 H ATOM 74 N LEU A 32 -3.461 4.696 -5.291 1.00 19.94 N ATOM 75 CA LEU A 32 -2.660 3.664 -4.654 1.00 20.43 C ATOM 76 C LEU A 32 -3.571 2.600 -4.110 1.00 21.19 C ATOM 77 O LEU A 32 -3.320 1.403 -4.385 1.00 23.96 O ATOM 78 CB LEU A 32 -1.782 4.290 -3.570 1.00 18.45 C ATOM 79 CG LEU A 32 -0.683 3.464 -2.838 1.00 17.90 C ATOM 80 CD1 LEU A 32 0.323 4.343 -2.153 1.00 17.86 C ATOM 81 CD2 LEU A 32 -1.168 2.441 -1.828 1.00 21.50 C ATOM 82 H LEU A 32 -3.417 5.669 -4.925 1.00 0.00 H ATOM 83 N LEU A 33 -4.642 2.972 -3.420 1.00 20.69 N ATOM 84 CA LEU A 33 -5.482 2.024 -2.678 1.00 22.45 C ATOM 85 C LEU A 33 -6.406 1.286 -3.623 1.00 26.89 C ATOM 86 O LEU A 33 -6.970 0.262 -3.237 1.00 29.66 O ATOM 87 CB LEU A 33 -6.306 2.677 -1.548 1.00 24.00 C ATOM 88 CG LEU A 33 -5.525 3.307 -0.402 1.00 23.32 C ATOM 89 CD1 LEU A 33 -6.535 3.887 0.557 1.00 24.78 C ATOM 90 CD2 LEU A 33 -4.663 2.236 0.245 1.00 23.86 C ATOM 91 H LEU A 33 -4.897 3.980 -3.404 1.00 0.00 H ATOM 92 N SER A 34 -6.551 1.793 -4.847 1.00 28.16 N ATOM 93 CA SER A 34 -7.412 1.117 -5.811 1.00 30.23 C ATOM 94 C SER A 34 -6.572 0.273 -6.786 1.00 28.01 C ATOM 95 O SER A 34 -7.167 -0.504 -7.532 1.00 29.46 O ATOM 96 CB SER A 34 -8.370 2.138 -6.460 1.00 28.18 C ATOM 97 OG SER A 34 -7.664 3.061 -7.239 1.00 31.89 O ATOM 98 HG SER A 34 -7.019 3.548 -6.668 1.00 0.00 H ATOM 99 H SER A 34 -6.053 2.666 -5.113 1.00 0.00 H ATOM 100 N ALA A 35 -5.224 0.350 -6.745 1.00 25.55 N ATOM 101 CA ALA A 35 -4.380 -0.462 -7.620 1.00 28.37 C ATOM 102 C ALA A 35 -4.444 -1.935 -7.181 1.00 28.29 C ATOM 103 O ALA A 35 -4.811 -2.204 -6.035 1.00 27.96 O ATOM 104 CB ALA A 35 -2.975 0.046 -7.563 1.00 28.84 C ATOM 105 H ALA A 35 -4.775 1.004 -6.073 1.00 0.00 H ATOM 106 N PRO A 36 -4.146 -2.893 -8.100 1.00 27.60 N ATOM 107 CA PRO A 36 -4.148 -4.270 -7.616 1.00 27.94 C ATOM 108 C PRO A 36 -3.164 -4.384 -6.436 1.00 21.42 C ATOM 109 O PRO A 36 -2.086 -3.854 -6.562 1.00 23.57 O ATOM 110 CB PRO A 36 -3.650 -5.096 -8.826 1.00 30.21 C ATOM 111 CG PRO A 36 -3.763 -4.181 -10.026 1.00 29.22 C ATOM 112 CD PRO A 36 -3.628 -2.778 -9.477 1.00 28.77 C ATOM 113 N PRO A 37 -3.568 -5.080 -5.388 1.00 23.38 N ATOM 114 CA PRO A 37 -2.719 -5.137 -4.137 1.00 21.81 C ATOM 115 C PRO A 37 -1.429 -5.866 -4.409 1.00 21.17 C ATOM 116 O PRO A 37 -1.426 -6.929 -5.093 1.00 18.78 O ATOM 117 CB PRO A 37 -3.572 -5.949 -3.179 1.00 27.65 C ATOM 118 CG PRO A 37 -4.586 -6.628 -3.974 1.00 30.20 C ATOM 119 CD PRO A 37 -4.855 -5.701 -5.133 1.00 25.49 C ATOM 120 N PRO A 38 -0.332 -5.419 -3.827 1.00 18.45 N ATOM 121 CA PRO A 38 0.896 -6.185 -3.917 1.00 18.23 C ATOM 122 C PRO A 38 0.733 -7.621 -3.447 1.00 17.49 C ATOM 123 O PRO A 38 0.035 -7.899 -2.475 1.00 16.17 O ATOM 124 CB PRO A 38 1.840 -5.407 -2.986 1.00 19.38 C ATOM 125 CG PRO A 38 1.403 -4.005 -3.081 1.00 17.70 C ATOM 126 CD PRO A 38 -0.103 -4.163 -3.066 1.00 17.31 C ATOM 127 N ASP A 39 1.308 -8.525 -4.240 1.00 17.83 N ATOM 128 CA ASP A 39 1.230 -9.960 -3.946 1.00 17.54 C ATOM 129 C ASP A 39 2.109 -10.386 -2.811 1.00 16.18 C ATOM 130 O ASP A 39 2.794 -9.548 -2.235 1.00 15.69 O ATOM 131 CB ASP A 39 1.540 -10.808 -5.216 1.00 18.22 C ATOM 132 CG ASP A 39 2.978 -10.682 -5.705 1.00 22.48 C ATOM 133 OD1 ASP A 39 3.945 -10.211 -5.038 1.00 21.51 O ATOM 134 OD2 ASP A 39 3.250 -11.171 -6.858 1.00 24.84 O ATOM 135 H ASP A 39 1.823 -8.206 -5.085 1.00 0.00 H ATOM 136 N LEU A 40 2.085 -11.643 -2.452 1.00 15.71 N ATOM 137 CA LEU A 40 2.780 -12.106 -1.260 1.00 14.64 C ATOM 138 C LEU A 40 4.285 -11.782 -1.385 1.00 15.13 C ATOM 139 O LEU A 40 4.978 -11.469 -0.377 1.00 14.64 O ATOM 140 CB LEU A 40 2.645 -13.630 -1.061 1.00 15.15 C ATOM 141 CG LEU A 40 1.275 -14.098 -0.619 1.00 16.40 C ATOM 142 CD1 LEU A 40 1.328 -15.625 -0.473 1.00 18.10 C ATOM 143 CD2 LEU A 40 0.685 -13.447 0.625 1.00 19.19 C ATOM 144 H LEU A 40 1.558 -12.327 -3.031 1.00 0.00 H ATOM 145 N GLY A 41 4.899 -11.952 -2.509 1.00 15.58 N ATOM 146 CA GLY A 41 6.244 -11.583 -2.733 1.00 14.65 C ATOM 147 C GLY A 41 6.627 -10.145 -2.319 1.00 14.93 C ATOM 148 O GLY A 41 7.638 -9.883 -1.583 1.00 14.79 O ATOM 149 H GLY A 41 4.373 -12.386 -3.294 1.00 0.00 H ATOM 150 N ALA A 42 5.824 -9.238 -2.792 1.00 15.10 N ATOM 151 CA ALA A 42 5.964 -7.816 -2.478 1.00 14.59 C ATOM 152 C ALA A 42 5.751 -7.599 -0.973 1.00 13.62 C ATOM 153 O ALA A 42 6.544 -6.821 -0.349 1.00 13.65 O ATOM 154 CB ALA A 42 5.004 -7.036 -3.261 1.00 14.22 C ATOM 155 H ALA A 42 5.050 -9.536 -3.420 1.00 0.00 H ATOM 156 N GLN A 43 4.754 -8.238 -0.400 1.00 12.63 N ATOM 157 CA GLN A 43 4.485 -8.136 1.022 1.00 11.90 C ATOM 158 C GLN A 43 5.665 -8.615 1.830 1.00 12.53 C ATOM 159 O GLN A 43 5.985 -7.971 2.841 1.00 11.33 O ATOM 160 CB GLN A 43 3.260 -8.888 1.399 1.00 11.70 C ATOM 161 CG GLN A 43 2.003 -8.319 0.748 1.00 13.32 C ATOM 162 CD GLN A 43 0.800 -9.225 1.022 1.00 14.29 C ATOM 163 OE1 GLN A 43 0.555 -9.681 2.108 1.00 12.90 O ATOM 164 NE2 GLN A 43 0.021 -9.493 0.001 1.00 15.82 N ATOM 165 HE22 GLN A 43 0.237 -9.097 -0.936 1.00 0.00 H ATOM 166 HE21 GLN A 43 -0.812 -10.102 0.129 1.00 0.00 H ATOM 167 H GLN A 43 4.138 -8.837 -0.986 1.00 0.00 H ATOM 168 N ARG A 44 6.367 -9.685 1.383 1.00 11.94 N ATOM 169 CA ARG A 44 7.521 -10.181 2.150 1.00 12.06 C ATOM 170 C ARG A 44 8.725 -9.235 1.991 1.00 11.32 C ATOM 171 O ARG A 44 9.412 -8.963 2.966 1.00 12.28 O ATOM 172 CB ARG A 44 7.898 -11.627 1.757 1.00 12.34 C ATOM 173 CG ARG A 44 6.827 -12.607 2.173 1.00 12.84 C ATOM 174 CD ARG A 44 7.268 -14.050 1.941 1.00 13.63 C ATOM 175 NE ARG A 44 6.280 -14.973 2.409 1.00 12.86 N ATOM 176 CZ ARG A 44 5.481 -15.743 1.670 1.00 13.57 C ATOM 177 NH1 ARG A 44 5.508 -15.665 0.369 1.00 12.96 N ATOM 178 NH2 ARG A 44 4.653 -16.548 2.270 1.00 13.73 N ATOM 179 HE ARG A 44 6.173 -15.052 3.440 1.00 0.00 H ATOM 180 HH12 ARG A 44 4.882 -16.269 -0.201 1.00 0.00 H ATOM 181 HH11 ARG A 44 6.156 -14.999 -0.099 1.00 0.00 H ATOM 182 HH22 ARG A 44 4.022 -17.156 1.711 1.00 0.00 H ATOM 183 HH21 ARG A 44 4.623 -16.583 3.309 1.00 0.00 H ATOM 184 H ARG A 44 6.090 -10.156 0.498 1.00 0.00 H ATOM 185 N ARG A 45 8.846 -8.677 0.793 1.00 12.73 N ATOM 186 CA ARG A 45 9.973 -7.743 0.582 1.00 13.97 C ATOM 187 C ARG A 45 9.900 -6.462 1.445 1.00 12.28 C ATOM 188 O ARG A 45 10.917 -5.896 1.868 1.00 13.35 O ATOM 189 CB ARG A 45 10.094 -7.319 -0.863 1.00 16.39 C ATOM 190 CG ARG A 45 10.732 -8.417 -1.696 1.00 22.34 C ATOM 191 CD ARG A 45 11.128 -7.895 -3.084 1.00 24.81 C ATOM 192 NE ARG A 45 10.039 -7.353 -3.832 1.00 30.49 N ATOM 193 CZ ARG A 45 9.121 -8.048 -4.502 1.00 33.74 C ATOM 194 NH1 ARG A 45 9.107 -9.379 -4.518 1.00 36.90 N ATOM 195 NH2 ARG A 45 8.189 -7.378 -5.155 1.00 37.02 N ATOM 196 HE ARG A 45 9.954 -6.317 -3.856 1.00 0.00 H ATOM 197 HH12 ARG A 45 8.373 -9.885 -5.054 1.00 0.00 H ATOM 198 HH11 ARG A 45 9.830 -9.913 -3.995 1.00 0.00 H ATOM 199 HH22 ARG A 45 7.457 -7.890 -5.688 1.00 0.00 H ATOM 200 HH21 ARG A 45 8.187 -6.338 -5.136 1.00 0.00 H ATOM 201 H ARG A 45 8.172 -8.889 0.030 1.00 0.00 H ATOM 202 N HIS A 46 8.667 -6.013 1.720 1.00 11.07 N ATOM 203 CA HIS A 46 8.413 -4.773 2.481 1.00 11.12 C ATOM 204 C HIS A 46 7.893 -5.141 3.883 1.00 10.50 C ATOM 205 O HIS A 46 7.520 -4.215 4.629 1.00 10.59 O ATOM 206 CB HIS A 46 7.390 -3.975 1.749 1.00 11.71 C ATOM 207 CG HIS A 46 7.911 -3.291 0.555 1.00 12.57 C ATOM 208 ND1 HIS A 46 8.394 -2.007 0.592 1.00 12.56 N ATOM 209 CD2 HIS A 46 8.094 -3.736 -0.711 1.00 13.91 C ATOM 210 CE1 HIS A 46 8.832 -1.664 -0.590 1.00 14.76 C ATOM 211 NE2 HIS A 46 8.639 -2.691 -1.414 1.00 15.50 N ATOM 212 H HIS A 46 7.852 -6.563 1.382 1.00 0.00 H ATOM 213 N GLY A 47 7.968 -6.387 4.296 1.00 9.88 N ATOM 214 CA GLY A 47 7.455 -6.843 5.573 1.00 9.17 C ATOM 215 C GLY A 47 8.436 -6.807 6.715 1.00 9.06 C ATOM 216 O GLY A 47 9.470 -6.119 6.559 1.00 9.28 O ATOM 217 H GLY A 47 8.421 -7.085 3.672 1.00 0.00 H ATOM 218 N TRP A 48 8.104 -7.424 7.816 1.00 8.46 N ATOM 219 CA TRP A 48 8.962 -7.289 9.013 1.00 8.82 C ATOM 220 C TRP A 48 10.342 -7.917 8.763 1.00 9.40 C ATOM 221 O TRP A 48 10.405 -8.945 8.047 1.00 10.01 O ATOM 222 CB TRP A 48 8.369 -7.977 10.215 1.00 8.52 C ATOM 223 CG TRP A 48 7.026 -7.498 10.598 1.00 7.69 C ATOM 224 CD1 TRP A 48 5.910 -8.251 10.726 1.00 7.96 C ATOM 225 CD2 TRP A 48 6.646 -6.142 10.993 1.00 7.26 C ATOM 226 NE1 TRP A 48 4.841 -7.462 11.149 1.00 8.83 N ATOM 227 CE2 TRP A 48 5.296 -6.176 11.325 1.00 7.81 C ATOM 228 CE3 TRP A 48 7.375 -4.899 11.054 1.00 8.66 C ATOM 229 CZ2 TRP A 48 4.598 -5.025 11.729 1.00 8.44 C ATOM 230 CZ3 TRP A 48 6.712 -3.794 11.453 1.00 7.72 C ATOM 231 CH2 TRP A 48 5.320 -3.849 11.832 1.00 7.78 C ATOM 232 HE1 TRP A 48 3.866 -7.790 11.305 1.00 0.00 H ATOM 233 H TRP A 48 7.243 -8.006 7.851 1.00 0.00 H ATOM 234 N ASN A 49 11.383 -7.267 9.318 1.00 8.80 N ATOM 235 CA ASN A 49 12.733 -7.707 9.067 1.00 10.24 C ATOM 236 C ASN A 49 13.119 -8.650 10.163 1.00 11.53 C ATOM 237 O ASN A 49 13.303 -8.227 11.286 1.00 10.28 O ATOM 238 CB ASN A 49 13.636 -6.488 8.987 1.00 9.57 C ATOM 239 CG ASN A 49 15.016 -6.775 8.407 1.00 10.27 C ATOM 240 OD1 ASN A 49 15.836 -5.798 8.125 1.00 12.94 O ATOM 241 ND2 ASN A 49 15.355 -7.992 8.271 1.00 9.69 N ATOM 242 HD22 ASN A 49 14.681 -8.749 8.503 1.00 0.00 H ATOM 243 HD21 ASN A 49 16.307 -8.231 7.927 1.00 0.00 H ATOM 244 H ASN A 49 11.212 -6.444 9.930 1.00 0.00 H ATOM 245 N PRO A 50 13.470 -9.963 9.860 1.00 12.54 N ATOM 246 CA PRO A 50 13.987 -10.845 10.944 1.00 12.86 C ATOM 247 C PRO A 50 15.276 -10.344 11.508 1.00 12.87 C ATOM 248 O PRO A 50 15.603 -10.680 12.698 1.00 14.59 O ATOM 249 CB PRO A 50 14.224 -12.175 10.256 1.00 13.27 C ATOM 250 CG PRO A 50 13.484 -12.147 9.082 1.00 16.24 C ATOM 251 CD PRO A 50 13.242 -10.694 8.635 1.00 11.46 C ATOM 252 N LYS A 51 15.985 -9.549 10.753 1.00 12.62 N ATOM 253 CA LYS A 51 17.257 -8.988 11.214 1.00 14.18 C ATOM 254 C LYS A 51 17.133 -7.618 11.775 1.00 13.65 C ATOM 255 O LYS A 51 18.181 -6.958 12.037 1.00 16.40 O ATOM 256 CB LYS A 51 18.235 -8.967 10.103 1.00 17.10 C ATOM 257 CG LYS A 51 18.597 -10.326 9.591 1.00 20.80 C ATOM 258 CD LYS A 51 19.022 -10.261 8.138 1.00 30.01 C ATOM 259 CE LYS A 51 20.224 -11.165 7.873 1.00 38.07 C ATOM 260 NZ LYS A 51 20.144 -12.514 8.496 1.00 41.43 N ATOM 261 HZ1 LYS A 51 20.067 -12.414 9.528 1.00 0.00 H ATOM 262 HZ2 LYS A 51 19.308 -13.014 8.132 1.00 0.00 H ATOM 263 HZ3 LYS A 51 21.001 -13.054 8.262 1.00 0.00 H ATOM 264 H LYS A 51 15.639 -9.309 9.802 1.00 0.00 H ATOM 265 N ASP A 52 15.893 -7.142 12.040 1.00 12.37 N ATOM 266 CA ASP A 52 15.725 -5.816 12.653 1.00 11.35 C ATOM 267 C ASP A 52 14.521 -5.792 13.546 1.00 10.57 C ATOM 268 O ASP A 52 13.609 -4.983 13.378 1.00 10.09 O ATOM 269 CB ASP A 52 15.666 -4.762 11.586 1.00 11.17 C ATOM 270 CG ASP A 52 16.078 -3.397 12.097 1.00 9.41 C ATOM 271 OD1 ASP A 52 16.665 -3.223 13.158 1.00 11.84 O ATOM 272 OD2 ASP A 52 15.774 -2.415 11.325 1.00 9.63 O ATOM 273 H ASP A 52 15.057 -7.716 11.809 1.00 0.00 H ATOM 274 N CYS A 53 14.532 -6.649 14.545 1.00 9.46 N ATOM 275 CA CYS A 53 13.448 -6.741 15.542 1.00 10.24 C ATOM 276 C CYS A 53 13.973 -7.069 16.894 1.00 10.64 C ATOM 277 O CYS A 53 15.130 -7.553 16.989 1.00 10.45 O ATOM 278 CB CYS A 53 12.409 -7.725 15.125 1.00 11.65 C ATOM 279 SG CYS A 53 12.960 -9.401 14.973 1.00 13.87 S ATOM 280 H CYS A 53 15.344 -7.292 14.636 1.00 0.00 H ATOM 281 N SER A 54 13.238 -6.834 17.941 1.00 10.36 N ATOM 282 CA SER A 54 13.562 -7.331 19.234 1.00 10.37 C ATOM 283 C SER A 54 13.989 -8.781 19.251 1.00 11.73 C ATOM 284 O SER A 54 13.392 -9.608 18.564 1.00 11.41 O ATOM 285 CB SER A 54 12.396 -7.120 20.177 1.00 10.28 C ATOM 286 OG SER A 54 12.653 -7.810 21.382 1.00 11.37 O ATOM 287 HG SER A 54 11.895 -7.677 22.005 1.00 0.00 H ATOM 288 H SER A 54 12.378 -6.259 17.828 1.00 0.00 H ATOM 289 N GLU A 55 14.915 -9.088 20.173 1.00 12.79 N ATOM 290 CA GLU A 55 15.322 -10.481 20.415 1.00 13.89 C ATOM 291 C GLU A 55 14.157 -11.311 20.889 1.00 12.83 C ATOM 292 O GLU A 55 14.203 -12.503 20.784 1.00 14.42 O ATOM 293 CB GLU A 55 16.459 -10.569 21.478 1.00 16.57 C ATOM 294 CG GLU A 55 16.096 -10.063 22.865 1.00 19.52 C ATOM 295 CD GLU A 55 17.197 -10.153 23.926 1.00 27.44 C ATOM 296 OE1 GLU A 55 18.187 -10.876 23.713 1.00 35.06 O ATOM 297 OE2 GLU A 55 17.054 -9.407 24.915 1.00 29.06 O ATOM 298 H GLU A 55 15.354 -8.326 20.728 1.00 0.00 H ATOM 299 N ASN A 56 13.052 -10.670 21.374 1.00 11.73 N ATOM 300 CA ASN A 56 11.896 -11.404 21.873 1.00 10.15 C ATOM 301 C ASN A 56 10.802 -11.525 20.826 1.00 10.93 C ATOM 302 O ASN A 56 9.701 -12.008 21.126 1.00 12.15 O ATOM 303 CB ASN A 56 11.321 -10.699 23.083 1.00 12.45 C ATOM 304 CG ASN A 56 12.266 -10.623 24.247 1.00 12.40 C ATOM 305 OD1 ASN A 56 12.993 -11.651 24.514 1.00 12.53 O ATOM 306 ND2 ASN A 56 12.419 -9.494 24.865 1.00 13.15 N ATOM 307 HD22 ASN A 56 11.814 -8.683 24.624 1.00 0.00 H ATOM 308 HD21 ASN A 56 13.147 -9.399 25.602 1.00 0.00 H ATOM 309 H ASN A 56 13.035 -9.630 21.387 1.00 0.00 H ATOM 310 N ILE A 57 11.081 -11.111 19.585 1.00 9.72 N ATOM 311 CA ILE A 57 10.120 -11.252 18.496 1.00 10.33 C ATOM 312 C ILE A 57 10.667 -12.224 17.440 1.00 10.56 C ATOM 313 O ILE A 57 11.874 -12.195 17.114 1.00 12.39 O ATOM 314 CB ILE A 57 9.828 -9.867 17.827 1.00 10.70 C ATOM 315 CG1 ILE A 57 8.964 -9.123 18.763 1.00 10.60 C ATOM 316 CG2 ILE A 57 9.218 -9.976 16.441 1.00 11.40 C ATOM 317 CD1 ILE A 57 8.618 -7.678 18.347 1.00 11.13 C ATOM 318 H ILE A 57 12.006 -10.678 19.391 1.00 0.00 H ATOM 319 N GLU A 58 9.806 -13.110 16.909 1.00 11.05 N ATOM 320 CA GLU A 58 10.120 -14.023 15.820 1.00 12.59 C ATOM 321 C GLU A 58 9.321 -13.568 14.593 1.00 9.82 C ATOM 322 O GLU A 58 8.115 -13.544 14.673 1.00 11.56 O ATOM 323 CB GLU A 58 9.740 -15.448 16.199 1.00 17.31 C ATOM 324 CG GLU A 58 10.171 -16.409 15.097 1.00 21.45 C ATOM 325 CD GLU A 58 9.801 -17.885 15.343 1.00 28.67 C ATOM 326 OE1 GLU A 58 9.414 -18.244 16.470 1.00 36.37 O ATOM 327 OE2 GLU A 58 9.870 -18.674 14.352 1.00 34.55 O ATOM 328 H GLU A 58 8.845 -13.145 17.306 1.00 0.00 H ATOM 329 N VAL A 59 10.012 -13.250 13.516 1.00 10.26 N ATOM 330 CA VAL A 59 9.393 -12.889 12.256 1.00 10.28 C ATOM 331 C VAL A 59 8.989 -14.176 11.520 1.00 10.56 C ATOM 332 O VAL A 59 9.812 -15.118 11.363 1.00 12.42 O ATOM 333 CB VAL A 59 10.261 -12.004 11.437 1.00 11.04 C ATOM 334 CG1 VAL A 59 9.674 -11.837 10.032 1.00 11.20 C ATOM 335 CG2 VAL A 59 10.510 -10.686 12.146 1.00 10.90 C ATOM 336 H VAL A 59 11.050 -13.259 13.573 1.00 0.00 H ATOM 337 N LYS A 60 7.777 -14.300 11.071 1.00 10.54 N ATOM 338 CA LYS A 60 7.265 -15.504 10.412 1.00 10.74 C ATOM 339 C LYS A 60 6.940 -15.202 8.983 1.00 10.88 C ATOM 340 O LYS A 60 6.695 -14.045 8.563 1.00 11.07 O ATOM 341 CB LYS A 60 6.010 -15.926 11.101 1.00 13.72 C ATOM 342 CG LYS A 60 6.141 -16.171 12.585 1.00 19.17 C ATOM 343 CD LYS A 60 6.803 -17.473 12.897 1.00 23.62 C ATOM 344 CE LYS A 60 6.636 -17.815 14.383 1.00 32.19 C ATOM 345 NZ LYS A 60 5.261 -17.872 14.952 1.00 39.76 N ATOM 346 HZ1 LYS A 60 4.802 -16.945 14.840 1.00 0.00 H ATOM 347 HZ2 LYS A 60 4.709 -18.596 14.450 1.00 0.00 H ATOM 348 HZ3 LYS A 60 5.315 -18.114 15.962 1.00 0.00 H ATOM 349 H LYS A 60 7.129 -13.494 11.186 1.00 0.00 H ATOM 350 N GLU A 61 6.834 -16.287 8.208 1.00 11.20 N ATOM 351 CA GLU A 61 6.373 -16.180 6.834 1.00 11.08 C ATOM 352 C GLU A 61 7.174 -15.201 6.013 1.00 11.01 C ATOM 353 O GLU A 61 6.699 -14.575 5.133 1.00 11.37 O ATOM 354 CB GLU A 61 4.827 -15.945 6.782 1.00 12.19 C ATOM 355 CG GLU A 61 4.102 -17.253 7.008 1.00 12.57 C ATOM 356 CD GLU A 61 4.258 -18.306 5.904 1.00 14.27 C ATOM 357 OE1 GLU A 61 4.735 -17.991 4.810 1.00 14.26 O ATOM 358 OE2 GLU A 61 4.002 -19.490 6.274 1.00 16.42 O ATOM 359 H GLU A 61 7.085 -17.220 8.594 1.00 0.00 H ATOM 360 N GLY A 62 8.499 -15.087 6.309 1.00 10.93 N ATOM 361 CA GLY A 62 9.321 -14.214 5.548 1.00 10.57 C ATOM 362 C GLY A 62 8.999 -12.732 5.620 1.00 10.70 C ATOM 363 O GLY A 62 9.399 -11.952 4.747 1.00 11.52 O ATOM 364 H GLY A 62 8.908 -15.638 7.091 1.00 0.00 H ATOM 365 N GLY A 63 8.318 -12.333 6.727 1.00 10.47 N ATOM 366 CA GLY A 63 8.013 -10.933 6.889 1.00 9.94 C ATOM 367 C GLY A 63 6.547 -10.582 6.957 1.00 10.30 C ATOM 368 O GLY A 63 6.180 -9.471 7.348 1.00 10.11 O ATOM 369 H GLY A 63 8.022 -13.025 7.444 1.00 0.00 H ATOM 370 N LEU A 64 5.631 -11.515 6.660 1.00 8.63 N ATOM 371 CA LEU A 64 4.209 -11.198 6.644 1.00 8.94 C ATOM 372 C LEU A 64 3.698 -10.930 8.030 1.00 9.36 C ATOM 373 O LEU A 64 2.739 -10.116 8.178 1.00 9.88 O ATOM 374 CB LEU A 64 3.381 -12.336 6.017 1.00 9.87 C ATOM 375 CG LEU A 64 3.690 -12.674 4.593 1.00 10.78 C ATOM 376 CD1 LEU A 64 2.784 -13.839 4.145 1.00 12.26 C ATOM 377 CD2 LEU A 64 3.628 -11.462 3.676 1.00 11.13 C ATOM 378 H LEU A 64 5.941 -12.482 6.437 1.00 0.00 H ATOM 379 N TYR A 65 4.190 -11.566 9.093 1.00 8.46 N ATOM 380 CA TYR A 65 3.752 -11.238 10.450 1.00 9.13 C ATOM 381 C TYR A 65 4.842 -11.573 11.406 1.00 8.50 C ATOM 382 O TYR A 65 5.834 -12.224 11.005 1.00 10.47 O ATOM 383 CB TYR A 65 2.428 -11.932 10.874 1.00 10.26 C ATOM 384 CG TYR A 65 2.450 -13.470 11.048 1.00 10.40 C ATOM 385 CD1 TYR A 65 2.329 -14.345 9.908 1.00 11.62 C ATOM 386 CD2 TYR A 65 2.584 -14.012 12.291 1.00 12.16 C ATOM 387 CE1 TYR A 65 2.360 -15.750 10.102 1.00 12.74 C ATOM 388 CE2 TYR A 65 2.569 -15.402 12.447 1.00 14.63 C ATOM 389 CZ TYR A 65 2.437 -16.191 11.363 1.00 12.80 C ATOM 390 OH TYR A 65 2.458 -17.540 11.793 1.00 19.42 O ATOM 391 HH TYR A 65 2.362 -18.137 11.009 1.00 0.00 H ATOM 392 H TYR A 65 4.901 -12.312 8.955 1.00 0.00 H ATOM 393 N PHE A 66 4.745 -11.160 12.642 1.00 8.43 N ATOM 394 CA PHE A 66 5.626 -11.553 13.703 1.00 8.82 C ATOM 395 C PHE A 66 4.820 -12.107 14.827 1.00 10.72 C ATOM 396 O PHE A 66 3.676 -11.764 14.996 1.00 10.56 O ATOM 397 CB PHE A 66 6.610 -10.472 14.078 1.00 9.31 C ATOM 398 CG PHE A 66 6.066 -9.314 14.888 1.00 8.84 C ATOM 399 CD1 PHE A 66 5.621 -9.468 16.139 1.00 10.29 C ATOM 400 CD2 PHE A 66 6.052 -8.018 14.377 1.00 10.14 C ATOM 401 CE1 PHE A 66 5.136 -8.413 16.912 1.00 9.94 C ATOM 402 CE2 PHE A 66 5.531 -6.957 15.084 1.00 9.10 C ATOM 403 CZ PHE A 66 5.075 -7.154 16.371 1.00 9.60 C ATOM 404 H PHE A 66 3.975 -10.500 12.872 1.00 0.00 H ATOM 405 N GLU A 67 5.489 -12.853 15.706 1.00 10.55 N ATOM 406 CA GLU A 67 4.925 -13.336 16.929 1.00 10.77 C ATOM 407 C GLU A 67 5.873 -12.891 18.048 1.00 11.79 C ATOM 408 O GLU A 67 7.080 -13.170 17.998 1.00 14.21 O ATOM 409 CB GLU A 67 4.659 -14.861 16.918 1.00 14.38 C ATOM 410 CG GLU A 67 3.986 -15.400 18.203 1.00 17.48 C ATOM 411 CD GLU A 67 3.509 -16.832 18.076 1.00 21.70 C ATOM 412 OE1 GLU A 67 2.926 -17.182 17.012 1.00 23.22 O ATOM 413 OE2 GLU A 67 3.782 -17.548 19.033 1.00 29.94 O ATOM 414 H GLU A 67 6.477 -13.098 15.491 1.00 0.00 H ATOM 415 N ARG A 68 5.359 -12.181 19.043 1.00 11.29 N ATOM 416 CA ARG A 68 6.101 -11.773 20.223 1.00 11.32 C ATOM 417 C ARG A 68 6.121 -12.930 21.235 1.00 12.61 C ATOM 418 O ARG A 68 5.043 -13.422 21.582 1.00 13.96 O ATOM 419 CB ARG A 68 5.601 -10.494 20.889 1.00 11.81 C ATOM 420 CG ARG A 68 6.442 -9.957 22.003 1.00 11.83 C ATOM 421 CD ARG A 68 5.803 -8.777 22.723 1.00 11.38 C ATOM 422 NE ARG A 68 6.360 -8.485 24.017 1.00 11.43 N ATOM 423 CZ ARG A 68 6.110 -9.176 25.164 1.00 10.68 C ATOM 424 NH1 ARG A 68 5.282 -10.201 25.107 1.00 12.36 N ATOM 425 NH2 ARG A 68 6.606 -8.710 26.249 1.00 12.82 N ATOM 426 HE ARG A 68 7.010 -7.676 24.082 1.00 0.00 H ATOM 427 HH12 ARG A 68 5.072 -10.748 25.966 1.00 0.00 H ATOM 428 HH11 ARG A 68 4.840 -10.462 24.203 1.00 0.00 H ATOM 429 HH22 ARG A 68 6.442 -9.203 27.150 1.00 0.00 H ATOM 430 HH21 ARG A 68 7.173 -7.838 26.229 1.00 0.00 H ATOM 431 H ARG A 68 4.361 -11.898 18.974 1.00 0.00 H ATOM 432 N ARG A 69 7.299 -13.384 21.691 1.00 12.66 N ATOM 433 CA ARG A 69 7.350 -14.454 22.656 1.00 13.62 C ATOM 434 C ARG A 69 6.740 -13.915 23.946 1.00 14.11 C ATOM 435 O ARG A 69 6.738 -12.686 24.261 1.00 12.74 O ATOM 436 CB ARG A 69 8.815 -14.886 22.826 1.00 16.40 C ATOM 437 CG ARG A 69 9.198 -15.705 21.627 1.00 20.64 C ATOM 438 CD ARG A 69 10.447 -16.524 21.805 1.00 27.89 C ATOM 439 NE ARG A 69 11.498 -15.709 21.313 1.00 31.88 N ATOM 440 CZ ARG A 69 11.942 -15.679 20.063 1.00 34.18 C ATOM 441 NH1 ARG A 69 12.837 -14.765 19.801 1.00 31.75 N ATOM 442 NH2 ARG A 69 11.562 -16.531 19.114 1.00 35.99 N ATOM 443 HE ARG A 69 11.964 -15.077 21.995 1.00 0.00 H ATOM 444 HH12 ARG A 69 13.230 -14.682 18.842 1.00 0.00 H ATOM 445 HH11 ARG A 69 13.156 -14.120 20.551 1.00 0.00 H ATOM 446 HH22 ARG A 69 11.952 -16.448 18.154 1.00 0.00 H ATOM 447 HH21 ARG A 69 10.875 -17.280 19.333 1.00 0.00 H ATOM 448 H ARG A 69 8.183 -12.960 21.345 1.00 0.00 H ATOM 449 N PRO A 70 6.291 -14.832 24.842 1.00 14.90 N ATOM 450 CA PRO A 70 5.832 -14.410 26.159 1.00 14.12 C ATOM 451 C PRO A 70 7.010 -14.057 27.038 1.00 16.50 C ATOM 452 O PRO A 70 7.789 -14.970 27.424 1.00 18.01 O ATOM 453 CB PRO A 70 5.040 -15.640 26.626 1.00 14.60 C ATOM 454 CG PRO A 70 5.714 -16.788 25.924 1.00 17.37 C ATOM 455 CD PRO A 70 6.047 -16.265 24.580 1.00 15.08 C ATOM 456 N VAL A 71 7.265 -12.804 27.365 1.00 14.70 N ATOM 457 CA VAL A 71 8.358 -12.284 28.141 1.00 15.25 C ATOM 458 C VAL A 71 7.803 -11.269 29.054 1.00 16.48 C ATOM 459 O VAL A 71 7.237 -10.233 28.613 1.00 13.99 O ATOM 460 CB VAL A 71 9.468 -11.733 27.205 1.00 15.84 C ATOM 461 CG1 VAL A 71 10.548 -11.125 28.008 1.00 16.51 C ATOM 462 CG2 VAL A 71 10.008 -12.809 26.297 1.00 16.09 C ATOM 463 H VAL A 71 6.585 -12.099 27.015 1.00 0.00 H ATOM 464 N ALA A 72 7.920 -11.458 30.365 1.00 15.42 N ATOM 465 CA ALA A 72 7.340 -10.561 31.323 1.00 16.86 C ATOM 466 C ALA A 72 8.181 -9.300 31.425 1.00 14.86 C ATOM 467 O ALA A 72 9.393 -9.317 31.235 1.00 16.56 O ATOM 468 CB ALA A 72 7.323 -11.243 32.709 1.00 21.87 C ATOM 469 H ALA A 72 8.450 -12.284 30.708 1.00 0.00 H ATOM 470 N GLN A 73 7.511 -8.178 31.607 1.00 15.93 N ATOM 471 CA GLN A 73 8.194 -6.924 31.862 1.00 17.90 C ATOM 472 C GLN A 73 9.155 -6.487 30.719 1.00 17.78 C ATOM 473 O GLN A 73 10.318 -6.183 30.859 1.00 17.43 O ATOM 474 CB GLN A 73 8.954 -6.973 33.204 1.00 19.11 C ATOM 475 CG GLN A 73 7.954 -7.123 34.368 1.00 20.62 C ATOM 476 CD GLN A 73 7.042 -5.924 34.487 1.00 21.25 C ATOM 477 OE1 GLN A 73 7.450 -4.807 34.327 1.00 24.50 O ATOM 478 NE2 GLN A 73 5.800 -6.164 34.814 1.00 26.58 N ATOM 479 HE22 GLN A 73 5.477 -7.144 34.946 1.00 0.00 H ATOM 480 HE21 GLN A 73 5.134 -5.375 34.943 1.00 0.00 H ATOM 481 H GLN A 73 6.472 -8.193 31.567 1.00 0.00 H ATOM 482 N SER A 74 8.606 -6.511 29.518 1.00 15.20 N ATOM 483 CA SER A 74 9.333 -6.150 28.307 1.00 13.92 C ATOM 484 C SER A 74 8.339 -5.496 27.305 1.00 12.09 C ATOM 485 O SER A 74 7.223 -6.007 27.146 1.00 12.93 O ATOM 486 CB SER A 74 9.878 -7.399 27.621 1.00 13.04 C ATOM 487 OG SER A 74 10.723 -7.092 26.497 1.00 13.97 O ATOM 488 HG SER A 74 10.205 -6.579 25.827 1.00 0.00 H ATOM 489 H SER A 74 7.611 -6.800 29.432 1.00 0.00 H ATOM 490 N THR A 75 8.851 -4.510 26.582 1.00 11.87 N ATOM 491 CA THR A 75 8.170 -4.022 25.340 1.00 11.12 C ATOM 492 C THR A 75 9.142 -4.202 24.199 1.00 10.60 C ATOM 493 O THR A 75 10.350 -4.038 24.300 1.00 11.14 O ATOM 494 CB THR A 75 7.834 -2.565 25.492 1.00 11.09 C ATOM 495 OG1 THR A 75 7.098 -2.287 26.699 1.00 11.34 O ATOM 496 CG2 THR A 75 6.982 -1.966 24.352 1.00 10.71 C ATOM 497 HG1 THR A 75 7.638 -2.558 27.483 1.00 0.00 H ATOM 498 H THR A 75 9.742 -4.067 26.883 1.00 0.00 H ATOM 499 N ASP A 76 8.561 -4.595 23.067 1.00 9.91 N ATOM 500 CA ASP A 76 9.312 -5.173 21.983 1.00 9.84 C ATOM 501 C ASP A 76 8.857 -4.618 20.677 1.00 10.58 C ATOM 502 O ASP A 76 7.648 -4.664 20.424 1.00 11.63 O ATOM 503 CB ASP A 76 9.184 -6.683 22.094 1.00 10.32 C ATOM 504 CG ASP A 76 9.804 -7.173 23.420 1.00 12.11 C ATOM 505 OD1 ASP A 76 11.052 -7.378 23.408 1.00 11.37 O ATOM 506 OD2 ASP A 76 9.012 -7.332 24.344 1.00 12.06 O ATOM 507 H ASP A 76 7.533 -4.481 22.963 1.00 0.00 H ATOM 508 N GLY A 77 9.802 -4.148 19.874 1.00 9.21 N ATOM 509 CA GLY A 77 9.447 -3.612 18.521 1.00 10.20 C ATOM 510 C GLY A 77 9.990 -4.349 17.363 1.00 11.04 C ATOM 511 O GLY A 77 10.927 -5.173 17.492 1.00 9.30 O ATOM 512 H GLY A 77 10.794 -4.152 20.185 1.00 0.00 H ATOM 513 N ALA A 78 9.500 -4.022 16.174 1.00 10.08 N ATOM 514 CA ALA A 78 10.044 -4.577 14.949 1.00 9.90 C ATOM 515 C ALA A 78 9.996 -3.465 13.907 1.00 8.74 C ATOM 516 O ALA A 78 9.093 -2.565 13.948 1.00 8.68 O ATOM 517 CB ALA A 78 9.113 -5.709 14.494 1.00 10.58 C ATOM 518 H ALA A 78 8.707 -3.352 16.119 1.00 0.00 H ATOM 519 N ARG A 79 10.947 -3.471 12.987 1.00 8.55 N ATOM 520 CA ARG A 79 10.915 -2.650 11.778 1.00 7.22 C ATOM 521 C ARG A 79 10.721 -3.469 10.527 1.00 8.01 C ATOM 522 O ARG A 79 11.182 -4.616 10.421 1.00 8.12 O ATOM 523 CB ARG A 79 12.218 -1.792 11.579 1.00 8.16 C ATOM 524 CG ARG A 79 12.266 -0.552 12.426 1.00 9.18 C ATOM 525 CD ARG A 79 13.500 0.365 12.197 1.00 8.86 C ATOM 526 NE ARG A 79 14.704 -0.308 12.789 1.00 9.72 N ATOM 527 CZ ARG A 79 15.191 0.008 13.992 1.00 9.89 C ATOM 528 NH1 ARG A 79 16.097 -0.813 14.508 1.00 10.76 N ATOM 529 NH2 ARG A 79 14.752 1.022 14.672 1.00 9.58 N ATOM 530 HE ARG A 79 15.179 -1.052 12.239 1.00 0.00 H ATOM 531 HH12 ARG A 79 16.508 -0.613 15.442 1.00 0.00 H ATOM 532 HH11 ARG A 79 16.396 -1.657 13.978 1.00 0.00 H ATOM 533 HH22 ARG A 79 15.157 1.236 15.606 1.00 0.00 H ATOM 534 HH21 ARG A 79 13.996 1.621 14.283 1.00 0.00 H ATOM 535 H ARG A 79 11.765 -4.096 13.133 1.00 0.00 H ATOM 536 N GLY A 80 10.123 -2.791 9.555 1.00 6.95 N ATOM 537 CA GLY A 80 10.086 -3.368 8.224 1.00 7.52 C ATOM 538 C GLY A 80 11.433 -3.410 7.604 1.00 7.94 C ATOM 539 O GLY A 80 12.352 -2.692 7.981 1.00 9.02 O ATOM 540 H GLY A 80 9.690 -1.865 9.744 1.00 0.00 H ATOM 541 N LYS A 81 11.531 -4.219 6.549 1.00 8.76 N ATOM 542 CA LYS A 81 12.790 -4.349 5.798 1.00 9.55 C ATOM 543 C LYS A 81 13.193 -3.156 5.008 1.00 10.75 C ATOM 544 O LYS A 81 14.426 -2.963 4.710 1.00 11.23 O ATOM 545 CB LYS A 81 12.641 -5.529 4.796 1.00 10.04 C ATOM 546 CG LYS A 81 12.609 -6.878 5.464 1.00 9.78 C ATOM 547 CD LYS A 81 12.193 -7.964 4.425 1.00 11.49 C ATOM 548 CE LYS A 81 12.078 -9.360 5.041 1.00 12.40 C ATOM 549 NZ LYS A 81 11.648 -10.322 4.058 1.00 13.95 N ATOM 550 HZ1 LYS A 81 10.718 -10.043 3.685 1.00 0.00 H ATOM 551 HZ2 LYS A 81 12.339 -10.355 3.281 1.00 0.00 H ATOM 552 HZ3 LYS A 81 11.578 -11.260 4.501 1.00 0.00 H ATOM 553 H LYS A 81 10.701 -4.770 6.251 1.00 0.00 H ATOM 554 N ARG A 82 12.261 -2.343 4.605 1.00 10.86 N ATOM 555 CA ARG A 82 12.505 -1.218 3.645 1.00 12.66 C ATOM 556 C ARG A 82 12.178 0.108 4.298 1.00 12.58 C ATOM 557 O ARG A 82 11.109 0.284 4.862 1.00 11.79 O ATOM 558 CB ARG A 82 11.654 -1.429 2.423 1.00 13.94 C ATOM 559 CG ARG A 82 12.022 -2.658 1.672 1.00 17.31 C ATOM 560 CD ARG A 82 13.232 -2.527 0.816 1.00 23.98 C ATOM 561 NE ARG A 82 12.935 -1.590 -0.274 1.00 30.51 N ATOM 562 CZ ARG A 82 12.367 -1.876 -1.452 1.00 30.84 C ATOM 563 NH1 ARG A 82 12.049 -3.112 -1.811 1.00 34.22 N ATOM 564 NH2 ARG A 82 12.171 -0.878 -2.321 1.00 37.74 N ATOM 565 HE ARG A 82 13.194 -0.596 -0.114 1.00 0.00 H ATOM 566 HH12 ARG A 82 11.609 -3.288 -2.737 1.00 0.00 H ATOM 567 HH11 ARG A 82 12.240 -3.906 -1.167 1.00 0.00 H ATOM 568 HH22 ARG A 82 11.732 -1.071 -3.244 1.00 0.00 H ATOM 569 HH21 ARG A 82 12.458 0.091 -2.074 1.00 0.00 H ATOM 570 H ARG A 82 11.296 -2.481 4.968 1.00 0.00 H ATOM 571 N GLY A 83 13.125 1.061 4.216 1.00 11.85 N ATOM 572 CA GLY A 83 12.970 2.407 4.708 1.00 11.11 C ATOM 573 C GLY A 83 12.614 3.333 3.584 1.00 11.75 C ATOM 574 O GLY A 83 13.197 3.229 2.525 1.00 14.77 O ATOM 575 H GLY A 83 14.029 0.809 3.768 1.00 0.00 H ATOM 576 N TYR A 84 11.704 4.258 3.888 1.00 10.98 N ATOM 577 CA TYR A 84 11.114 5.108 2.832 1.00 12.43 C ATOM 578 C TYR A 84 11.595 6.524 3.087 1.00 12.32 C ATOM 579 O TYR A 84 11.503 7.053 4.211 1.00 11.05 O ATOM 580 CB TYR A 84 9.588 4.979 2.939 1.00 11.39 C ATOM 581 CG TYR A 84 9.145 3.532 2.857 1.00 11.39 C ATOM 582 CD1 TYR A 84 9.577 2.704 1.846 1.00 11.99 C ATOM 583 CD2 TYR A 84 8.228 3.024 3.800 1.00 11.94 C ATOM 584 CE1 TYR A 84 9.162 1.374 1.772 1.00 12.53 C ATOM 585 CE2 TYR A 84 7.792 1.750 3.743 1.00 11.08 C ATOM 586 CZ TYR A 84 8.289 0.890 2.748 1.00 12.62 C ATOM 587 OH TYR A 84 7.902 -0.428 2.739 1.00 12.51 O ATOM 588 HH TYR A 84 8.337 -0.893 1.981 1.00 0.00 H ATOM 589 H TYR A 84 11.406 4.383 4.877 1.00 0.00 H ATOM 590 N SER A 85 12.012 7.206 1.992 1.00 13.95 N ATOM 591 CA SER A 85 12.493 8.578 2.011 1.00 15.13 C ATOM 592 C SER A 85 11.782 9.528 1.034 1.00 14.14 C ATOM 593 O SER A 85 11.953 10.741 1.225 1.00 15.95 O ATOM 594 CB SER A 85 13.978 8.599 1.770 1.00 16.97 C ATOM 595 OG SER A 85 14.357 8.091 0.537 1.00 19.94 O ATOM 596 HG SER A 85 15.342 8.137 0.451 1.00 0.00 H ATOM 597 H SER A 85 11.986 6.714 1.076 1.00 0.00 H ATOM 598 N ARG A 86 11.036 8.965 0.095 1.00 14.58 N ATOM 599 CA ARG A 86 10.368 9.713 -0.978 1.00 16.82 C ATOM 600 C ARG A 86 9.067 9.097 -1.340 1.00 15.75 C ATOM 601 O ARG A 86 8.881 7.903 -1.048 1.00 18.31 O ATOM 602 CB ARG A 86 11.245 9.706 -2.265 1.00 19.90 C ATOM 603 CG ARG A 86 12.624 10.294 -2.179 1.00 24.48 C ATOM 604 CD ARG A 86 12.717 11.758 -1.706 1.00 28.88 C ATOM 605 NE ARG A 86 11.739 12.704 -2.298 1.00 35.91 N ATOM 606 CZ ARG A 86 11.906 13.401 -3.430 1.00 43.71 C ATOM 607 NH1 ARG A 86 13.018 13.296 -4.159 1.00 45.07 N ATOM 608 NH2 ARG A 86 10.949 14.225 -3.842 1.00 44.33 N ATOM 609 HE ARG A 86 10.843 12.838 -1.788 1.00 0.00 H ATOM 610 HH12 ARG A 86 13.121 13.849 -5.034 1.00 0.00 H ATOM 611 HH11 ARG A 86 13.783 12.661 -3.853 1.00 0.00 H ATOM 612 HH22 ARG A 86 11.073 14.769 -4.720 1.00 0.00 H ATOM 613 HH21 ARG A 86 10.076 14.327 -3.287 1.00 0.00 H ATOM 614 H ARG A 86 10.916 7.932 0.119 1.00 0.00 H ATOM 615 N GLY A 87 8.143 9.896 -1.862 1.00 14.89 N ATOM 616 CA GLY A 87 6.889 9.380 -2.329 1.00 15.72 C ATOM 617 C GLY A 87 5.926 8.982 -1.254 1.00 13.74 C ATOM 618 O GLY A 87 6.106 9.292 -0.073 1.00 17.30 O ATOM 619 H GLY A 87 8.333 10.916 -1.933 1.00 0.00 H ATOM 620 N LEU A 88 4.952 8.263 -1.694 1.00 13.15 N ATOM 621 CA LEU A 88 3.827 7.844 -0.856 1.00 12.98 C ATOM 622 C LEU A 88 3.929 6.341 -0.685 1.00 13.15 C ATOM 623 O LEU A 88 4.061 5.617 -1.676 1.00 12.13 O ATOM 624 CB LEU A 88 2.485 8.168 -1.516 1.00 13.00 C ATOM 625 CG LEU A 88 1.245 7.777 -0.754 1.00 12.70 C ATOM 626 CD1 LEU A 88 1.167 8.544 0.596 1.00 12.26 C ATOM 627 CD2 LEU A 88 -0.040 8.013 -1.594 1.00 13.16 C ATOM 628 H LEU A 88 4.965 7.966 -2.691 1.00 0.00 H ATOM 629 N HIS A 89 3.777 5.855 0.549 1.00 11.33 N ATOM 630 CA HIS A 89 3.763 4.411 0.841 1.00 11.46 C ATOM 631 C HIS A 89 2.688 4.141 1.835 1.00 10.70 C ATOM 632 O HIS A 89 2.384 4.975 2.737 1.00 11.17 O ATOM 633 CB HIS A 89 5.116 3.897 1.442 1.00 13.60 C ATOM 634 CG HIS A 89 6.296 4.149 0.581 1.00 14.98 C ATOM 635 ND1 HIS A 89 6.863 3.204 -0.230 1.00 18.32 N ATOM 636 CD2 HIS A 89 6.987 5.303 0.367 1.00 15.98 C ATOM 637 CE1 HIS A 89 7.848 3.771 -0.928 1.00 18.35 C ATOM 638 NE2 HIS A 89 7.962 5.016 -0.525 1.00 19.28 N ATOM 639 H HIS A 89 3.664 6.524 1.337 1.00 0.00 H ATOM 640 N ALA A 90 2.043 3.008 1.674 1.00 11.31 N ATOM 641 CA ALA A 90 1.036 2.619 2.633 1.00 11.40 C ATOM 642 C ALA A 90 1.100 1.107 2.938 1.00 9.67 C ATOM 643 O ALA A 90 1.524 0.326 2.062 1.00 10.30 O ATOM 644 CB ALA A 90 -0.345 3.019 2.213 1.00 12.26 C ATOM 645 H ALA A 90 2.256 2.395 0.861 1.00 0.00 H ATOM 646 N TRP A 91 0.650 0.712 4.124 1.00 9.28 N ATOM 647 CA TRP A 91 0.641 -0.673 4.530 1.00 8.93 C ATOM 648 C TRP A 91 -0.455 -0.886 5.529 1.00 9.44 C ATOM 649 O TRP A 91 -0.769 0.004 6.317 1.00 9.74 O ATOM 650 CB TRP A 91 1.985 -1.157 5.046 1.00 8.70 C ATOM 651 CG TRP A 91 2.534 -0.357 6.221 1.00 8.37 C ATOM 652 CD1 TRP A 91 2.419 -0.661 7.551 1.00 8.33 C ATOM 653 CD2 TRP A 91 3.351 0.832 6.166 1.00 8.26 C ATOM 654 NE1 TRP A 91 3.013 0.281 8.371 1.00 7.81 N ATOM 655 CE2 TRP A 91 3.603 1.208 7.502 1.00 7.68 C ATOM 656 CE3 TRP A 91 3.866 1.642 5.109 1.00 8.87 C ATOM 657 CZ2 TRP A 91 4.396 2.323 7.792 1.00 8.17 C ATOM 658 CZ3 TRP A 91 4.642 2.722 5.421 1.00 9.49 C ATOM 659 CH2 TRP A 91 4.846 3.116 6.741 1.00 8.70 C ATOM 660 HE1 TRP A 91 3.020 0.298 9.411 1.00 0.00 H ATOM 661 H TRP A 91 0.290 1.429 4.786 1.00 0.00 H ATOM 662 N GLU A 92 -1.028 -2.071 5.526 1.00 10.01 N ATOM 663 CA GLU A 92 -2.055 -2.432 6.502 1.00 9.48 C ATOM 664 C GLU A 92 -1.460 -3.194 7.635 1.00 9.74 C ATOM 665 O GLU A 92 -0.674 -4.153 7.382 1.00 12.37 O ATOM 666 CB GLU A 92 -3.096 -3.301 5.844 1.00 11.48 C ATOM 667 CG GLU A 92 -4.246 -3.856 6.662 1.00 14.61 C ATOM 668 CD GLU A 92 -5.004 -4.957 5.880 1.00 18.21 C ATOM 669 OE1 GLU A 92 -4.497 -6.117 5.710 1.00 17.71 O ATOM 670 OE2 GLU A 92 -6.017 -4.564 5.412 1.00 23.56 O ATOM 671 H GLU A 92 -0.743 -2.769 4.810 1.00 0.00 H ATOM 672 N ILE A 93 -1.756 -2.817 8.858 1.00 8.89 N ATOM 673 CA ILE A 93 -1.381 -3.560 10.036 1.00 7.72 C ATOM 674 C ILE A 93 -2.630 -4.319 10.502 1.00 8.20 C ATOM 675 O ILE A 93 -3.724 -3.751 10.592 1.00 9.11 O ATOM 676 CB ILE A 93 -0.889 -2.595 11.164 1.00 7.78 C ATOM 677 CG1 ILE A 93 0.424 -1.976 10.722 1.00 8.05 C ATOM 678 CG2 ILE A 93 -0.780 -3.337 12.481 1.00 8.80 C ATOM 679 CD1 ILE A 93 1.554 -2.934 10.695 1.00 8.37 C ATOM 680 H ILE A 93 -2.290 -1.934 8.984 1.00 0.00 H ATOM 681 N SER A 94 -2.501 -5.607 10.849 1.00 8.01 N ATOM 682 CA SER A 94 -3.586 -6.431 11.408 1.00 8.41 C ATOM 683 C SER A 94 -3.149 -6.851 12.754 1.00 9.48 C ATOM 684 O SER A 94 -2.095 -7.585 12.869 1.00 9.44 O ATOM 685 CB SER A 94 -3.883 -7.625 10.514 1.00 10.94 C ATOM 686 OG SER A 94 -4.357 -7.279 9.286 1.00 16.34 O ATOM 687 HG SER A 94 -3.686 -6.719 8.820 1.00 0.00 H ATOM 688 H SER A 94 -1.572 -6.055 10.714 1.00 0.00 H ATOM 689 N TRP A 95 -3.867 -6.453 13.805 1.00 9.63 N ATOM 690 CA TRP A 95 -3.424 -6.645 15.229 1.00 9.87 C ATOM 691 C TRP A 95 -4.683 -6.974 15.987 1.00 11.21 C ATOM 692 O TRP A 95 -5.522 -6.155 16.293 1.00 10.17 O ATOM 693 CB TRP A 95 -2.790 -5.396 15.781 1.00 9.00 C ATOM 694 CG TRP A 95 -2.058 -5.596 17.049 1.00 9.77 C ATOM 695 CD1 TRP A 95 -2.197 -6.609 17.983 1.00 10.14 C ATOM 696 CD2 TRP A 95 -0.995 -4.787 17.515 1.00 8.40 C ATOM 697 NE1 TRP A 95 -1.305 -6.473 18.965 1.00 10.19 N ATOM 698 CE2 TRP A 95 -0.516 -5.363 18.710 1.00 9.77 C ATOM 699 CE3 TRP A 95 -0.331 -3.657 16.982 1.00 9.30 C ATOM 700 CZ2 TRP A 95 0.510 -4.796 19.417 1.00 9.40 C ATOM 701 CZ3 TRP A 95 0.721 -3.107 17.703 1.00 9.72 C ATOM 702 CH2 TRP A 95 1.134 -3.689 18.897 1.00 9.01 C ATOM 703 HE1 TRP A 95 -1.216 -7.100 19.790 1.00 0.00 H ATOM 704 H TRP A 95 -4.780 -5.986 13.631 1.00 0.00 H ATOM 705 N PRO A 96 -4.899 -8.276 16.222 1.00 11.55 N ATOM 706 CA PRO A 96 -6.165 -8.728 16.861 1.00 12.06 C ATOM 707 C PRO A 96 -6.436 -7.966 18.147 1.00 11.98 C ATOM 708 O PRO A 96 -5.522 -7.730 18.963 1.00 10.83 O ATOM 709 CB PRO A 96 -5.859 -10.218 17.144 1.00 13.39 C ATOM 710 CG PRO A 96 -5.039 -10.611 16.026 1.00 13.88 C ATOM 711 CD PRO A 96 -4.068 -9.458 15.876 1.00 12.24 C ATOM 712 N LEU A 97 -7.728 -7.617 18.377 1.00 13.66 N ATOM 713 CA LEU A 97 -8.020 -6.772 19.535 1.00 14.89 C ATOM 714 C LEU A 97 -7.623 -7.360 20.863 1.00 13.82 C ATOM 715 O LEU A 97 -7.177 -6.678 21.790 1.00 15.36 O ATOM 716 CB LEU A 97 -9.513 -6.352 19.558 1.00 16.44 C ATOM 717 CG LEU A 97 -9.740 -4.939 18.931 1.00 19.96 C ATOM 718 CD1 LEU A 97 -9.398 -5.019 17.464 1.00 22.17 C ATOM 719 CD2 LEU A 97 -11.184 -4.553 19.152 1.00 22.07 C ATOM 720 H LEU A 97 -8.489 -7.942 17.747 1.00 0.00 H ATOM 721 N GLU A 98 -7.776 -8.694 20.937 1.00 13.44 N ATOM 722 CA GLU A 98 -7.465 -9.385 22.152 1.00 14.43 C ATOM 723 C GLU A 98 -5.998 -9.635 22.382 1.00 15.04 C ATOM 724 O GLU A 98 -5.612 -10.292 23.355 1.00 16.25 O ATOM 725 CB GLU A 98 -8.299 -10.707 22.216 1.00 17.40 C ATOM 726 CG GLU A 98 -7.798 -11.798 21.333 1.00 21.08 C ATOM 727 CD GLU A 98 -8.046 -11.745 19.820 1.00 26.63 C ATOM 728 OE1 GLU A 98 -8.723 -10.794 19.161 1.00 25.65 O ATOM 729 OE2 GLU A 98 -7.509 -12.820 19.304 1.00 33.17 O ATOM 730 H GLU A 98 -8.120 -9.224 20.111 1.00 0.00 H ATOM 731 N GLN A 99 -5.147 -9.197 21.471 1.00 12.50 N ATOM 732 CA GLN A 99 -3.713 -9.426 21.540 1.00 12.20 C ATOM 733 C GLN A 99 -2.980 -8.106 21.723 1.00 10.63 C ATOM 734 O GLN A 99 -1.752 -7.991 21.394 1.00 11.36 O ATOM 735 CB GLN A 99 -3.222 -10.173 20.360 1.00 12.26 C ATOM 736 CG GLN A 99 -3.845 -11.574 20.177 1.00 13.33 C ATOM 737 CD GLN A 99 -3.405 -12.215 18.879 1.00 15.88 C ATOM 738 OE1 GLN A 99 -2.403 -11.864 18.333 1.00 17.05 O ATOM 739 NE2 GLN A 99 -4.138 -13.181 18.393 1.00 18.72 N ATOM 740 HE22 GLN A 99 -5.007 -13.472 18.884 1.00 0.00 H ATOM 741 HE21 GLN A 99 -3.852 -13.659 17.515 1.00 0.00 H ATOM 742 H GLN A 99 -5.522 -8.661 20.663 1.00 0.00 H ATOM 743 N ARG A 100 -3.626 -7.075 22.259 1.00 10.33 N ATOM 744 CA ARG A 100 -2.958 -5.758 22.362 1.00 11.08 C ATOM 745 C ARG A 100 -2.465 -5.444 23.764 1.00 12.18 C ATOM 746 O ARG A 100 -1.425 -4.809 23.890 1.00 12.52 O ATOM 747 CB ARG A 100 -3.910 -4.641 21.893 1.00 10.82 C ATOM 748 CG ARG A 100 -4.217 -4.760 20.402 1.00 11.15 C ATOM 749 CD ARG A 100 -5.289 -3.850 19.967 1.00 11.49 C ATOM 750 NE ARG A 100 -5.540 -4.042 18.548 1.00 10.66 N ATOM 751 CZ ARG A 100 -6.276 -3.241 17.816 1.00 10.49 C ATOM 752 NH1 ARG A 100 -6.392 -3.459 16.525 1.00 11.48 N ATOM 753 NH2 ARG A 100 -6.989 -2.263 18.370 1.00 11.69 N ATOM 754 HE ARG A 100 -5.109 -4.867 18.084 1.00 0.00 H ATOM 755 HH12 ARG A 100 -6.975 -2.826 15.941 1.00 0.00 H ATOM 756 HH11 ARG A 100 -5.901 -4.265 16.087 1.00 0.00 H ATOM 757 HH22 ARG A 100 -7.567 -1.638 17.772 1.00 0.00 H ATOM 758 HH21 ARG A 100 -6.968 -2.124 19.400 1.00 0.00 H ATOM 759 H ARG A 100 -4.599 -7.194 22.605 1.00 0.00 H ATOM 760 N GLY A 101 -3.082 -5.932 24.843 1.00 14.16 N ATOM 761 CA GLY A 101 -2.537 -5.654 26.127 1.00 12.73 C ATOM 762 C GLY A 101 -2.516 -4.190 26.456 1.00 13.07 C ATOM 763 O GLY A 101 -3.398 -3.374 26.001 1.00 13.04 O ATOM 764 H GLY A 101 -3.945 -6.505 24.746 1.00 0.00 H ATOM 765 N THR A 102 -1.612 -3.787 27.322 1.00 12.16 N ATOM 766 CA THR A 102 -1.632 -2.494 27.867 1.00 12.08 C ATOM 767 C THR A 102 -1.014 -1.388 26.974 1.00 12.59 C ATOM 768 O THR A 102 -1.313 -0.218 27.192 1.00 14.06 O ATOM 769 CB THR A 102 -0.846 -2.462 29.236 1.00 13.59 C ATOM 770 OG1 THR A 102 0.516 -2.836 29.029 1.00 13.37 O ATOM 771 CG2 THR A 102 -1.461 -3.381 30.194 1.00 14.72 C ATOM 772 HG1 THR A 102 0.938 -2.202 28.396 1.00 0.00 H ATOM 773 H THR A 102 -0.861 -4.445 27.611 1.00 0.00 H ATOM 774 N HIS A 103 -0.162 -1.780 26.055 1.00 12.09 N ATOM 775 CA HIS A 103 0.566 -0.803 25.176 1.00 11.85 C ATOM 776 C HIS A 103 0.776 -1.370 23.800 1.00 10.99 C ATOM 777 O HIS A 103 1.689 -2.158 23.581 1.00 10.92 O ATOM 778 CB HIS A 103 1.891 -0.366 25.766 1.00 13.19 C ATOM 779 CG HIS A 103 1.810 0.234 27.139 1.00 13.43 C ATOM 780 ND1 HIS A 103 1.811 -0.549 28.280 1.00 13.61 N ATOM 781 CD2 HIS A 103 1.796 1.518 27.530 1.00 15.08 C ATOM 782 CE1 HIS A 103 1.757 0.284 29.328 1.00 15.80 C ATOM 783 NE2 HIS A 103 1.738 1.528 28.894 1.00 17.30 N ATOM 784 H HIS A 103 0.014 -2.798 25.932 1.00 0.00 H ATOM 785 N ALA A 104 -0.043 -0.934 22.820 1.00 9.40 N ATOM 786 CA ALA A 104 -0.020 -1.379 21.428 1.00 9.45 C ATOM 787 C ALA A 104 0.150 -0.121 20.598 1.00 8.10 C ATOM 788 O ALA A 104 -0.789 0.726 20.563 1.00 9.39 O ATOM 789 CB ALA A 104 -1.272 -2.153 21.011 1.00 10.17 C ATOM 790 H ALA A 104 -0.753 -0.219 23.078 1.00 0.00 H ATOM 791 N VAL A 105 1.335 0.077 19.968 1.00 7.96 N ATOM 792 CA VAL A 105 1.666 1.347 19.293 1.00 8.44 C ATOM 793 C VAL A 105 2.053 1.062 17.881 1.00 7.42 C ATOM 794 O VAL A 105 2.857 0.160 17.624 1.00 8.24 O ATOM 795 CB VAL A 105 2.730 2.114 20.037 1.00 9.45 C ATOM 796 CG1 VAL A 105 2.863 3.489 19.400 1.00 9.06 C ATOM 797 CG2 VAL A 105 2.355 2.221 21.505 1.00 9.98 C ATOM 798 H VAL A 105 2.034 -0.693 19.960 1.00 0.00 H ATOM 799 N VAL A 106 1.509 1.828 16.923 1.00 7.52 N ATOM 800 CA VAL A 106 1.672 1.596 15.520 1.00 7.89 C ATOM 801 C VAL A 106 2.236 2.825 14.815 1.00 7.92 C ATOM 802 O VAL A 106 1.603 3.922 14.962 1.00 8.16 O ATOM 803 CB VAL A 106 0.340 1.187 14.843 1.00 8.20 C ATOM 804 CG1 VAL A 106 0.485 1.027 13.362 1.00 8.58 C ATOM 805 CG2 VAL A 106 -0.227 -0.084 15.480 1.00 8.76 C ATOM 806 H VAL A 106 0.933 2.642 17.219 1.00 0.00 H ATOM 807 N GLY A 107 3.323 2.789 14.075 1.00 7.92 N ATOM 808 CA GLY A 107 3.844 3.989 13.420 1.00 7.19 C ATOM 809 C GLY A 107 5.048 3.672 12.572 1.00 7.50 C ATOM 810 O GLY A 107 4.978 2.795 11.714 1.00 7.16 O ATOM 811 H GLY A 107 3.824 1.886 13.953 1.00 0.00 H ATOM 812 N VAL A 108 6.049 4.545 12.710 1.00 7.05 N ATOM 813 CA VAL A 108 7.275 4.395 11.943 1.00 7.14 C ATOM 814 C VAL A 108 8.437 4.703 12.883 1.00 7.48 C ATOM 815 O VAL A 108 8.287 5.302 13.949 1.00 7.54 O ATOM 816 CB VAL A 108 7.363 5.326 10.696 1.00 7.92 C ATOM 817 CG1 VAL A 108 6.269 4.970 9.738 1.00 8.04 C ATOM 818 CG2 VAL A 108 7.347 6.802 11.077 1.00 7.61 C ATOM 819 H VAL A 108 5.951 5.340 13.373 1.00 0.00 H ATOM 820 N ALA A 109 9.642 4.319 12.429 1.00 7.88 N ATOM 821 CA ALA A 109 10.884 4.599 13.206 1.00 8.06 C ATOM 822 C ALA A 109 12.001 4.779 12.200 1.00 8.81 C ATOM 823 O ALA A 109 12.028 4.238 11.090 1.00 9.12 O ATOM 824 CB ALA A 109 11.214 3.440 14.073 1.00 8.66 C ATOM 825 H ALA A 109 9.710 3.818 11.520 1.00 0.00 H ATOM 826 N THR A 110 12.996 5.558 12.657 1.00 9.20 N ATOM 827 CA THR A 110 14.248 5.541 11.962 1.00 9.34 C ATOM 828 C THR A 110 14.963 4.217 12.215 1.00 9.56 C ATOM 829 O THR A 110 14.569 3.441 13.081 1.00 9.28 O ATOM 830 CB THR A 110 15.207 6.694 12.446 1.00 9.94 C ATOM 831 OG1 THR A 110 15.745 6.269 13.670 1.00 9.91 O ATOM 832 CG2 THR A 110 14.453 8.004 12.492 1.00 11.54 C ATOM 833 HG1 THR A 110 16.359 6.963 14.018 1.00 0.00 H ATOM 834 H THR A 110 12.860 6.159 13.495 1.00 0.00 H ATOM 835 N ALA A 111 16.057 3.961 11.507 1.00 9.54 N ATOM 836 CA ALA A 111 16.895 2.811 11.702 1.00 9.87 C ATOM 837 C ALA A 111 17.570 2.725 13.056 1.00 8.99 C ATOM 838 O ALA A 111 18.119 1.682 13.408 1.00 10.58 O ATOM 839 CB ALA A 111 17.946 2.621 10.621 1.00 11.68 C ATOM 840 H ALA A 111 16.324 4.637 10.763 1.00 0.00 H ATOM 841 N LEU A 112 17.564 3.794 13.807 1.00 9.77 N ATOM 842 CA LEU A 112 18.237 3.838 15.067 1.00 10.37 C ATOM 843 C LEU A 112 17.384 3.748 16.336 1.00 10.73 C ATOM 844 O LEU A 112 17.870 3.677 17.455 1.00 10.48 O ATOM 845 CB LEU A 112 19.074 5.127 15.176 1.00 12.70 C ATOM 846 CG LEU A 112 20.375 5.138 14.421 1.00 14.69 C ATOM 847 CD1 LEU A 112 20.926 6.588 14.406 1.00 17.04 C ATOM 848 CD2 LEU A 112 21.368 4.118 14.945 1.00 18.10 C ATOM 849 H LEU A 112 17.054 4.639 13.478 1.00 0.00 H ATOM 850 N ALA A 113 16.061 3.692 16.149 1.00 9.45 N ATOM 851 CA ALA A 113 15.160 3.623 17.318 1.00 10.03 C ATOM 852 C ALA A 113 15.414 2.347 18.096 1.00 10.04 C ATOM 853 O ALA A 113 15.467 1.281 17.443 1.00 10.22 O ATOM 854 CB ALA A 113 13.729 3.729 16.926 1.00 9.68 C ATOM 855 H ALA A 113 15.668 3.697 15.186 1.00 0.00 H ATOM 856 N PRO A 114 15.430 2.397 19.380 1.00 10.06 N ATOM 857 CA PRO A 114 15.496 1.140 20.191 1.00 11.51 C ATOM 858 C PRO A 114 14.269 0.307 20.007 1.00 10.11 C ATOM 859 O PRO A 114 13.147 0.798 20.016 1.00 11.32 O ATOM 860 CB PRO A 114 15.590 1.644 21.619 1.00 12.84 C ATOM 861 CG PRO A 114 15.819 3.074 21.544 1.00 18.05 C ATOM 862 CD PRO A 114 15.504 3.605 20.231 1.00 12.73 C ATOM 863 N LEU A 115 14.480 -0.988 20.038 1.00 10.55 N ATOM 864 CA LEU A 115 13.417 -1.969 19.806 1.00 11.47 C ATOM 865 C LEU A 115 13.071 -2.795 21.031 1.00 10.24 C ATOM 866 O LEU A 115 12.213 -3.695 20.921 1.00 11.49 O ATOM 867 CB LEU A 115 13.828 -2.905 18.657 1.00 15.64 C ATOM 868 CG LEU A 115 14.215 -2.315 17.313 1.00 19.96 C ATOM 869 CD1 LEU A 115 14.926 -3.436 16.478 1.00 21.98 C ATOM 870 CD2 LEU A 115 12.981 -1.728 16.761 1.00 23.19 C ATOM 871 H LEU A 115 15.441 -1.332 20.235 1.00 0.00 H ATOM 872 N GLN A 116 13.681 -2.526 22.186 1.00 11.62 N ATOM 873 CA GLN A 116 13.362 -3.302 23.363 1.00 12.47 C ATOM 874 C GLN A 116 13.585 -2.466 24.608 1.00 13.33 C ATOM 875 O GLN A 116 14.538 -1.701 24.619 1.00 14.64 O ATOM 876 CB GLN A 116 14.195 -4.614 23.383 1.00 14.72 C ATOM 877 CG GLN A 116 13.689 -5.693 24.366 1.00 14.73 C ATOM 878 CD GLN A 116 14.172 -5.442 25.809 1.00 18.31 C ATOM 879 OE1 GLN A 116 15.270 -4.922 25.986 1.00 18.48 O ATOM 880 NE2 GLN A 116 13.385 -5.876 26.815 1.00 17.36 N ATOM 881 HE22 GLN A 116 12.463 -6.309 26.604 1.00 0.00 H ATOM 882 HE21 GLN A 116 13.700 -5.777 27.801 1.00 0.00 H ATOM 883 H GLN A 116 14.383 -1.761 22.240 1.00 0.00 H ATOM 884 N THR A 117 12.710 -2.627 25.605 1.00 13.46 N ATOM 885 CA THR A 117 12.948 -2.005 26.883 1.00 14.22 C ATOM 886 C THR A 117 12.345 -2.925 27.939 1.00 15.11 C ATOM 887 O THR A 117 11.349 -3.647 27.728 1.00 13.96 O ATOM 888 CB THR A 117 12.429 -0.594 26.891 1.00 15.80 C ATOM 889 OG1 THR A 117 12.842 0.055 28.109 1.00 18.39 O ATOM 890 CG2 THR A 117 11.008 -0.511 26.848 1.00 14.45 C ATOM 891 HG1 THR A 117 12.502 0.985 28.118 1.00 0.00 H ATOM 892 H THR A 117 11.856 -3.202 25.458 1.00 0.00 H ATOM 893 N ASP A 118 12.980 -2.915 29.127 1.00 18.50 N ATOM 894 CA ASP A 118 12.579 -3.807 30.215 1.00 19.42 C ATOM 895 C ASP A 118 11.404 -3.349 31.122 1.00 21.26 C ATOM 896 O ASP A 118 11.413 -3.541 32.359 1.00 20.34 O ATOM 897 CB ASP A 118 13.821 -4.117 31.118 1.00 20.73 C ATOM 898 CG ASP A 118 14.853 -5.077 30.438 1.00 25.00 C ATOM 899 OD1 ASP A 118 14.489 -5.886 29.509 1.00 22.46 O ATOM 900 OD2 ASP A 118 16.037 -5.054 30.899 1.00 33.03 O ATOM 901 H ASP A 118 13.773 -2.258 29.274 1.00 0.00 H ATOM 902 N HIS A 119 10.385 -2.756 30.544 1.00 18.05 N ATOM 903 CA HIS A 119 9.152 -2.495 31.265 1.00 18.08 C ATOM 904 C HIS A 119 8.038 -2.393 30.212 1.00 16.60 C ATOM 905 O HIS A 119 8.386 -2.352 29.014 1.00 15.73 O ATOM 906 CB HIS A 119 9.228 -1.257 32.112 1.00 21.13 C ATOM 907 CG HIS A 119 9.631 -0.025 31.394 1.00 21.49 C ATOM 908 ND1 HIS A 119 8.777 1.035 31.215 1.00 26.85 N ATOM 909 CD2 HIS A 119 10.816 0.355 30.863 1.00 22.36 C ATOM 910 CE1 HIS A 119 9.412 2.016 30.587 1.00 23.96 C ATOM 911 NE2 HIS A 119 10.647 1.617 30.351 1.00 28.45 N ATOM 912 H HIS A 119 10.463 -2.467 29.548 1.00 0.00 H ATOM 913 N TYR A 120 6.804 -2.326 30.641 1.00 14.91 N ATOM 914 CA TYR A 120 5.667 -2.139 29.691 1.00 14.08 C ATOM 915 C TYR A 120 5.504 -0.677 29.413 1.00 14.02 C ATOM 916 O TYR A 120 5.268 0.124 30.357 1.00 16.49 O ATOM 917 CB TYR A 120 4.350 -2.718 30.279 1.00 15.92 C ATOM 918 CG TYR A 120 4.391 -4.190 30.558 1.00 15.70 C ATOM 919 CD1 TYR A 120 4.947 -5.089 29.640 1.00 14.32 C ATOM 920 CD2 TYR A 120 3.921 -4.736 31.815 1.00 16.43 C ATOM 921 CE1 TYR A 120 4.972 -6.451 29.867 1.00 16.10 C ATOM 922 CE2 TYR A 120 3.938 -6.118 32.041 1.00 15.20 C ATOM 923 CZ TYR A 120 4.512 -6.966 31.113 1.00 15.16 C ATOM 924 OH TYR A 120 4.595 -8.352 31.234 1.00 16.32 O ATOM 925 HH TYR A 120 3.683 -8.731 31.302 1.00 0.00 H ATOM 926 H TYR A 120 6.612 -2.404 31.660 1.00 0.00 H ATOM 927 N ALA A 121 5.539 -0.213 28.147 1.00 13.56 N ATOM 928 CA ALA A 121 5.555 1.178 27.864 1.00 13.64 C ATOM 929 C ALA A 121 5.190 1.365 26.394 1.00 12.37 C ATOM 930 O ALA A 121 5.240 0.419 25.570 1.00 11.03 O ATOM 931 CB ALA A 121 6.902 1.808 28.082 1.00 14.74 C ATOM 932 H ALA A 121 5.555 -0.891 27.359 1.00 0.00 H ATOM 933 N ALA A 122 4.871 2.603 26.060 1.00 10.78 N ATOM 934 CA ALA A 122 4.695 2.989 24.617 1.00 10.49 C ATOM 935 C ALA A 122 6.053 3.285 24.004 1.00 9.97 C ATOM 936 O ALA A 122 6.467 4.449 23.810 1.00 11.85 O ATOM 937 CB ALA A 122 3.756 4.146 24.455 1.00 11.79 C ATOM 938 H ALA A 122 4.740 3.319 26.803 1.00 0.00 H ATOM 939 N LEU A 123 6.821 2.245 23.793 1.00 9.66 N ATOM 940 CA LEU A 123 8.212 2.326 23.322 1.00 9.31 C ATOM 941 C LEU A 123 8.319 3.098 22.041 1.00 9.91 C ATOM 942 O LEU A 123 9.213 3.953 21.854 1.00 10.28 O ATOM 943 CB LEU A 123 8.823 0.959 23.193 1.00 9.98 C ATOM 944 CG LEU A 123 10.202 0.830 22.601 1.00 11.11 C ATOM 945 CD1 LEU A 123 11.247 1.605 23.346 1.00 13.91 C ATOM 946 CD2 LEU A 123 10.578 -0.619 22.465 1.00 13.56 C ATOM 947 H LEU A 123 6.421 1.301 23.970 1.00 0.00 H ATOM 948 N LEU A 124 7.465 2.729 21.102 1.00 9.17 N ATOM 949 CA LEU A 124 7.385 3.474 19.849 1.00 8.68 C ATOM 950 C LEU A 124 6.797 4.832 20.027 1.00 8.67 C ATOM 951 O LEU A 124 5.672 4.935 20.447 1.00 9.67 O ATOM 952 CB LEU A 124 6.630 2.666 18.767 1.00 8.71 C ATOM 953 CG LEU A 124 6.873 3.196 17.323 1.00 8.33 C ATOM 954 CD1 LEU A 124 8.201 2.720 16.784 1.00 9.31 C ATOM 955 CD2 LEU A 124 5.790 2.696 16.385 1.00 8.74 C ATOM 956 H LEU A 124 6.848 1.906 21.256 1.00 0.00 H ATOM 957 N GLY A 125 7.622 5.857 19.811 1.00 9.10 N ATOM 958 CA GLY A 125 7.217 7.243 20.021 1.00 10.25 C ATOM 959 C GLY A 125 7.766 7.786 21.374 1.00 10.79 C ATOM 960 O GLY A 125 7.528 8.991 21.676 1.00 12.70 O ATOM 961 H GLY A 125 8.589 5.662 19.481 1.00 0.00 H ATOM 962 N SER A 126 8.513 7.006 22.100 1.00 11.69 N ATOM 963 CA SER A 126 9.135 7.454 23.370 1.00 13.11 C ATOM 964 C SER A 126 10.422 8.245 23.178 1.00 14.04 C ATOM 965 O SER A 126 11.037 8.618 24.235 1.00 16.03 O ATOM 966 CB SER A 126 9.373 6.290 24.267 1.00 12.78 C ATOM 967 OG SER A 126 10.348 5.434 23.797 1.00 13.17 O ATOM 968 HG SER A 126 10.077 5.081 22.913 1.00 0.00 H ATOM 969 H SER A 126 8.680 6.031 21.778 1.00 0.00 H ATOM 970 N ASN A 127 10.859 8.455 21.968 1.00 11.47 N ATOM 971 CA ASN A 127 12.196 8.998 21.728 1.00 12.14 C ATOM 972 C ASN A 127 12.155 9.781 20.433 1.00 13.51 C ATOM 973 O ASN A 127 11.118 9.897 19.729 1.00 13.27 O ATOM 974 CB ASN A 127 13.194 7.893 21.734 1.00 12.40 C ATOM 975 CG ASN A 127 12.811 6.767 20.743 1.00 12.74 C ATOM 976 OD1 ASN A 127 12.579 7.016 19.559 1.00 11.98 O ATOM 977 ND2 ASN A 127 12.713 5.596 21.259 1.00 13.68 N ATOM 978 HD22 ASN A 127 12.923 5.453 22.267 1.00 0.00 H ATOM 979 HD21 ASN A 127 12.423 4.790 20.669 1.00 0.00 H ATOM 980 H ASN A 127 10.246 8.232 21.158 1.00 0.00 H ATOM 981 N SER A 128 13.336 10.400 20.114 1.00 13.83 N ATOM 982 CA SER A 128 13.535 11.148 18.889 1.00 13.72 C ATOM 983 C SER A 128 13.386 10.388 17.586 1.00 12.65 C ATOM 984 O SER A 128 13.271 11.003 16.530 1.00 11.77 O ATOM 985 CB SER A 128 15.015 11.795 18.786 1.00 14.44 C ATOM 986 OG SER A 128 15.965 10.837 18.965 1.00 17.47 O ATOM 987 HG SER A 128 15.867 10.142 18.267 1.00 0.00 H ATOM 988 H SER A 128 14.128 10.329 20.784 1.00 0.00 H ATOM 989 N GLU A 129 13.476 9.080 17.670 1.00 11.61 N ATOM 990 CA GLU A 129 13.648 8.263 16.495 1.00 10.43 C ATOM 991 C GLU A 129 12.374 7.517 16.086 1.00 9.51 C ATOM 992 O GLU A 129 12.421 6.654 15.239 1.00 9.69 O ATOM 993 CB GLU A 129 14.730 7.211 16.750 1.00 10.26 C ATOM 994 CG GLU A 129 16.120 7.810 17.156 1.00 11.78 C ATOM 995 CD GLU A 129 16.582 8.753 16.140 1.00 13.25 C ATOM 996 OE1 GLU A 129 16.809 8.390 14.966 1.00 14.40 O ATOM 997 OE2 GLU A 129 16.674 9.995 16.453 1.00 14.26 O ATOM 998 H GLU A 129 13.422 8.625 18.603 1.00 0.00 H ATOM 999 N SER A 130 11.235 7.821 16.705 1.00 9.21 N ATOM 1000 CA SER A 130 10.058 7.036 16.477 1.00 8.62 C ATOM 1001 C SER A 130 8.789 7.894 16.640 1.00 8.38 C ATOM 1002 O SER A 130 8.784 8.835 17.458 1.00 9.60 O ATOM 1003 CB SER A 130 10.050 5.806 17.410 1.00 9.56 C ATOM 1004 OG SER A 130 10.126 6.085 18.783 1.00 10.57 O ATOM 1005 HG SER A 130 10.966 6.574 18.973 1.00 0.00 H ATOM 1006 H SER A 130 11.199 8.631 17.356 1.00 0.00 H ATOM 1007 N TRP A 131 7.737 7.461 15.962 1.00 8.81 N ATOM 1008 CA TRP A 131 6.471 8.181 15.999 1.00 8.10 C ATOM 1009 C TRP A 131 5.352 7.112 16.002 1.00 8.96 C ATOM 1010 O TRP A 131 5.340 6.222 15.092 1.00 9.13 O ATOM 1011 CB TRP A 131 6.267 8.988 14.703 1.00 8.86 C ATOM 1012 CG TRP A 131 7.319 10.118 14.419 1.00 9.36 C ATOM 1013 CD1 TRP A 131 7.040 11.463 14.562 1.00 9.77 C ATOM 1014 CD2 TRP A 131 8.662 10.000 14.004 1.00 8.81 C ATOM 1015 NE1 TRP A 131 8.179 12.149 14.221 1.00 9.72 N ATOM 1016 CE2 TRP A 131 9.194 11.302 13.920 1.00 9.44 C ATOM 1017 CE3 TRP A 131 9.491 8.931 13.715 1.00 9.49 C ATOM 1018 CZ2 TRP A 131 10.484 11.545 13.497 1.00 9.78 C ATOM 1019 CZ3 TRP A 131 10.785 9.178 13.320 1.00 9.53 C ATOM 1020 CH2 TRP A 131 11.284 10.488 13.251 1.00 8.88 C ATOM 1021 HE1 TRP A 131 8.254 13.186 14.197 1.00 0.00 H ATOM 1022 H TRP A 131 7.816 6.593 15.394 1.00 0.00 H ATOM 1023 N GLY A 132 4.453 7.189 16.937 1.00 9.17 N ATOM 1024 CA GLY A 132 3.445 6.134 17.135 1.00 9.96 C ATOM 1025 C GLY A 132 2.087 6.625 17.524 1.00 9.84 C ATOM 1026 O GLY A 132 1.953 7.578 18.298 1.00 10.55 O ATOM 1027 H GLY A 132 4.445 8.019 17.563 1.00 0.00 H ATOM 1028 N TRP A 133 1.084 5.849 17.121 1.00 8.07 N ATOM 1029 CA TRP A 133 -0.260 6.017 17.527 1.00 8.79 C ATOM 1030 C TRP A 133 -0.535 4.844 18.479 1.00 8.35 C ATOM 1031 O TRP A 133 -0.480 3.671 18.091 1.00 8.25 O ATOM 1032 CB TRP A 133 -1.243 5.994 16.317 1.00 8.58 C ATOM 1033 CG TRP A 133 -2.711 6.262 16.645 1.00 8.48 C ATOM 1034 CD1 TRP A 133 -3.193 7.038 17.642 1.00 9.46 C ATOM 1035 CD2 TRP A 133 -3.825 5.819 15.864 1.00 8.78 C ATOM 1036 NE1 TRP A 133 -4.551 7.050 17.559 1.00 9.84 N ATOM 1037 CE2 TRP A 133 -4.990 6.356 16.459 1.00 8.59 C ATOM 1038 CE3 TRP A 133 -3.982 5.059 14.724 1.00 9.24 C ATOM 1039 CZ2 TRP A 133 -6.236 6.092 15.936 1.00 9.04 C ATOM 1040 CZ3 TRP A 133 -5.205 4.841 14.209 1.00 10.04 C ATOM 1041 CH2 TRP A 133 -6.324 5.358 14.800 1.00 9.50 C ATOM 1042 HE1 TRP A 133 -5.176 7.524 18.241 1.00 0.00 H ATOM 1043 H TRP A 133 1.302 5.071 16.467 1.00 0.00 H ATOM 1044 N ASP A 134 -0.933 5.141 19.672 1.00 8.35 N ATOM 1045 CA ASP A 134 -1.448 4.139 20.633 1.00 8.78 C ATOM 1046 C ASP A 134 -2.797 3.725 20.329 1.00 10.19 C ATOM 1047 O ASP A 134 -3.747 4.613 20.461 1.00 12.02 O ATOM 1048 CB ASP A 134 -1.442 4.805 22.014 1.00 10.07 C ATOM 1049 CG ASP A 134 -1.746 3.850 23.149 1.00 10.95 C ATOM 1050 OD1 ASP A 134 -2.625 2.978 22.960 1.00 10.74 O ATOM 1051 OD2 ASP A 134 -1.089 3.977 24.253 1.00 12.87 O ATOM 1052 H ASP A 134 -0.889 6.136 19.973 1.00 0.00 H ATOM 1053 N ILE A 135 -2.990 2.561 19.722 1.00 10.23 N ATOM 1054 CA ILE A 135 -4.270 2.161 19.210 1.00 11.05 C ATOM 1055 C ILE A 135 -5.276 1.742 20.291 1.00 12.45 C ATOM 1056 O ILE A 135 -6.435 1.451 19.947 1.00 14.41 O ATOM 1057 CB ILE A 135 -4.140 1.118 18.106 1.00 11.42 C ATOM 1058 CG1 ILE A 135 -3.497 -0.216 18.606 1.00 11.56 C ATOM 1059 CG2 ILE A 135 -3.374 1.752 16.974 1.00 11.79 C ATOM 1060 CD1 ILE A 135 -3.398 -1.324 17.552 1.00 12.07 C ATOM 1061 H ILE A 135 -2.183 1.914 19.613 1.00 0.00 H ATOM 1062 N GLY A 136 -4.842 1.683 21.560 1.00 11.89 N ATOM 1063 CA GLY A 136 -5.827 1.487 22.660 1.00 11.86 C ATOM 1064 C GLY A 136 -6.234 2.832 23.273 1.00 14.29 C ATOM 1065 O GLY A 136 -7.409 3.083 23.507 1.00 17.08 O ATOM 1066 H GLY A 136 -3.828 1.773 21.773 1.00 0.00 H ATOM 1067 N ARG A 137 -5.324 3.771 23.487 1.00 11.34 N ATOM 1068 CA ARG A 137 -5.597 5.026 24.165 1.00 13.19 C ATOM 1069 C ARG A 137 -5.938 6.112 23.148 1.00 11.99 C ATOM 1070 O ARG A 137 -6.593 7.136 23.538 1.00 12.53 O ATOM 1071 CB ARG A 137 -4.429 5.499 24.998 1.00 13.71 C ATOM 1072 CG ARG A 137 -4.152 4.594 26.171 1.00 15.06 C ATOM 1073 CD ARG A 137 -2.933 5.062 26.945 1.00 16.37 C ATOM 1074 NE ARG A 137 -2.605 4.136 27.995 1.00 17.03 N ATOM 1075 CZ ARG A 137 -2.025 2.960 27.814 1.00 16.39 C ATOM 1076 NH1 ARG A 137 -1.560 2.582 26.641 1.00 15.45 N ATOM 1077 NH2 ARG A 137 -1.887 2.135 28.838 1.00 17.99 N ATOM 1078 HE ARG A 137 -2.841 4.411 28.970 1.00 0.00 H ATOM 1079 HH12 ARG A 137 -1.110 1.650 26.536 1.00 0.00 H ATOM 1080 HH11 ARG A 137 -1.643 3.215 25.820 1.00 0.00 H ATOM 1081 HH22 ARG A 137 -1.432 1.210 28.703 1.00 0.00 H ATOM 1082 HH21 ARG A 137 -2.233 2.412 29.779 1.00 0.00 H ATOM 1083 H ARG A 137 -4.356 3.599 23.149 1.00 0.00 H ATOM 1084 N GLY A 138 -5.585 5.978 21.873 1.00 11.73 N ATOM 1085 CA GLY A 138 -5.804 6.992 20.925 1.00 10.74 C ATOM 1086 C GLY A 138 -4.772 8.106 20.847 1.00 10.95 C ATOM 1087 O GLY A 138 -4.918 9.005 20.061 1.00 12.14 O ATOM 1088 H GLY A 138 -5.132 5.093 21.567 1.00 0.00 H ATOM 1089 N LYS A 139 -3.771 8.043 21.669 1.00 11.00 N ATOM 1090 CA LYS A 139 -2.794 9.063 21.768 1.00 11.57 C ATOM 1091 C LYS A 139 -1.652 8.973 20.790 1.00 11.96 C ATOM 1092 O LYS A 139 -1.252 7.892 20.348 1.00 10.96 O ATOM 1093 CB LYS A 139 -2.299 9.116 23.201 1.00 15.12 C ATOM 1094 CG LYS A 139 -3.400 9.514 24.182 1.00 19.14 C ATOM 1095 CD LYS A 139 -2.782 9.492 25.591 1.00 24.56 C ATOM 1096 CE LYS A 139 -3.316 10.607 26.486 1.00 34.09 C ATOM 1097 NZ LYS A 139 -4.340 10.087 27.418 1.00 38.49 N ATOM 1098 HZ1 LYS A 139 -5.130 9.685 26.874 1.00 0.00 H ATOM 1099 HZ2 LYS A 139 -3.919 9.348 28.017 1.00 0.00 H ATOM 1100 HZ3 LYS A 139 -4.688 10.863 28.016 1.00 0.00 H ATOM 1101 H LYS A 139 -3.682 7.207 22.282 1.00 0.00 H ATOM 1102 N LEU A 140 -1.104 10.120 20.412 1.00 11.18 N ATOM 1103 CA LEU A 140 0.073 10.216 19.533 1.00 10.68 C ATOM 1104 C LEU A 140 1.339 10.457 20.353 1.00 12.08 C ATOM 1105 O LEU A 140 1.396 11.418 21.097 1.00 14.57 O ATOM 1106 CB LEU A 140 -0.057 11.307 18.468 1.00 9.99 C ATOM 1107 CG LEU A 140 -1.239 11.226 17.584 1.00 11.63 C ATOM 1108 CD1 LEU A 140 -1.320 12.464 16.684 1.00 12.89 C ATOM 1109 CD2 LEU A 140 -1.117 9.949 16.705 1.00 11.87 C ATOM 1110 H LEU A 140 -1.531 11.003 20.757 1.00 0.00 H ATOM 1111 N TYR A 141 2.394 9.695 20.117 1.00 11.17 N ATOM 1112 CA TYR A 141 3.679 9.790 20.788 1.00 11.08 C ATOM 1113 C TYR A 141 4.794 10.082 19.803 1.00 10.78 C ATOM 1114 O TYR A 141 5.019 9.360 18.835 1.00 9.87 O ATOM 1115 CB TYR A 141 3.961 8.507 21.517 1.00 12.79 C ATOM 1116 CG TYR A 141 2.864 8.001 22.418 1.00 14.08 C ATOM 1117 CD1 TYR A 141 2.244 8.764 23.319 1.00 18.54 C ATOM 1118 CD2 TYR A 141 2.465 6.704 22.285 1.00 16.82 C ATOM 1119 CE1 TYR A 141 1.267 8.220 24.169 1.00 18.69 C ATOM 1120 CE2 TYR A 141 1.462 6.153 23.082 1.00 17.77 C ATOM 1121 CZ TYR A 141 0.859 6.957 24.007 1.00 17.00 C ATOM 1122 OH TYR A 141 -0.171 6.428 24.827 1.00 19.77 O ATOM 1123 HH TYR A 141 -0.915 6.111 24.256 1.00 0.00 H ATOM 1124 H TYR A 141 2.295 8.962 19.386 1.00 0.00 H ATOM 1125 N HIS A 142 5.567 11.149 20.100 1.00 10.54 N ATOM 1126 CA HIS A 142 6.879 11.387 19.528 1.00 11.33 C ATOM 1127 C HIS A 142 7.706 12.084 20.564 1.00 13.47 C ATOM 1128 O HIS A 142 7.230 13.153 21.004 1.00 15.05 O ATOM 1129 CB HIS A 142 6.776 12.210 18.231 1.00 10.79 C ATOM 1130 CG HIS A 142 8.125 12.560 17.654 1.00 11.04 C ATOM 1131 ND1 HIS A 142 9.060 11.625 17.276 1.00 10.92 N ATOM 1132 CD2 HIS A 142 8.716 13.758 17.440 1.00 11.76 C ATOM 1133 CE1 HIS A 142 10.160 12.222 16.850 1.00 12.04 C ATOM 1134 NE2 HIS A 142 9.982 13.515 17.014 1.00 12.77 N ATOM 1135 H HIS A 142 5.199 11.843 20.781 1.00 0.00 H ATOM 1136 N GLN A 143 8.846 11.532 20.942 1.00 12.32 N ATOM 1137 CA GLN A 143 9.623 12.058 22.079 1.00 16.94 C ATOM 1138 C GLN A 143 8.691 12.270 23.273 1.00 17.29 C ATOM 1139 O GLN A 143 8.799 13.318 23.993 1.00 19.60 O ATOM 1140 CB GLN A 143 10.317 13.398 21.735 1.00 22.25 C ATOM 1141 CG GLN A 143 11.057 13.395 20.453 1.00 22.79 C ATOM 1142 CD GLN A 143 11.973 14.594 20.363 1.00 22.26 C ATOM 1143 OE1 GLN A 143 13.046 14.503 20.804 1.00 29.51 O ATOM 1144 NE2 GLN A 143 11.486 15.680 19.909 1.00 24.21 N ATOM 1145 HE22 GLN A 143 10.519 15.697 19.527 1.00 0.00 H ATOM 1146 HE21 GLN A 143 12.056 16.550 19.920 1.00 0.00 H ATOM 1147 H GLN A 143 9.204 10.705 20.424 1.00 0.00 H ATOM 1148 N SER A 144 7.810 11.333 23.547 1.00 17.13 N ATOM 1149 CA SER A 144 6.779 11.467 24.586 1.00 18.01 C ATOM 1150 C SER A 144 6.727 10.243 25.496 1.00 23.45 C ATOM 1151 O SER A 144 6.754 9.117 25.002 1.00 21.95 O ATOM 1152 CB SER A 144 5.373 11.605 23.922 1.00 24.16 C ATOM 1153 OG SER A 144 4.348 11.491 24.935 1.00 28.58 O ATOM 1154 HG SER A 144 3.457 11.579 24.513 1.00 0.00 H ATOM 1155 H SER A 144 7.845 10.450 22.999 1.00 0.00 H ATOM 1156 N LYS A 145 6.628 10.463 26.804 1.00 26.56 N ATOM 1157 CA LYS A 145 6.473 9.418 27.852 1.00 28.98 C ATOM 1158 C LYS A 145 5.013 9.022 27.952 1.00 33.69 C ATOM 1159 O LYS A 145 4.712 7.983 28.532 1.00 39.89 O ATOM 1160 CB LYS A 145 6.957 9.935 29.228 1.00 29.24 C ATOM 1161 H LYS A 145 6.662 11.452 27.122 1.00 0.00 H ATOM 1162 N GLY A 146 4.080 9.833 27.451 1.00 33.52 N ATOM 1163 CA GLY A 146 2.693 9.390 27.351 1.00 37.49 C ATOM 1164 C GLY A 146 1.615 10.189 28.045 1.00 41.33 C ATOM 1165 O GLY A 146 0.543 10.394 27.474 1.00 38.12 O ATOM 1166 H GLY A 146 4.342 10.787 27.130 1.00 0.00 H ATOM 1167 N PRO A 147 1.867 10.631 29.286 1.00 45.40 N ATOM 1168 CA PRO A 147 0.832 11.520 29.834 1.00 41.90 C ATOM 1169 C PRO A 147 0.840 12.893 29.142 1.00 41.30 C ATOM 1170 O PRO A 147 1.927 13.441 28.888 1.00 42.72 O ATOM 1171 HN2 PRO A 147 1.954 9.807 29.914 1.00 0.00 H ATOM 1172 HN1 PRO A 147 2.768 11.150 29.270 1.00 0.00 H ATOM 1173 N GLY A 148 -0.360 13.412 28.815 1.00 37.43 N ATOM 1174 CA GLY A 148 -0.540 14.683 28.113 1.00 33.29 C ATOM 1175 C GLY A 148 -0.510 14.600 26.596 1.00 31.88 C ATOM 1176 O GLY A 148 -0.727 15.596 25.909 1.00 28.15 O ATOM 1177 H GLY A 148 -1.211 12.876 29.078 1.00 0.00 H ATOM 1178 N ALA A 149 -0.202 13.422 26.051 1.00 24.32 N ATOM 1179 CA ALA A 149 -0.082 13.321 24.591 1.00 21.74 C ATOM 1180 C ALA A 149 -1.472 13.570 23.936 1.00 17.50 C ATOM 1181 O ALA A 149 -2.481 13.230 24.528 1.00 18.57 O ATOM 1182 CB ALA A 149 0.471 11.944 24.278 1.00 19.81 C ATOM 1183 H ALA A 149 -0.049 12.587 26.652 1.00 0.00 H ATOM 1184 N PRO A 150 -1.504 14.160 22.728 1.00 15.61 N ATOM 1185 CA PRO A 150 -2.764 14.529 22.044 1.00 16.44 C ATOM 1186 C PRO A 150 -3.509 13.333 21.471 1.00 14.68 C ATOM 1187 O PRO A 150 -2.904 12.284 21.036 1.00 15.20 O ATOM 1188 CB PRO A 150 -2.331 15.424 20.885 1.00 17.27 C ATOM 1189 CG PRO A 150 -0.882 15.050 20.623 1.00 16.78 C ATOM 1190 CD PRO A 150 -0.325 14.590 21.942 1.00 17.70 C ATOM 1191 N GLN A 151 -4.807 13.432 21.380 1.00 14.09 N ATOM 1192 CA GLN A 151 -5.635 12.426 20.791 1.00 12.93 C ATOM 1193 C GLN A 151 -5.710 12.527 19.310 1.00 13.09 C ATOM 1194 O GLN A 151 -5.681 13.623 18.700 1.00 14.07 O ATOM 1195 CB GLN A 151 -7.039 12.619 21.353 1.00 13.97 C ATOM 1196 CG GLN A 151 -7.218 12.341 22.799 1.00 14.56 C ATOM 1197 CD GLN A 151 -6.874 10.977 23.312 1.00 15.56 C ATOM 1198 OE1 GLN A 151 -7.126 9.878 22.649 1.00 16.33 O ATOM 1199 NE2 GLN A 151 -6.444 10.963 24.524 1.00 14.12 N ATOM 1200 HE22 GLN A 151 -6.255 11.858 25.019 1.00 0.00 H ATOM 1201 HE21 GLN A 151 -6.286 10.057 25.009 1.00 0.00 H ATOM 1202 H GLN A 151 -5.263 14.288 21.756 1.00 0.00 H ATOM 1203 N TYR A 152 -5.821 11.385 18.626 1.00 10.96 N ATOM 1204 CA TYR A 152 -6.028 11.289 17.222 1.00 11.10 C ATOM 1205 C TYR A 152 -6.974 10.155 16.965 1.00 10.44 C ATOM 1206 O TYR A 152 -6.907 9.095 17.641 1.00 11.01 O ATOM 1207 CB TYR A 152 -4.651 10.992 16.529 1.00 11.04 C ATOM 1208 CG TYR A 152 -4.697 10.723 15.082 1.00 10.69 C ATOM 1209 CD1 TYR A 152 -4.608 11.736 14.123 1.00 10.80 C ATOM 1210 CD2 TYR A 152 -4.853 9.420 14.587 1.00 9.87 C ATOM 1211 CE1 TYR A 152 -4.609 11.469 12.785 1.00 9.85 C ATOM 1212 CE2 TYR A 152 -4.920 9.154 13.259 1.00 9.21 C ATOM 1213 CZ TYR A 152 -4.735 10.145 12.280 1.00 9.03 C ATOM 1214 OH TYR A 152 -4.699 9.848 10.973 1.00 10.15 O ATOM 1215 HH TYR A 152 -4.561 10.678 10.451 1.00 0.00 H ATOM 1216 H TYR A 152 -5.751 10.497 19.162 1.00 0.00 H ATOM 1217 N PRO A 153 -7.876 10.325 15.987 1.00 10.70 N ATOM 1218 CA PRO A 153 -8.045 11.531 15.164 1.00 12.40 C ATOM 1219 C PRO A 153 -8.748 12.668 15.937 1.00 12.48 C ATOM 1220 O PRO A 153 -9.179 12.505 17.072 1.00 11.97 O ATOM 1221 CB PRO A 153 -8.967 11.041 14.095 1.00 12.84 C ATOM 1222 CG PRO A 153 -9.774 9.959 14.669 1.00 12.27 C ATOM 1223 CD PRO A 153 -8.850 9.256 15.603 1.00 11.22 C ATOM 1224 N ALA A 154 -8.805 13.802 15.275 1.00 12.32 N ATOM 1225 CA ALA A 154 -9.395 14.996 15.949 1.00 13.55 C ATOM 1226 C ALA A 154 -10.798 14.721 16.425 1.00 13.01 C ATOM 1227 O ALA A 154 -11.624 14.135 15.752 1.00 14.78 O ATOM 1228 CB ALA A 154 -9.413 16.155 15.017 1.00 16.02 C ATOM 1229 H ALA A 154 -8.446 13.866 14.301 1.00 0.00 H ATOM 1230 N GLY A 155 -11.070 15.205 17.640 1.00 13.54 N ATOM 1231 CA GLY A 155 -12.442 15.130 18.211 1.00 15.42 C ATOM 1232 C GLY A 155 -12.825 13.794 18.821 1.00 16.59 C ATOM 1233 O GLY A 155 -13.997 13.533 19.030 1.00 17.27 O ATOM 1234 H GLY A 155 -10.309 15.642 18.197 1.00 0.00 H ATOM 1235 N THR A 156 -11.861 12.903 19.097 1.00 15.20 N ATOM 1236 CA THR A 156 -12.119 11.571 19.660 1.00 16.39 C ATOM 1237 C THR A 156 -11.340 11.425 20.982 1.00 19.96 C ATOM 1238 O THR A 156 -10.483 12.252 21.335 1.00 21.46 O ATOM 1239 CB THR A 156 -11.689 10.440 18.725 1.00 16.61 C ATOM 1240 OG1 THR A 156 -10.227 10.413 18.598 1.00 17.33 O ATOM 1241 CG2 THR A 156 -12.361 10.545 17.383 1.00 16.41 C ATOM 1242 HG1 THR A 156 -9.913 11.276 18.228 1.00 0.00 H ATOM 1243 H THR A 156 -10.875 13.170 18.901 1.00 0.00 H ATOM 1244 N GLN A 157 -11.643 10.363 21.698 1.00 19.89 N ATOM 1245 CA GLN A 157 -10.850 9.995 22.915 1.00 21.48 C ATOM 1246 C GLN A 157 -10.933 8.542 23.152 1.00 22.44 C ATOM 1247 O GLN A 157 -11.902 7.845 22.706 1.00 17.17 O ATOM 1248 CB GLN A 157 -11.292 10.837 24.114 1.00 25.58 C ATOM 1249 CG GLN A 157 -12.752 10.706 24.393 1.00 27.55 C ATOM 1250 CD GLN A 157 -13.149 11.338 25.703 1.00 34.99 C ATOM 1251 OE1 GLN A 157 -13.816 10.703 26.542 1.00 49.00 O ATOM 1252 NE2 GLN A 157 -12.756 12.584 25.896 1.00 41.91 N ATOM 1253 HE22 GLN A 157 -12.200 13.073 25.165 1.00 0.00 H ATOM 1254 HE21 GLN A 157 -13.002 13.076 26.778 1.00 0.00 H ATOM 1255 H GLN A 157 -12.448 9.768 21.414 1.00 0.00 H ATOM 1256 N GLY A 158 -9.894 7.995 23.790 1.00 19.97 N ATOM 1257 CA GLY A 158 -9.736 6.543 23.966 1.00 23.17 C ATOM 1258 C GLY A 158 -10.969 5.797 24.395 1.00 22.84 C ATOM 1259 O GLY A 158 -11.274 4.709 23.877 1.00 21.84 O ATOM 1260 H GLY A 158 -9.164 8.625 24.180 1.00 0.00 H ATOM 1261 N GLU A 159 -11.597 6.384 25.416 1.00 22.22 N ATOM 1262 CA GLU A 159 -12.664 5.712 26.136 1.00 22.50 C ATOM 1263 C GLU A 159 -13.867 5.587 25.252 1.00 23.37 C ATOM 1264 O GLU A 159 -14.830 4.868 25.603 1.00 24.47 O ATOM 1265 H GLU A 159 -11.316 7.344 25.702 1.00 0.00 H ATOM 1266 N GLN A 160 -13.887 6.343 24.159 1.00 20.37 N ATOM 1267 CA GLN A 160 -15.031 6.348 23.278 1.00 22.52 C ATOM 1268 C GLN A 160 -14.645 6.090 21.829 1.00 19.25 C ATOM 1269 O GLN A 160 -15.262 6.584 20.866 1.00 18.19 O ATOM 1270 CB GLN A 160 -15.742 7.650 23.438 1.00 26.23 C ATOM 1271 CG GLN A 160 -16.242 7.767 24.862 1.00 31.77 C ATOM 1272 CD GLN A 160 -17.319 8.774 25.000 1.00 37.06 C ATOM 1273 OE1 GLN A 160 -17.453 9.639 24.154 1.00 35.00 O ATOM 1274 NE2 GLN A 160 -18.090 8.682 26.093 1.00 44.44 N ATOM 1275 HE22 GLN A 160 -17.927 7.920 26.782 1.00 0.00 H ATOM 1276 HE21 GLN A 160 -18.851 9.373 26.252 1.00 0.00 H ATOM 1277 H GLN A 160 -13.066 6.940 23.935 1.00 0.00 H ATOM 1278 N LEU A 161 -13.594 5.266 21.684 1.00 17.76 N ATOM 1279 CA LEU A 161 -13.278 4.730 20.383 1.00 20.13 C ATOM 1280 C LEU A 161 -12.634 3.399 20.443 1.00 16.43 C ATOM 1281 O LEU A 161 -12.151 2.968 21.523 1.00 17.39 O ATOM 1282 CB LEU A 161 -12.399 5.670 19.633 1.00 22.95 C ATOM 1283 CG LEU A 161 -10.971 5.848 19.953 1.00 24.45 C ATOM 1284 CD1 LEU A 161 -10.112 4.696 19.416 1.00 24.75 C ATOM 1285 CD2 LEU A 161 -10.485 7.159 19.337 1.00 32.62 C ATOM 1286 H LEU A 161 -13.010 5.015 22.507 1.00 0.00 H ATOM 1287 N GLU A 162 -12.725 2.670 19.325 1.00 13.82 N ATOM 1288 CA GLU A 162 -12.109 1.385 19.297 1.00 14.42 C ATOM 1289 C GLU A 162 -11.496 1.238 17.900 1.00 13.11 C ATOM 1290 O GLU A 162 -12.198 1.256 16.862 1.00 14.21 O ATOM 1291 CB GLU A 162 -13.111 0.297 19.582 1.00 18.53 C ATOM 1292 CG GLU A 162 -12.668 -1.140 19.669 1.00 24.72 C ATOM 1293 CD GLU A 162 -13.907 -2.127 19.547 1.00 32.78 C ATOM 1294 OE1 GLU A 162 -15.137 -1.782 19.484 1.00 36.79 O ATOM 1295 OE2 GLU A 162 -13.708 -3.330 19.410 1.00 35.80 O ATOM 1296 H GLU A 162 -13.234 3.033 18.494 1.00 0.00 H ATOM 1297 N VAL A 163 -10.164 1.131 17.848 1.00 10.62 N ATOM 1298 CA VAL A 163 -9.474 0.861 16.601 1.00 10.85 C ATOM 1299 C VAL A 163 -9.714 -0.605 16.240 1.00 9.70 C ATOM 1300 O VAL A 163 -9.357 -1.478 17.021 1.00 10.28 O ATOM 1301 CB VAL A 163 -7.970 1.210 16.710 1.00 10.95 C ATOM 1302 CG1 VAL A 163 -7.241 0.877 15.369 1.00 11.40 C ATOM 1303 CG2 VAL A 163 -7.836 2.662 17.111 1.00 11.37 C ATOM 1304 H VAL A 163 -9.610 1.244 18.721 1.00 0.00 H ATOM 1305 N PRO A 164 -10.248 -0.913 15.085 1.00 9.41 N ATOM 1306 CA PRO A 164 -10.495 -2.284 14.729 1.00 10.45 C ATOM 1307 C PRO A 164 -9.202 -3.061 14.404 1.00 10.50 C ATOM 1308 O PRO A 164 -8.114 -2.536 14.465 1.00 10.15 O ATOM 1309 CB PRO A 164 -11.391 -2.154 13.510 1.00 11.05 C ATOM 1310 CG PRO A 164 -11.009 -0.894 12.879 1.00 10.79 C ATOM 1311 CD PRO A 164 -10.679 0.002 13.992 1.00 9.00 C ATOM 1312 N GLU A 165 -9.345 -4.326 14.120 1.00 9.92 N ATOM 1313 CA GLU A 165 -8.202 -5.223 13.907 1.00 10.24 C ATOM 1314 C GLU A 165 -7.297 -4.718 12.858 1.00 10.50 C ATOM 1315 O GLU A 165 -6.028 -4.774 13.009 1.00 11.55 O ATOM 1316 CB GLU A 165 -8.707 -6.642 13.547 1.00 11.66 C ATOM 1317 CG GLU A 165 -7.512 -7.623 13.316 1.00 13.19 C ATOM 1318 CD GLU A 165 -7.875 -9.098 13.427 1.00 19.48 C ATOM 1319 OE1 GLU A 165 -8.757 -9.456 14.179 1.00 24.69 O ATOM 1320 OE2 GLU A 165 -7.169 -9.919 12.833 1.00 23.78 O ATOM 1321 H GLU A 165 -10.306 -4.715 14.041 1.00 0.00 H ATOM 1322 N ARG A 166 -7.839 -4.241 11.757 1.00 10.28 N ATOM 1323 CA ARG A 166 -7.006 -3.763 10.645 1.00 10.93 C ATOM 1324 C ARG A 166 -7.004 -2.267 10.542 1.00 10.06 C ATOM 1325 O ARG A 166 -8.091 -1.607 10.669 1.00 12.38 O ATOM 1326 CB ARG A 166 -7.534 -4.327 9.347 1.00 12.68 C ATOM 1327 CG ARG A 166 -7.492 -5.799 9.247 1.00 15.56 C ATOM 1328 CD ARG A 166 -8.203 -6.374 8.068 1.00 21.34 C ATOM 1329 NE ARG A 166 -9.662 -6.351 7.935 1.00 30.71 N ATOM 1330 CZ ARG A 166 -10.608 -7.010 8.649 1.00 36.55 C ATOM 1331 NH1 ARG A 166 -10.399 -7.612 9.883 1.00 33.28 N ATOM 1332 NH2 ARG A 166 -11.849 -6.940 8.160 1.00 36.75 N ATOM 1333 HE ARG A 166 -10.027 -5.737 7.179 1.00 0.00 H ATOM 1334 HH12 ARG A 166 -11.183 -8.098 10.364 1.00 0.00 H ATOM 1335 HH11 ARG A 166 -9.459 -7.576 10.326 1.00 0.00 H ATOM 1336 HH22 ARG A 166 -12.630 -7.420 8.652 1.00 0.00 H ATOM 1337 HH21 ARG A 166 -12.035 -6.406 7.287 1.00 0.00 H ATOM 1338 H ARG A 166 -8.875 -4.202 11.673 1.00 0.00 H ATOM 1339 N LEU A 167 -5.867 -1.672 10.303 1.00 9.57 N ATOM 1340 CA LEU A 167 -5.727 -0.205 10.099 1.00 9.76 C ATOM 1341 C LEU A 167 -4.651 0.004 9.075 1.00 9.02 C ATOM 1342 O LEU A 167 -3.709 -0.799 8.964 1.00 10.38 O ATOM 1343 CB LEU A 167 -5.451 0.536 11.460 1.00 10.34 C ATOM 1344 CG LEU A 167 -4.060 0.230 12.146 1.00 10.85 C ATOM 1345 CD1 LEU A 167 -3.593 1.443 12.920 1.00 12.21 C ATOM 1346 CD2 LEU A 167 -4.118 -0.967 13.026 1.00 12.44 C ATOM 1347 H LEU A 167 -5.009 -2.258 10.252 1.00 0.00 H ATOM 1348 N LEU A 168 -4.754 1.056 8.269 1.00 9.19 N ATOM 1349 CA LEU A 168 -3.730 1.453 7.296 1.00 9.62 C ATOM 1350 C LEU A 168 -2.874 2.525 7.874 1.00 8.85 C ATOM 1351 O LEU A 168 -3.336 3.461 8.549 1.00 10.83 O ATOM 1352 CB LEU A 168 -4.377 1.985 6.047 1.00 12.60 C ATOM 1353 CG LEU A 168 -5.352 1.084 5.382 1.00 16.77 C ATOM 1354 CD1 LEU A 168 -5.707 1.697 4.046 1.00 18.84 C ATOM 1355 CD2 LEU A 168 -5.005 -0.413 5.268 1.00 18.89 C ATOM 1356 H LEU A 168 -5.616 1.635 8.332 1.00 0.00 H ATOM 1357 N VAL A 169 -1.598 2.447 7.552 1.00 8.00 N ATOM 1358 CA VAL A 169 -0.592 3.401 7.906 1.00 8.04 C ATOM 1359 C VAL A 169 -0.127 4.022 6.612 1.00 8.91 C ATOM 1360 O VAL A 169 0.194 3.318 5.641 1.00 9.31 O ATOM 1361 CB VAL A 169 0.574 2.706 8.629 1.00 7.94 C ATOM 1362 CG1 VAL A 169 1.574 3.750 9.143 1.00 8.22 C ATOM 1363 CG2 VAL A 169 0.038 1.762 9.738 1.00 8.41 C ATOM 1364 H VAL A 169 -1.297 1.623 6.994 1.00 0.00 H ATOM 1365 N VAL A 170 -0.159 5.340 6.575 1.00 9.47 N ATOM 1366 CA VAL A 170 0.080 6.103 5.367 1.00 8.66 C ATOM 1367 C VAL A 170 1.164 7.139 5.510 1.00 7.63 C ATOM 1368 O VAL A 170 1.048 8.096 6.326 1.00 9.10 O ATOM 1369 CB VAL A 170 -1.265 6.787 4.920 1.00 9.54 C ATOM 1370 CG1 VAL A 170 -1.067 7.603 3.616 1.00 11.87 C ATOM 1371 CG2 VAL A 170 -2.391 5.781 4.740 1.00 10.64 C ATOM 1372 H VAL A 170 -0.365 5.856 7.454 1.00 0.00 H ATOM 1373 N LEU A 171 2.309 6.918 4.840 1.00 8.11 N ATOM 1374 CA LEU A 171 3.485 7.742 4.973 1.00 10.10 C ATOM 1375 C LEU A 171 3.744 8.521 3.669 1.00 10.41 C ATOM 1376 O LEU A 171 3.984 7.952 2.638 1.00 10.64 O ATOM 1377 CB LEU A 171 4.685 6.853 5.293 1.00 9.13 C ATOM 1378 CG LEU A 171 5.973 7.603 5.614 1.00 9.42 C ATOM 1379 CD1 LEU A 171 5.919 8.369 6.857 1.00 10.47 C ATOM 1380 CD2 LEU A 171 7.111 6.595 5.581 1.00 9.82 C ATOM 1381 H LEU A 171 2.349 6.107 4.190 1.00 0.00 H ATOM 1382 N ASP A 172 3.532 9.811 3.800 1.00 10.63 N ATOM 1383 CA ASP A 172 3.746 10.768 2.680 1.00 11.85 C ATOM 1384 C ASP A 172 5.043 11.478 2.797 1.00 10.67 C ATOM 1385 O ASP A 172 5.186 12.376 3.650 1.00 11.05 O ATOM 1386 CB ASP A 172 2.599 11.762 2.635 1.00 11.68 C ATOM 1387 CG ASP A 172 2.729 12.810 1.572 1.00 13.55 C ATOM 1388 OD1 ASP A 172 3.756 12.894 0.914 1.00 13.45 O ATOM 1389 OD2 ASP A 172 1.678 13.537 1.421 1.00 13.38 O ATOM 1390 H ASP A 172 3.204 10.176 4.717 1.00 0.00 H ATOM 1391 N MET A 173 6.063 10.993 2.082 1.00 11.23 N ATOM 1392 CA MET A 173 7.387 11.566 2.275 1.00 12.36 C ATOM 1393 C MET A 173 7.661 12.781 1.387 1.00 15.57 C ATOM 1394 O MET A 173 8.714 13.414 1.559 1.00 18.85 O ATOM 1395 CB MET A 173 8.491 10.505 2.151 1.00 12.73 C ATOM 1396 CG MET A 173 8.512 9.499 3.320 1.00 13.38 C ATOM 1397 SD MET A 173 8.635 10.170 4.900 1.00 14.74 S ATOM 1398 CE MET A 173 10.389 10.592 4.825 1.00 13.92 C ATOM 1399 H MET A 173 5.913 10.221 1.401 1.00 0.00 H ATOM 1400 N GLU A 174 6.683 13.159 0.579 1.00 15.63 N ATOM 1401 CA GLU A 174 6.783 14.459 -0.169 1.00 17.22 C ATOM 1402 C GLU A 174 6.323 15.580 0.736 1.00 16.38 C ATOM 1403 O GLU A 174 7.005 16.621 0.907 1.00 20.89 O ATOM 1404 CB GLU A 174 6.001 14.286 -1.462 1.00 17.13 C ATOM 1405 CG GLU A 174 6.498 13.143 -2.345 1.00 21.13 C ATOM 1406 CD GLU A 174 7.983 13.350 -2.696 1.00 23.39 C ATOM 1407 OE1 GLU A 174 8.316 14.454 -3.219 1.00 26.94 O ATOM 1408 OE2 GLU A 174 8.857 12.486 -2.398 1.00 20.81 O ATOM 1409 H GLU A 174 5.844 12.556 0.462 1.00 0.00 H ATOM 1410 N GLU A 175 5.187 15.432 1.421 1.00 14.07 N ATOM 1411 CA GLU A 175 4.755 16.444 2.406 1.00 14.50 C ATOM 1412 C GLU A 175 5.408 16.299 3.762 1.00 12.42 C ATOM 1413 O GLU A 175 5.348 17.168 4.639 1.00 13.62 O ATOM 1414 CB GLU A 175 3.233 16.447 2.640 1.00 15.12 C ATOM 1415 CG GLU A 175 2.434 16.739 1.351 1.00 15.80 C ATOM 1416 CD GLU A 175 2.743 18.120 0.780 1.00 19.67 C ATOM 1417 OE1 GLU A 175 2.636 19.070 1.528 1.00 18.29 O ATOM 1418 OE2 GLU A 175 3.078 18.174 -0.405 1.00 24.18 O ATOM 1419 H GLU A 175 4.597 14.591 1.259 1.00 0.00 H ATOM 1420 N GLY A 176 5.921 15.093 4.042 1.00 11.48 N ATOM 1421 CA GLY A 176 6.492 14.769 5.325 1.00 11.22 C ATOM 1422 C GLY A 176 5.507 14.482 6.499 1.00 10.94 C ATOM 1423 O GLY A 176 5.682 14.979 7.595 1.00 11.92 O ATOM 1424 H GLY A 176 5.906 14.361 3.303 1.00 0.00 H ATOM 1425 N THR A 177 4.517 13.650 6.215 1.00 10.56 N ATOM 1426 CA THR A 177 3.454 13.331 7.160 1.00 9.95 C ATOM 1427 C THR A 177 3.316 11.820 7.341 1.00 10.10 C ATOM 1428 O THR A 177 3.558 11.023 6.418 1.00 9.95 O ATOM 1429 CB THR A 177 2.100 13.948 6.752 1.00 10.13 C ATOM 1430 OG1 THR A 177 1.662 13.345 5.558 1.00 11.80 O ATOM 1431 CG2 THR A 177 2.289 15.476 6.536 1.00 11.00 C ATOM 1432 HG1 THR A 177 1.556 12.371 5.701 1.00 0.00 H ATOM 1433 H THR A 177 4.497 13.204 5.276 1.00 0.00 H ATOM 1434 N LEU A 178 2.790 11.474 8.506 1.00 8.54 N ATOM 1435 CA LEU A 178 2.344 10.115 8.777 1.00 8.74 C ATOM 1436 C LEU A 178 0.851 10.221 9.219 1.00 8.44 C ATOM 1437 O LEU A 178 0.562 11.074 10.079 1.00 8.84 O ATOM 1438 CB LEU A 178 3.107 9.446 9.896 1.00 9.99 C ATOM 1439 CG LEU A 178 2.656 8.110 10.438 1.00 10.52 C ATOM 1440 CD1 LEU A 178 2.768 7.108 9.340 1.00 11.21 C ATOM 1441 CD2 LEU A 178 3.481 7.644 11.607 1.00 11.45 C ATOM 1442 H LEU A 178 2.693 12.195 9.250 1.00 0.00 H ATOM 1443 N GLY A 179 -0.026 9.438 8.653 1.00 8.12 N ATOM 1444 CA GLY A 179 -1.428 9.383 9.105 1.00 8.21 C ATOM 1445 C GLY A 179 -1.934 8.003 8.917 1.00 9.04 C ATOM 1446 O GLY A 179 -1.159 7.078 8.568 1.00 10.10 O ATOM 1447 H GLY A 179 0.273 8.835 7.860 1.00 0.00 H ATOM 1448 N TYR A 180 -3.185 7.802 9.221 1.00 9.21 N ATOM 1449 CA TYR A 180 -3.794 6.470 9.307 1.00 9.29 C ATOM 1450 C TYR A 180 -5.097 6.448 8.621 1.00 9.11 C ATOM 1451 O TYR A 180 -5.751 7.536 8.458 1.00 9.95 O ATOM 1452 CB TYR A 180 -3.927 5.953 10.702 1.00 9.01 C ATOM 1453 CG TYR A 180 -2.619 6.009 11.486 1.00 8.18 C ATOM 1454 CD1 TYR A 180 -2.192 7.147 12.127 1.00 9.76 C ATOM 1455 CD2 TYR A 180 -1.793 4.893 11.587 1.00 8.53 C ATOM 1456 CE1 TYR A 180 -1.001 7.250 12.799 1.00 8.42 C ATOM 1457 CE2 TYR A 180 -0.615 4.941 12.284 1.00 8.57 C ATOM 1458 CZ TYR A 180 -0.223 6.123 12.935 1.00 8.26 C ATOM 1459 OH TYR A 180 0.999 6.217 13.627 1.00 8.79 O ATOM 1460 HH TYR A 180 1.018 5.544 14.353 1.00 0.00 H ATOM 1461 H TYR A 180 -3.784 8.630 9.413 1.00 0.00 H ATOM 1462 N ALA A 181 -5.578 5.282 8.198 1.00 10.30 N ATOM 1463 CA ALA A 181 -6.947 5.151 7.622 1.00 10.79 C ATOM 1464 C ALA A 181 -7.590 3.957 8.260 1.00 11.11 C ATOM 1465 O ALA A 181 -6.942 2.954 8.595 1.00 10.92 O ATOM 1466 CB ALA A 181 -6.894 4.994 6.197 1.00 10.73 C ATOM 1467 H ALA A 181 -4.980 4.434 8.271 1.00 0.00 H ATOM 1468 N ILE A 182 -8.885 4.036 8.490 1.00 11.38 N ATOM 1469 CA ILE A 182 -9.659 2.945 9.104 1.00 14.05 C ATOM 1470 C ILE A 182 -10.882 2.724 8.235 1.00 15.25 C ATOM 1471 O ILE A 182 -11.562 3.729 7.843 1.00 16.93 O ATOM 1472 CB ILE A 182 -9.982 3.248 10.601 1.00 14.12 C ATOM 1473 CG1 ILE A 182 -8.583 3.121 11.384 1.00 20.25 C ATOM 1474 CG2 ILE A 182 -10.975 2.217 11.150 1.00 15.17 C ATOM 1475 CD1 ILE A 182 -8.605 3.406 12.835 1.00 24.72 C ATOM 1476 H ILE A 182 -9.383 4.910 8.225 1.00 0.00 H ATOM 1477 N GLY A 183 -11.152 1.472 7.855 1.00 16.60 N ATOM 1478 CA GLY A 183 -12.296 1.166 6.920 1.00 16.71 C ATOM 1479 C GLY A 183 -12.245 1.954 5.651 1.00 18.64 C ATOM 1480 O GLY A 183 -13.308 2.364 5.108 1.00 18.45 O ATOM 1481 H GLY A 183 -10.562 0.693 8.211 1.00 0.00 H ATOM 1482 N GLY A 184 -11.023 2.166 5.094 1.00 17.06 N ATOM 1483 CA GLY A 184 -10.859 2.902 3.829 1.00 17.71 C ATOM 1484 C GLY A 184 -10.868 4.409 3.931 1.00 18.80 C ATOM 1485 O GLY A 184 -10.653 5.095 2.919 1.00 23.28 O ATOM 1486 H GLY A 184 -10.178 1.797 5.576 1.00 0.00 H ATOM 1487 N THR A 185 -11.004 4.960 5.130 1.00 14.61 N ATOM 1488 CA THR A 185 -11.191 6.391 5.281 1.00 13.64 C ATOM 1489 C THR A 185 -9.947 7.009 5.951 1.00 12.98 C ATOM 1490 O THR A 185 -9.623 6.618 7.073 1.00 11.82 O ATOM 1491 CB THR A 185 -12.387 6.669 6.144 1.00 14.07 C ATOM 1492 OG1 THR A 185 -13.547 6.034 5.535 1.00 16.06 O ATOM 1493 CG2 THR A 185 -12.659 8.099 6.304 1.00 15.51 C ATOM 1494 HG1 THR A 185 -13.392 5.058 5.472 1.00 0.00 H ATOM 1495 H THR A 185 -10.976 4.356 5.976 1.00 0.00 H ATOM 1496 N TYR A 186 -9.236 7.893 5.255 1.00 11.57 N ATOM 1497 CA TYR A 186 -8.123 8.592 5.860 1.00 10.66 C ATOM 1498 C TYR A 186 -8.508 9.477 6.979 1.00 11.93 C ATOM 1499 O TYR A 186 -9.512 10.215 6.872 1.00 13.52 O ATOM 1500 CB TYR A 186 -7.383 9.406 4.808 1.00 10.91 C ATOM 1501 CG TYR A 186 -6.042 9.986 5.213 1.00 10.92 C ATOM 1502 CD1 TYR A 186 -4.932 9.167 5.530 1.00 10.19 C ATOM 1503 CD2 TYR A 186 -5.875 11.348 5.244 1.00 11.06 C ATOM 1504 CE1 TYR A 186 -3.701 9.761 5.828 1.00 10.39 C ATOM 1505 CE2 TYR A 186 -4.670 11.938 5.549 1.00 10.74 C ATOM 1506 CZ TYR A 186 -3.539 11.128 5.882 1.00 8.99 C ATOM 1507 OH TYR A 186 -2.363 11.695 6.169 1.00 10.75 O ATOM 1508 HH TYR A 186 -2.054 12.224 5.391 1.00 0.00 H ATOM 1509 H TYR A 186 -9.484 8.084 4.263 1.00 0.00 H ATOM 1510 N LEU A 187 -7.831 9.435 8.097 1.00 11.20 N ATOM 1511 CA LEU A 187 -8.201 10.163 9.297 1.00 11.19 C ATOM 1512 C LEU A 187 -7.425 11.461 9.452 1.00 11.68 C ATOM 1513 O LEU A 187 -7.612 12.188 10.456 1.00 15.49 O ATOM 1514 CB LEU A 187 -7.964 9.245 10.524 1.00 11.03 C ATOM 1515 CG LEU A 187 -8.745 7.960 10.554 1.00 14.10 C ATOM 1516 CD1 LEU A 187 -8.296 7.199 11.822 1.00 14.19 C ATOM 1517 CD2 LEU A 187 -10.205 8.169 10.584 1.00 17.43 C ATOM 1518 H LEU A 187 -6.976 8.844 8.128 1.00 0.00 H ATOM 1519 N GLY A 188 -6.624 11.819 8.484 1.00 11.61 N ATOM 1520 CA GLY A 188 -5.839 13.057 8.541 1.00 11.63 C ATOM 1521 C GLY A 188 -4.373 12.854 8.891 1.00 12.12 C ATOM 1522 O GLY A 188 -3.969 11.805 9.436 1.00 12.10 O ATOM 1523 H GLY A 188 -6.540 11.207 7.647 1.00 0.00 H ATOM 1524 N PRO A 189 -3.540 13.862 8.734 1.00 12.42 N ATOM 1525 CA PRO A 189 -2.123 13.735 9.131 1.00 14.32 C ATOM 1526 C PRO A 189 -2.086 13.719 10.662 1.00 12.45 C ATOM 1527 O PRO A 189 -2.779 14.476 11.315 1.00 14.23 O ATOM 1528 CB PRO A 189 -1.441 14.930 8.477 1.00 14.89 C ATOM 1529 CG PRO A 189 -2.584 15.891 8.213 1.00 16.02 C ATOM 1530 CD PRO A 189 -3.804 15.098 7.949 1.00 13.76 C ATOM 1531 N ALA A 190 -1.375 12.745 11.219 1.00 10.06 N ATOM 1532 CA ALA A 190 -1.121 12.600 12.615 1.00 10.59 C ATOM 1533 C ALA A 190 0.159 13.273 13.015 1.00 10.06 C ATOM 1534 O ALA A 190 0.204 13.995 14.053 1.00 11.83 O ATOM 1535 CB ALA A 190 -1.085 11.129 12.991 1.00 11.48 C ATOM 1536 H ALA A 190 -0.970 12.028 10.584 1.00 0.00 H ATOM 1537 N PHE A 191 1.205 13.044 12.262 1.00 9.81 N ATOM 1538 CA PHE A 191 2.505 13.664 12.465 1.00 11.29 C ATOM 1539 C PHE A 191 2.952 14.392 11.196 1.00 10.60 C ATOM 1540 O PHE A 191 2.686 13.962 10.082 1.00 10.90 O ATOM 1541 CB PHE A 191 3.570 12.628 12.799 1.00 10.37 C ATOM 1542 CG PHE A 191 3.285 11.753 14.003 1.00 10.06 C ATOM 1543 CD1 PHE A 191 3.632 12.191 15.265 1.00 10.35 C ATOM 1544 CD2 PHE A 191 2.620 10.556 13.876 1.00 10.42 C ATOM 1545 CE1 PHE A 191 3.362 11.399 16.393 1.00 10.42 C ATOM 1546 CE2 PHE A 191 2.381 9.774 15.005 1.00 10.26 C ATOM 1547 CZ PHE A 191 2.744 10.220 16.242 1.00 9.75 C ATOM 1548 H PHE A 191 1.100 12.378 11.470 1.00 0.00 H ATOM 1549 N ARG A 192 3.650 15.524 11.446 1.00 11.51 N ATOM 1550 CA ARG A 192 4.267 16.286 10.395 1.00 12.73 C ATOM 1551 C ARG A 192 5.774 16.447 10.653 1.00 14.19 C ATOM 1552 O ARG A 192 6.289 15.903 11.653 1.00 15.84 O ATOM 1553 CB ARG A 192 3.590 17.682 10.270 1.00 16.19 C ATOM 1554 CG ARG A 192 2.121 17.615 10.258 1.00 19.56 C ATOM 1555 CD ARG A 192 1.653 19.032 9.870 1.00 27.37 C ATOM 1556 NE ARG A 192 0.279 19.290 9.493 1.00 37.20 N ATOM 1557 CZ ARG A 192 -0.342 19.133 8.300 1.00 33.26 C ATOM 1558 NH1 ARG A 192 0.154 18.460 7.232 1.00 25.33 N ATOM 1559 NH2 ARG A 192 -1.598 19.570 8.246 1.00 29.49 N ATOM 1560 HE ARG A 192 -0.325 19.652 10.258 1.00 0.00 H ATOM 1561 HH12 ARG A 192 -0.401 18.395 6.355 1.00 0.00 H ATOM 1562 HH11 ARG A 192 1.090 18.009 7.290 1.00 0.00 H ATOM 1563 HH22 ARG A 192 -2.141 19.484 7.363 1.00 0.00 H ATOM 1564 HH21 ARG A 192 -2.036 19.997 9.087 1.00 0.00 H ATOM 1565 H ARG A 192 3.743 15.853 12.428 1.00 0.00 H ATOM 1566 N GLY A 193 6.435 17.152 9.723 1.00 14.44 N ATOM 1567 CA GLY A 193 7.845 17.434 9.905 1.00 17.82 C ATOM 1568 C GLY A 193 8.785 16.286 9.626 1.00 17.08 C ATOM 1569 O GLY A 193 9.902 16.257 10.114 1.00 18.64 O ATOM 1570 H GLY A 193 5.938 17.494 8.876 1.00 0.00 H ATOM 1571 N LEU A 194 8.369 15.331 8.788 1.00 15.14 N ATOM 1572 CA LEU A 194 9.166 14.127 8.515 1.00 13.53 C ATOM 1573 C LEU A 194 10.028 14.202 7.229 1.00 14.31 C ATOM 1574 O LEU A 194 10.700 13.261 6.852 1.00 14.09 O ATOM 1575 CB LEU A 194 8.205 12.914 8.397 1.00 12.41 C ATOM 1576 CG LEU A 194 7.264 12.682 9.565 1.00 12.34 C ATOM 1577 CD1 LEU A 194 6.399 11.468 9.257 1.00 12.60 C ATOM 1578 CD2 LEU A 194 8.010 12.522 10.901 1.00 14.33 C ATOM 1579 H LEU A 194 7.451 15.444 8.313 1.00 0.00 H ATOM 1580 N LYS A 195 9.958 15.299 6.491 1.00 14.61 N ATOM 1581 CA LYS A 195 10.744 15.423 5.245 1.00 15.06 C ATOM 1582 C LYS A 195 12.247 15.237 5.521 1.00 12.70 C ATOM 1583 O LYS A 195 12.723 15.687 6.498 1.00 15.92 O ATOM 1584 CB LYS A 195 10.522 16.808 4.559 1.00 16.91 C ATOM 1585 CG LYS A 195 9.195 17.049 3.949 1.00 20.07 C ATOM 1586 CD LYS A 195 9.172 18.282 3.008 1.00 26.46 C ATOM 1587 CE LYS A 195 8.805 19.522 3.748 1.00 33.00 C ATOM 1588 NZ LYS A 195 7.982 20.465 2.915 1.00 36.13 N ATOM 1589 HZ1 LYS A 195 8.523 20.742 2.071 1.00 0.00 H ATOM 1590 HZ2 LYS A 195 7.103 19.992 2.625 1.00 0.00 H ATOM 1591 HZ3 LYS A 195 7.753 21.311 3.475 1.00 0.00 H ATOM 1592 H LYS A 195 9.343 16.082 6.791 1.00 0.00 H ATOM 1593 N GLY A 196 12.871 14.511 4.613 1.00 14.62 N ATOM 1594 CA GLY A 196 14.324 14.307 4.642 1.00 15.62 C ATOM 1595 C GLY A 196 14.763 13.119 5.482 1.00 17.60 C ATOM 1596 O GLY A 196 15.935 12.792 5.553 1.00 20.93 O ATOM 1597 H GLY A 196 12.316 14.069 3.853 1.00 0.00 H ATOM 1598 N ARG A 197 13.832 12.466 6.181 1.00 16.45 N ATOM 1599 CA ARG A 197 14.153 11.279 6.992 1.00 15.46 C ATOM 1600 C ARG A 197 14.005 10.009 6.180 1.00 11.89 C ATOM 1601 O ARG A 197 13.531 10.014 5.044 1.00 13.91 O ATOM 1602 CB ARG A 197 13.214 11.232 8.162 1.00 15.47 C ATOM 1603 CG ARG A 197 13.403 12.420 9.094 1.00 19.25 C ATOM 1604 CD ARG A 197 12.429 12.369 10.169 1.00 23.37 C ATOM 1605 NE ARG A 197 12.480 13.511 11.052 1.00 25.25 N ATOM 1606 CZ ARG A 197 13.238 13.605 12.136 1.00 26.03 C ATOM 1607 NH1 ARG A 197 14.136 12.730 12.481 1.00 24.10 N ATOM 1608 NH2 ARG A 197 13.020 14.623 12.910 1.00 29.44 N ATOM 1609 HE ARG A 197 11.874 14.324 10.819 1.00 0.00 H ATOM 1610 HH12 ARG A 197 14.694 12.871 13.347 1.00 0.00 H ATOM 1611 HH11 ARG A 197 14.296 11.889 11.891 1.00 0.00 H ATOM 1612 HH22 ARG A 197 13.584 14.749 13.775 1.00 0.00 H ATOM 1613 HH21 ARG A 197 12.281 15.313 12.666 1.00 0.00 H ATOM 1614 H ARG A 197 12.850 12.806 6.152 1.00 0.00 H ATOM 1615 N THR A 198 14.491 8.907 6.755 1.00 11.98 N ATOM 1616 CA THR A 198 14.348 7.556 6.133 1.00 11.70 C ATOM 1617 C THR A 198 13.655 6.735 7.210 1.00 10.21 C ATOM 1618 O THR A 198 14.181 6.524 8.280 1.00 11.34 O ATOM 1619 CB THR A 198 15.661 6.908 5.725 1.00 12.83 C ATOM 1620 OG1 THR A 198 16.206 7.717 4.661 1.00 14.39 O ATOM 1621 CG2 THR A 198 15.410 5.550 5.162 1.00 13.82 C ATOM 1622 HG1 THR A 198 17.067 7.330 4.362 1.00 0.00 H ATOM 1623 H THR A 198 14.986 8.991 7.666 1.00 0.00 H ATOM 1624 N LEU A 199 12.390 6.387 6.949 1.00 9.16 N ATOM 1625 CA LEU A 199 11.475 5.843 7.944 1.00 9.46 C ATOM 1626 C LEU A 199 10.940 4.478 7.559 1.00 8.86 C ATOM 1627 O LEU A 199 10.568 4.215 6.398 1.00 10.58 O ATOM 1628 CB LEU A 199 10.330 6.820 8.165 1.00 9.50 C ATOM 1629 CG LEU A 199 10.774 8.195 8.697 1.00 10.51 C ATOM 1630 CD1 LEU A 199 9.633 9.212 8.693 1.00 10.20 C ATOM 1631 CD2 LEU A 199 11.464 8.095 9.994 1.00 10.95 C ATOM 1632 H LEU A 199 12.039 6.512 5.978 1.00 0.00 H ATOM 1633 N TYR A 200 10.904 3.596 8.588 1.00 8.60 N ATOM 1634 CA TYR A 200 10.507 2.213 8.381 1.00 7.86 C ATOM 1635 C TYR A 200 9.164 1.984 9.086 1.00 7.86 C ATOM 1636 O TYR A 200 8.986 2.488 10.182 1.00 7.71 O ATOM 1637 CB TYR A 200 11.558 1.302 9.049 1.00 8.08 C ATOM 1638 CG TYR A 200 12.962 1.431 8.463 1.00 8.67 C ATOM 1639 CD1 TYR A 200 13.772 2.568 8.739 1.00 9.02 C ATOM 1640 CD2 TYR A 200 13.437 0.424 7.651 1.00 8.86 C ATOM 1641 CE1 TYR A 200 15.031 2.646 8.207 1.00 9.32 C ATOM 1642 CE2 TYR A 200 14.701 0.496 7.088 1.00 9.22 C ATOM 1643 CZ TYR A 200 15.449 1.618 7.362 1.00 8.76 C ATOM 1644 OH TYR A 200 16.727 1.801 6.769 1.00 11.91 O ATOM 1645 HH TYR A 200 17.321 1.054 7.032 1.00 0.00 H ATOM 1646 H TYR A 200 11.165 3.915 9.543 1.00 0.00 H ATOM 1647 N PRO A 201 8.364 1.081 8.525 1.00 7.48 N ATOM 1648 CA PRO A 201 7.199 0.620 9.283 1.00 7.62 C ATOM 1649 C PRO A 201 7.640 0.085 10.646 1.00 6.61 C ATOM 1650 O PRO A 201 8.652 -0.599 10.759 1.00 7.89 O ATOM 1651 CB PRO A 201 6.658 -0.537 8.410 1.00 7.70 C ATOM 1652 CG PRO A 201 7.075 -0.137 7.007 1.00 7.42 C ATOM 1653 CD PRO A 201 8.455 0.448 7.197 1.00 7.94 C ATOM 1654 N ALA A 202 6.840 0.291 11.692 1.00 7.42 N ATOM 1655 CA ALA A 202 7.214 -0.134 13.041 1.00 6.22 C ATOM 1656 C ALA A 202 6.008 -0.235 13.937 1.00 6.23 C ATOM 1657 O ALA A 202 5.006 0.441 13.737 1.00 7.25 O ATOM 1658 CB ALA A 202 8.218 0.834 13.666 1.00 6.97 C ATOM 1659 H ALA A 202 5.927 0.766 11.545 1.00 0.00 H ATOM 1660 N VAL A 203 6.159 -1.113 14.943 1.00 6.48 N ATOM 1661 CA VAL A 203 5.171 -1.212 15.989 1.00 7.33 C ATOM 1662 C VAL A 203 5.972 -1.479 17.292 1.00 7.30 C ATOM 1663 O VAL A 203 7.132 -1.945 17.233 1.00 8.09 O ATOM 1664 CB VAL A 203 4.163 -2.358 15.799 1.00 8.64 C ATOM 1665 CG1 VAL A 203 3.243 -2.105 14.620 1.00 8.90 C ATOM 1666 CG2 VAL A 203 4.809 -3.660 15.863 1.00 9.72 C ATOM 1667 H VAL A 203 6.997 -1.728 14.968 1.00 0.00 H ATOM 1668 N SER A 204 5.338 -1.258 18.432 1.00 7.12 N ATOM 1669 CA SER A 204 5.867 -1.834 19.694 1.00 8.04 C ATOM 1670 C SER A 204 4.733 -2.499 20.414 1.00 8.02 C ATOM 1671 O SER A 204 3.598 -2.007 20.433 1.00 7.84 O ATOM 1672 CB SER A 204 6.545 -0.800 20.551 1.00 8.01 C ATOM 1673 OG SER A 204 5.704 0.298 20.991 1.00 8.56 O ATOM 1674 HG SER A 204 4.951 -0.058 21.526 1.00 0.00 H ATOM 1675 H SER A 204 4.472 -0.683 18.444 1.00 0.00 H ATOM 1676 N ALA A 205 5.070 -3.653 21.107 1.00 8.65 N ATOM 1677 CA ALA A 205 4.095 -4.585 21.687 1.00 9.07 C ATOM 1678 C ALA A 205 4.592 -5.147 23.015 1.00 9.67 C ATOM 1679 O ALA A 205 5.775 -5.232 23.231 1.00 10.81 O ATOM 1680 CB ALA A 205 3.846 -5.723 20.705 1.00 9.52 C ATOM 1681 H ALA A 205 6.080 -3.872 21.223 1.00 0.00 H ATOM 1682 N VAL A 206 3.570 -5.503 23.791 1.00 9.76 N ATOM 1683 CA VAL A 206 3.769 -6.083 25.117 1.00 10.41 C ATOM 1684 C VAL A 206 3.074 -7.393 25.352 1.00 10.49 C ATOM 1685 O VAL A 206 3.288 -7.988 26.474 1.00 11.96 O ATOM 1686 CB VAL A 206 3.305 -5.067 26.185 1.00 10.96 C ATOM 1687 CG1 VAL A 206 4.099 -3.803 26.175 1.00 12.26 C ATOM 1688 CG2 VAL A 206 1.792 -4.751 26.183 1.00 10.79 C ATOM 1689 H VAL A 206 2.600 -5.364 23.442 1.00 0.00 H ATOM 1690 N TRP A 207 2.287 -7.890 24.442 1.00 10.02 N ATOM 1691 CA TRP A 207 1.418 -9.014 24.659 1.00 11.89 C ATOM 1692 C TRP A 207 2.074 -10.301 24.283 1.00 12.35 C ATOM 1693 O TRP A 207 2.528 -10.494 23.175 1.00 11.52 O ATOM 1694 CB TRP A 207 0.148 -8.829 23.862 1.00 12.81 C ATOM 1695 CG TRP A 207 -0.921 -9.908 24.103 1.00 12.60 C ATOM 1696 CD1 TRP A 207 -1.179 -10.984 23.333 1.00 12.91 C ATOM 1697 CD2 TRP A 207 -1.873 -9.942 25.176 1.00 13.07 C ATOM 1698 NE1 TRP A 207 -2.244 -11.716 23.839 1.00 13.11 N ATOM 1699 CE2 TRP A 207 -2.651 -11.092 24.962 1.00 12.80 C ATOM 1700 CE3 TRP A 207 -2.064 -9.187 26.355 1.00 13.83 C ATOM 1701 CZ2 TRP A 207 -3.657 -11.466 25.827 1.00 14.73 C ATOM 1702 CZ3 TRP A 207 -3.164 -9.590 27.214 1.00 14.32 C ATOM 1703 CH2 TRP A 207 -3.836 -10.724 26.928 1.00 14.42 C ATOM 1704 HE1 TRP A 207 -2.651 -12.581 23.430 1.00 0.00 H ATOM 1705 H TRP A 207 2.287 -7.447 23.501 1.00 0.00 H ATOM 1706 N GLY A 208 2.051 -11.266 25.210 1.00 11.07 N ATOM 1707 CA GLY A 208 2.588 -12.560 24.978 1.00 12.88 C ATOM 1708 C GLY A 208 1.866 -13.268 23.841 1.00 12.05 C ATOM 1709 O GLY A 208 0.633 -13.420 23.887 1.00 12.80 O ATOM 1710 H GLY A 208 1.624 -11.060 26.136 1.00 0.00 H ATOM 1711 N GLN A 209 2.624 -13.764 22.860 1.00 11.99 N ATOM 1712 CA GLN A 209 2.092 -14.425 21.728 1.00 12.64 C ATOM 1713 C GLN A 209 1.225 -13.625 20.812 1.00 12.77 C ATOM 1714 O GLN A 209 0.533 -14.181 19.956 1.00 13.71 O ATOM 1715 CB GLN A 209 1.484 -15.814 22.096 1.00 17.14 C ATOM 1716 CG GLN A 209 2.671 -16.804 22.371 1.00 23.71 C ATOM 1717 CD GLN A 209 2.640 -17.404 23.728 1.00 32.20 C ATOM 1718 OE1 GLN A 209 3.223 -18.478 23.960 1.00 32.29 O ATOM 1719 NE2 GLN A 209 2.001 -16.712 24.656 1.00 33.80 N ATOM 1720 HE22 GLN A 209 1.530 -15.819 24.407 1.00 0.00 H ATOM 1721 HE21 GLN A 209 1.969 -17.061 25.635 1.00 0.00 H ATOM 1722 H GLN A 209 3.656 -13.659 22.932 1.00 0.00 H ATOM 1723 N CYS A 210 1.345 -12.303 20.875 1.00 11.23 N ATOM 1724 CA CYS A 210 0.654 -11.516 19.853 1.00 11.82 C ATOM 1725 C CYS A 210 1.192 -11.765 18.490 1.00 11.07 C ATOM 1726 O CYS A 210 2.439 -12.061 18.358 1.00 12.43 O ATOM 1727 CB CYS A 210 0.684 -10.036 20.195 1.00 11.53 C ATOM 1728 SG CYS A 210 2.228 -9.184 20.097 1.00 11.88 S ATOM 1729 H CYS A 210 1.908 -11.846 21.621 1.00 0.00 H ATOM 1730 N GLN A 211 0.333 -11.744 17.497 1.00 10.73 N ATOM 1731 CA GLN A 211 0.646 -11.920 16.083 1.00 11.43 C ATOM 1732 C GLN A 211 0.230 -10.657 15.345 1.00 10.51 C ATOM 1733 O GLN A 211 -0.926 -10.352 15.225 1.00 12.90 O ATOM 1734 CB GLN A 211 -0.037 -13.143 15.502 1.00 13.96 C ATOM 1735 CG GLN A 211 0.457 -14.463 16.128 1.00 17.50 C ATOM 1736 CD GLN A 211 -0.209 -15.690 15.542 1.00 19.98 C ATOM 1737 OE1 GLN A 211 -1.409 -15.701 15.275 1.00 24.03 O ATOM 1738 NE2 GLN A 211 0.533 -16.788 15.521 1.00 23.49 N ATOM 1739 HE22 GLN A 211 1.545 -16.736 15.753 1.00 0.00 H ATOM 1740 HE21 GLN A 211 0.103 -17.702 15.272 1.00 0.00 H ATOM 1741 H GLN A 211 -0.665 -11.587 17.742 1.00 0.00 H ATOM 1742 N VAL A 212 1.222 -9.915 14.862 1.00 9.00 N ATOM 1743 CA VAL A 212 1.009 -8.644 14.175 1.00 8.71 C ATOM 1744 C VAL A 212 1.362 -8.796 12.743 1.00 8.84 C ATOM 1745 O VAL A 212 2.544 -9.039 12.456 1.00 8.59 O ATOM 1746 CB VAL A 212 1.728 -7.497 14.901 1.00 9.34 C ATOM 1747 CG1 VAL A 212 1.381 -6.183 14.192 1.00 9.52 C ATOM 1748 CG2 VAL A 212 1.351 -7.398 16.334 1.00 9.93 C ATOM 1749 H VAL A 212 2.197 -10.256 14.979 1.00 0.00 H ATOM 1750 N ARG A 213 0.427 -8.630 11.814 1.00 8.15 N ATOM 1751 CA ARG A 213 0.672 -8.772 10.486 1.00 9.59 C ATOM 1752 C ARG A 213 0.868 -7.448 9.786 1.00 9.15 C ATOM 1753 O ARG A 213 0.285 -6.418 10.229 1.00 9.41 O ATOM 1754 CB ARG A 213 -0.517 -9.481 9.834 1.00 11.24 C ATOM 1755 CG ARG A 213 -0.537 -9.708 8.357 1.00 14.87 C ATOM 1756 CD ARG A 213 -1.646 -10.636 7.841 1.00 17.26 C ATOM 1757 NE ARG A 213 -1.455 -11.990 8.246 1.00 15.07 N ATOM 1758 CZ ARG A 213 -0.957 -12.962 7.510 1.00 18.24 C ATOM 1759 NH1 ARG A 213 -0.816 -14.121 8.064 1.00 23.06 N ATOM 1760 NH2 ARG A 213 -0.536 -12.701 6.300 1.00 16.15 N ATOM 1761 HE ARG A 213 -1.736 -12.234 9.217 1.00 0.00 H ATOM 1762 HH12 ARG A 213 -0.426 -14.915 7.517 1.00 0.00 H ATOM 1763 HH11 ARG A 213 -1.092 -14.260 9.057 1.00 0.00 H ATOM 1764 HH22 ARG A 213 -0.141 -13.462 5.711 1.00 0.00 H ATOM 1765 HH21 ARG A 213 -0.596 -11.732 5.926 1.00 0.00 H ATOM 1766 H ARG A 213 -0.536 -8.380 12.117 1.00 0.00 H ATOM 1767 N ILE A 214 1.687 -7.412 8.764 1.00 8.16 N ATOM 1768 CA ILE A 214 1.888 -6.262 7.920 1.00 7.92 C ATOM 1769 C ILE A 214 1.613 -6.640 6.475 1.00 8.69 C ATOM 1770 O ILE A 214 2.223 -7.592 5.999 1.00 10.14 O ATOM 1771 CB ILE A 214 3.285 -5.624 8.135 1.00 8.21 C ATOM 1772 CG1 ILE A 214 3.391 -4.341 7.319 1.00 8.37 C ATOM 1773 CG2 ILE A 214 4.397 -6.645 7.827 1.00 8.03 C ATOM 1774 CD1 ILE A 214 4.643 -3.535 7.673 1.00 9.14 C ATOM 1775 H ILE A 214 2.229 -8.273 8.547 1.00 0.00 H ATOM 1776 N ARG A 215 0.850 -5.864 5.730 1.00 8.75 N ATOM 1777 CA ARG A 215 0.530 -6.059 4.345 1.00 10.83 C ATOM 1778 C ARG A 215 0.837 -4.801 3.600 1.00 10.27 C ATOM 1779 O ARG A 215 0.036 -3.835 3.549 1.00 10.86 O ATOM 1780 CB ARG A 215 -0.940 -6.483 4.142 1.00 11.49 C ATOM 1781 CG ARG A 215 -1.304 -6.744 2.653 1.00 13.70 C ATOM 1782 CD ARG A 215 -2.575 -7.542 2.545 1.00 19.08 C ATOM 1783 NE ARG A 215 -3.670 -6.690 2.873 1.00 20.67 N ATOM 1784 CZ ARG A 215 -4.334 -5.918 2.018 1.00 23.18 C ATOM 1785 NH1 ARG A 215 -3.982 -5.870 0.734 1.00 26.50 N ATOM 1786 NH2 ARG A 215 -5.362 -5.160 2.467 1.00 23.65 N ATOM 1787 HE ARG A 215 -3.976 -6.671 3.867 1.00 0.00 H ATOM 1788 HH12 ARG A 215 -4.508 -5.263 0.073 1.00 0.00 H ATOM 1789 HH11 ARG A 215 -3.182 -6.440 0.393 1.00 0.00 H ATOM 1790 HH22 ARG A 215 -5.888 -4.553 1.806 1.00 0.00 H ATOM 1791 HH21 ARG A 215 -5.626 -5.185 3.473 1.00 0.00 H ATOM 1792 H ARG A 215 0.440 -5.028 6.192 1.00 0.00 H ATOM 1793 N TYR A 216 1.940 -4.771 2.894 1.00 11.30 N ATOM 1794 CA TYR A 216 2.293 -3.643 2.072 1.00 11.55 C ATOM 1795 C TYR A 216 1.311 -3.352 0.992 1.00 12.04 C ATOM 1796 O TYR A 216 0.845 -4.327 0.355 1.00 13.67 O ATOM 1797 CB TYR A 216 3.648 -3.930 1.451 1.00 12.35 C ATOM 1798 CG TYR A 216 4.223 -2.813 0.604 1.00 15.35 C ATOM 1799 CD1 TYR A 216 4.540 -1.564 1.163 1.00 18.13 C ATOM 1800 CD2 TYR A 216 4.540 -3.093 -0.745 1.00 19.62 C ATOM 1801 CE1 TYR A 216 5.180 -0.563 0.343 1.00 19.98 C ATOM 1802 CE2 TYR A 216 5.114 -2.128 -1.564 1.00 19.37 C ATOM 1803 CZ TYR A 216 5.412 -0.909 -1.021 1.00 18.05 C ATOM 1804 OH TYR A 216 5.969 0.050 -1.891 1.00 23.76 O ATOM 1805 HH TYR A 216 6.142 0.887 -1.391 1.00 0.00 H ATOM 1806 H TYR A 216 2.582 -5.589 2.928 1.00 0.00 H ATOM 1807 N LEU A 217 0.891 -2.130 0.805 1.00 12.24 N ATOM 1808 CA LEU A 217 -0.175 -1.790 -0.192 1.00 14.01 C ATOM 1809 C LEU A 217 0.391 -1.092 -1.406 1.00 15.78 C ATOM 1810 O LEU A 217 -0.380 -0.778 -2.362 1.00 17.68 O ATOM 1811 CB LEU A 217 -1.270 -0.991 0.441 1.00 15.63 C ATOM 1812 CG LEU A 217 -2.078 -1.770 1.493 1.00 19.74 C ATOM 1813 CD1 LEU A 217 -3.135 -0.858 2.135 1.00 23.94 C ATOM 1814 CD2 LEU A 217 -2.683 -3.033 0.977 1.00 22.19 C ATOM 1815 H LEU A 217 1.312 -1.364 1.369 1.00 0.00 H ATOM 1816 N GLY A 218 1.665 -0.761 -1.400 1.00 14.22 N ATOM 1817 CA GLY A 218 2.305 -0.130 -2.550 1.00 13.96 C ATOM 1818 C GLY A 218 2.804 1.261 -2.320 1.00 14.92 C ATOM 1819 O GLY A 218 2.799 1.811 -1.188 1.00 14.58 O ATOM 1820 H GLY A 218 2.233 -0.955 -0.550 1.00 0.00 H ATOM 1821 N GLU A 219 3.254 1.877 -3.455 1.00 16.26 N ATOM 1822 CA GLU A 219 3.877 3.182 -3.405 1.00 18.25 C ATOM 1823 C GLU A 219 3.509 3.942 -4.648 1.00 19.77 C ATOM 1824 O GLU A 219 3.113 3.318 -5.627 1.00 19.81 O ATOM 1825 CB GLU A 219 5.393 3.108 -3.294 1.00 22.03 C ATOM 1826 CG GLU A 219 6.061 2.437 -4.469 1.00 24.07 C ATOM 1827 H GLU A 219 3.146 1.398 -4.372 1.00 0.00 H ATOM 1828 N ARG A 220 3.688 5.239 -4.556 1.00 20.47 N ATOM 1829 CA ARG A 220 3.545 6.191 -5.704 1.00 23.20 C ATOM 1830 C ARG A 220 4.528 7.314 -5.518 1.00 28.74 C ATOM 1831 O ARG A 220 4.806 7.700 -4.410 1.00 24.94 O ATOM 1832 CB ARG A 220 2.121 6.729 -5.764 1.00 23.72 C ATOM 1833 CG ARG A 220 1.055 5.751 -6.184 1.00 27.88 C ATOM 1834 H ARG A 220 3.945 5.631 -3.628 1.00 0.00 H ATOM 1835 N GLY A 221 5.148 7.825 -6.579 1.00 31.31 N ATOM 1836 CA GLY A 221 5.917 9.077 -6.451 1.00 30.38 C ATOM 1837 H GLY A 221 5.090 7.342 -7.498 1.00 0.00 H TER 1838 GLY A 221 HETATM 1839 O HOH 1 6.523 7.486 1.702 1.00 18.72 O HETATM 1840 O HOH 2 -2.112 13.878 4.842 1.00 15.25 O HETATM 1841 O HOH 3 -8.868 0.764 20.417 1.00 18.28 O HETATM 1842 O HOH 4 0.979 -4.733 22.765 1.00 12.06 O HETATM 1843 O HOH 5 -4.701 -10.552 12.078 1.00 22.17 O HETATM 1844 O HOH 6 1.140 14.187 -1.106 1.00 15.83 O HETATM 1845 O HOH 7 -9.959 -0.791 8.949 1.00 20.79 O HETATM 1846 O HOH 8 18.241 -4.309 15.018 1.00 16.78 O HETATM 1847 O HOH 9 16.372 -9.339 6.191 1.00 26.05 O HETATM 1848 O HOH 10 13.448 11.923 3.117 1.00 20.23 O HETATM 1849 O HOH 11 -8.227 9.428 20.101 1.00 13.10 O HETATM 1850 O HOH 12 0.313 14.552 3.561 1.00 11.85 O HETATM 1851 O HOH 13 3.905 -6.628 3.926 1.00 11.28 O HETATM 1852 O HOH 14 17.571 -0.405 5.437 1.00 16.70 O HETATM 1853 O HOH 15 6.187 6.562 25.712 1.00 20.21 O HETATM 1854 O HOH 16 -14.452 4.149 7.263 1.00 15.65 O HETATM 1855 O HOH 17 5.441 -19.890 3.006 1.00 17.60 O HETATM 1856 O HOH 18 13.465 -6.314 1.018 1.00 19.50 O HETATM 1857 O HOH 19 -2.272 0.482 23.988 1.00 14.26 O HETATM 1858 O HOH 20 16.661 -9.008 14.570 1.00 19.56 O HETATM 1859 O HOH 21 11.327 13.808 2.227 1.00 27.34 O HETATM 1860 O HOH 22 -2.357 -6.762 7.495 1.00 15.63 O HETATM 1861 O HOH 23 4.215 -0.622 23.106 1.00 11.35 O HETATM 1862 O HOH 24 0.357 10.924 5.676 1.00 11.77 O HETATM 1863 O HOH 25 15.023 -3.080 8.759 1.00 9.59 O HETATM 1864 O HOH 26 -9.649 -8.752 16.739 1.00 18.12 O HETATM 1865 O HOH 27 3.404 0.578 11.175 1.00 7.95 O HETATM 1866 O HOH 28 16.654 5.721 9.279 1.00 13.97 O HETATM 1867 O HOH 29 -2.690 -11.790 13.609 1.00 16.95 O HETATM 1868 O HOH 30 2.542 21.434 0.036 1.00 22.25 O HETATM 1869 O HOH 31 -1.103 -6.259 -0.515 1.00 16.76 O HETATM 1870 O HOH 32 9.403 -2.197 5.118 1.00 10.00 O HETATM 1871 O HOH 33 -7.722 13.910 12.684 1.00 16.67 O HETATM 1872 O HOH 34 7.093 -18.896 9.243 1.00 20.73 O HETATM 1873 O HOH 35 11.729 15.491 15.987 1.00 28.26 O HETATM 1874 O HOH 36 15.709 0.374 3.282 1.00 19.55 O HETATM 1875 O HOH 37 2.167 16.285 -2.326 1.00 21.81 O HETATM 1876 O HOH 38 10.206 -15.755 8.485 1.00 20.40 O HETATM 1877 O HOH 39 11.680 3.236 19.949 1.00 12.47 O HETATM 1878 O HOH 40 0.657 -9.783 5.040 1.00 13.50 O HETATM 1879 O HOH 41 7.974 14.970 13.766 1.00 19.97 O HETATM 1880 O HOH 42 0.512 19.377 3.444 1.00 19.51 O HETATM 1881 O HOH 43 13.309 5.165 24.041 1.00 21.53 O HETATM 1882 O HOH 44 -13.472 -2.509 16.647 1.00 22.38 O HETATM 1883 O HOH 45 18.174 -0.658 11.697 1.00 13.87 O HETATM 1884 O HOH 46 11.554 5.873 -0.542 1.00 20.28 O HETATM 1885 O HOH 47 9.037 17.982 7.140 1.00 25.09 O HETATM 1886 O HOH 48 3.846 16.375 14.227 1.00 19.93 O HETATM 1887 O HOH 49 -12.048 -5.529 14.094 1.00 19.44 O HETATM 1888 O HOH 50 -7.681 -1.582 21.173 1.00 19.17 O HETATM 1889 O HOH 51 16.114 9.477 9.194 1.00 22.83 O HETATM 1890 O HOH 52 -10.763 -4.800 11.044 1.00 19.79 O HETATM 1891 O HOH 53 5.060 -17.965 29.518 1.00 21.47 O HETATM 1892 O HOH 54 -2.216 -16.673 23.101 1.00 20.87 O HETATM 1893 N ARG A 55 1.825 -16.815 33.921 1.00 -0.10 N HETATM 1894 CA ARG A 55 0.798 -16.832 34.897 1.00 0.29 C HETATM 1895 C ARG A 55 0.909 -15.620 35.788 1.00 0.26 C HETATM 1896 O ARG A 55 1.972 -15.245 36.261 1.00 -0.34 O HETATM 1897 N ARG A 55 -0.224 -14.976 35.967 1.00 -0.26 N HETATM 1898 CA ARG A 55 -0.351 -13.809 36.804 1.00 0.12 C HETATM 1899 C ARG A 55 -0.099 -12.430 36.183 1.00 0.20 C HETATM 1900 O ARG A 55 -0.245 -11.443 36.833 1.00 -0.39 O HETATM 1901 N ARG A 55 0.383 -12.386 34.969 1.00 -0.26 N HETATM 1902 CA ARG A 55 0.822 -11.137 34.360 1.00 0.14 C HETATM 1903 C ARG A 55 -0.309 -10.533 33.512 1.00 0.21 C HETATM 1904 O ARG A 55 -0.966 -11.263 32.775 1.00 -0.39 O HETATM 1905 N ARG A 55 -0.410 -9.209 33.551 1.00 -0.26 N HETATM 1906 CA ARG A 55 -1.464 -8.454 32.860 1.00 0.13 C HETATM 1907 C ARG A 55 -1.420 -8.619 31.328 1.00 0.20 C HETATM 1908 O ARG A 55 -2.422 -8.362 30.642 1.00 -0.39 O HETATM 1909 N ARG A 55 -0.228 -8.882 30.793 1.00 -0.26 N HETATM 1910 CA ARG A 55 0.028 -8.926 29.324 1.00 0.15 C HETATM 1911 C ARG A 55 0.289 -10.297 28.723 1.00 0.21 C HETATM 1912 O ARG A 55 0.918 -10.484 27.674 1.00 -0.39 O HETATM 1913 N ARG A 55 -0.253 -11.348 29.396 1.00 -0.26 N HETATM 1914 CA ARG A 55 -0.254 -12.712 28.826 1.00 0.15 C HETATM 1915 C ARG A 55 1.168 -13.302 28.703 1.00 0.21 C HETATM 1916 O ARG A 55 1.426 -14.050 27.832 1.00 -0.39 O HETATM 1917 N ARG A 55 2.055 -12.854 29.564 1.00 -0.26 N HETATM 1918 CA ARG A 55 3.468 -13.284 29.377 1.00 0.15 C HETATM 1919 C ARG A 55 3.814 -14.496 30.228 1.00 0.21 C HETATM 1920 O ARG A 55 4.750 -15.179 29.876 1.00 -0.39 O HETATM 1921 N ARG A 55 3.068 -14.667 31.307 1.00 -0.26 N HETATM 1922 CA ARG A 55 3.212 -15.802 32.213 1.00 0.14 C HETATM 1923 C ARG A 55 2.054 -15.710 33.217 1.00 0.23 C HETATM 1924 O ARG A 55 1.314 -14.712 33.310 1.00 -0.39 O HETATM 1925 CB ARG A 55 4.571 -15.691 32.884 1.00 -0.01 C HETATM 1926 CG1 ARG A 55 4.603 -14.487 33.802 1.00 -0.06 C HETATM 1927 H51 ARG A 55 5.591 -14.418 34.281 1.00 0.02 H HETATM 1928 H52 ARG A 55 3.827 -14.594 34.575 1.00 0.02 H HETATM 1929 H53 ARG A 55 4.414 -13.575 33.217 1.00 0.02 H HETATM 1930 CG2 ARG A 55 5.014 -17.034 33.558 1.00 -0.06 C HETATM 1931 H54 ARG A 55 4.960 -17.849 32.821 1.00 0.02 H HETATM 1932 H55 ARG A 55 4.346 -17.258 34.403 1.00 0.02 H HETATM 1933 H56 ARG A 55 6.047 -16.938 33.923 1.00 0.02 H HETATM 1934 H50 ARG A 55 5.305 -15.495 32.088 1.00 0.03 H HETATM 1935 H49 ARG A 55 3.151 -16.751 31.660 1.00 0.08 H HETATM 1936 H48 ARG A 55 2.369 -13.982 31.513 1.00 0.19 H HETATM 1937 CB ARG A 55 4.406 -12.083 29.595 1.00 0.08 C HETATM 1938 CG ARG A 55 4.327 -11.090 28.416 1.00 0.18 C HETATM 1939 OD1 ARG A 55 4.387 -11.537 27.308 1.00 -0.40 O HETATM 1940 ND2 ARG A 55 3.981 -9.853 28.682 1.00 -0.30 N HETATM 1941 H46 ARG A 55 3.919 -9.181 27.944 1.00 0.18 H HETATM 1942 H47 ARG A 55 3.779 -9.582 29.623 1.00 0.18 H HETATM 1943 H44 ARG A 55 5.440 -12.448 29.688 1.00 0.06 H HETATM 1944 H45 ARG A 55 4.115 -11.564 30.520 1.00 0.06 H HETATM 1945 H43 ARG A 55 3.581 -13.595 28.328 1.00 0.08 H HETATM 1946 H42 ARG A 55 1.791 -12.248 30.315 1.00 0.19 H HETATM 1947 CB ARG A 55 -1.071 -12.833 27.503 1.00 0.08 C HETATM 1948 CG ARG A 55 -1.244 -14.258 27.046 1.00 0.18 C HETATM 1949 OD1 ARG A 55 -1.663 -15.179 27.858 1.00 -0.40 O HETATM 1950 ND2 ARG A 55 -1.080 -14.518 25.814 1.00 -0.30 N HETATM 1951 H40 ARG A 55 -1.188 -15.455 25.482 1.00 0.18 H HETATM 1952 H41 ARG A 55 -0.842 -13.786 25.176 1.00 0.18 H HETATM 1953 H38 ARG A 55 -0.546 -12.273 26.715 1.00 0.06 H HETATM 1954 H39 ARG A 55 -2.066 -12.393 27.664 1.00 0.06 H HETATM 1955 H37 ARG A 55 -0.779 -13.342 29.559 1.00 0.08 H HETATM 1956 H36 ARG A 55 -0.660 -11.194 30.297 1.00 0.19 H HETATM 1957 CB ARG A 55 1.155 -7.949 28.983 1.00 0.08 C HETATM 1958 CG ARG A 55 0.669 -6.484 28.922 1.00 0.18 C HETATM 1959 OD1 ARG A 55 -0.419 -6.214 28.358 1.00 -0.40 O HETATM 1960 ND2 ARG A 55 1.425 -5.567 29.501 1.00 -0.30 N HETATM 1961 H34 ARG A 55 1.147 -4.607 29.485 1.00 0.18 H HETATM 1962 H35 ARG A 55 2.275 -5.834 29.955 1.00 0.18 H HETATM 1963 H32 ARG A 55 1.575 -8.223 28.004 1.00 0.06 H HETATM 1964 H33 ARG A 55 1.937 -8.030 29.753 1.00 0.06 H HETATM 1965 H31 ARG A 55 -0.887 -8.554 28.840 1.00 0.08 H HETATM 1966 H30 ARG A 55 0.538 -9.060 31.411 1.00 0.19 H HETATM 1967 CB ARG A 55 -1.415 -6.965 33.303 1.00 -0.00 C HETATM 1968 CG1 ARG A 55 -2.680 -6.173 32.885 1.00 -0.05 C HETATM 1969 CD1 ARG A 55 -3.271 -5.265 33.931 1.00 -0.06 C HETATM 1970 H27 ARG A 55 -4.158 -4.761 33.520 1.00 0.02 H HETATM 1971 H28 ARG A 55 -2.525 -4.512 34.227 1.00 0.02 H HETATM 1972 H29 ARG A 55 -3.561 -5.859 34.810 1.00 0.02 H HETATM 1973 H22 ARG A 55 -3.453 -6.902 32.598 1.00 0.03 H HETATM 1974 H23 ARG A 55 -2.417 -5.555 32.014 1.00 0.03 H HETATM 1975 CG2 ARG A 55 -0.162 -6.247 32.814 1.00 -0.06 C HETATM 1976 H24 ARG A 55 0.729 -6.817 33.116 1.00 0.02 H HETATM 1977 H25 ARG A 55 -0.120 -5.240 33.256 1.00 0.02 H HETATM 1978 H26 ARG A 55 -0.191 -6.165 31.717 1.00 0.02 H HETATM 1979 H21 ARG A 55 -1.381 -6.965 34.403 1.00 0.03 H HETATM 1980 H20 ARG A 55 -2.429 -8.863 33.193 1.00 0.08 H HETATM 1981 H19 ARG A 55 0.268 -8.698 34.079 1.00 0.19 H HETATM 1982 CB ARG A 55 2.038 -11.459 33.478 1.00 0.04 C HETATM 1983 CG ARG A 55 2.470 -10.260 32.618 1.00 0.04 C HETATM 1984 OD1 ARG A 55 3.196 -9.388 33.144 1.00 -0.57 O HETATM 1985 OD2 ARG A 55 2.101 -10.366 31.429 1.00 -0.57 O HETATM 1986 H17 ARG A 55 1.781 -12.297 32.813 1.00 0.05 H HETATM 1987 H18 ARG A 55 2.878 -11.750 34.126 1.00 0.05 H HETATM 1988 H16 ARG A 55 1.109 -10.421 35.144 1.00 0.08 H HETATM 1989 H15 ARG A 55 0.453 -13.234 34.443 1.00 0.19 H HETATM 1990 H13 ARG A 55 0.361 -13.926 37.634 1.00 0.08 H HETATM 1991 H14 ARG A 55 -1.377 -13.804 37.200 1.00 0.08 H HETATM 1992 H12 ARG A 55 -1.040 -15.314 35.498 1.00 0.19 H HETATM 1993 CB ARG A 55 0.848 -18.130 35.713 1.00 0.01 C HETATM 1994 CG ARG A 55 0.056 -18.025 37.019 1.00 -0.02 C HETATM 1995 CD ARG A 55 -0.051 -19.411 37.630 1.00 0.06 C HETATM 1996 NE ARG A 55 1.186 -19.878 38.258 1.00 -0.27 N HETATM 1997 CZ ARG A 55 1.577 -19.596 39.501 1.00 0.29 C HETATM 1998 NH1 ARG A 55 0.862 -18.776 40.284 1.00 -0.28 N HETATM 1999 H8 ARG A 55 1.181 -18.570 41.242 1.00 0.26 H HETATM 2000 H9 ARG A 55 -0.006 -18.351 39.928 1.00 0.26 H HETATM 2001 NH2 ARG A 55 2.705 -20.130 39.960 1.00 -0.28 N HETATM 2002 H10 ARG A 55 3.257 -20.761 39.361 1.00 0.26 H HETATM 2003 H11 ARG A 55 3.026 -19.913 40.914 1.00 0.26 H HETATM 2004 H7 ARG A 55 1.806 -20.474 37.692 1.00 0.26 H HETATM 2005 H5 ARG A 55 -0.325 -20.120 36.835 1.00 0.07 H HETATM 2006 H6 ARG A 55 -0.842 -19.393 38.394 1.00 0.07 H HETATM 2007 H3 ARG A 55 -0.950 -17.632 36.812 1.00 0.03 H HETATM 2008 H4 ARG A 55 0.577 -17.352 37.716 1.00 0.03 H HETATM 2009 H1 ARG A 55 1.897 -18.357 35.953 1.00 0.03 H HETATM 2010 H2 ARG A 55 0.425 -18.945 35.107 1.00 0.03 H HETATM 2011 OXT ARG A 55 1.770 -16.627 34.012 1.00 -0.21 O HETATM 2012 CD2 UNK 56 -11.172 18.845 -0.336 1.00 33.77 C CONECT 1 2 5 6 7 CONECT 5 1 CONECT 6 1 CONECT 7 1 CONECT 1167 1164 1168 1171 1172 CONECT 1171 1167 CONECT 1172 1167 CONECT 1893 1894 1923 2011 CONECT 1894 1893 1895 1993 2011 CONECT 1895 1894 1896 1897 CONECT 1896 1895 CONECT 1897 1895 1898 1992 CONECT 1898 1897 1899 1990 1991 CONECT 1899 1898 1900 1901 CONECT 1900 1899 CONECT 1901 1899 1902 1989 CONECT 1902 1901 1903 1982 1988 CONECT 1903 1902 1904 1905 CONECT 1904 1903 CONECT 1905 1903 1906 1981 CONECT 1906 1905 1907 1967 1980 CONECT 1907 1906 1908 1909 CONECT 1908 1907 CONECT 1909 1907 1910 1966 CONECT 1910 1909 1911 1957 1965 CONECT 1911 1910 1912 1913 CONECT 1912 1911 CONECT 1913 1911 1914 1956 CONECT 1914 1913 1915 1947 1955 CONECT 1915 1914 1916 1917 CONECT 1916 1915 CONECT 1917 1915 1918 1946 CONECT 1918 1917 1919 1937 1945 CONECT 1919 1918 1920 1921 CONECT 1920 1919 CONECT 1921 1919 1922 1936 CONECT 1922 1921 1923 1925 1935 CONECT 1923 1893 1922 1924 CONECT 1924 1923 CONECT 1925 1922 1926 1930 1934 CONECT 1926 1925 1927 1928 1929 CONECT 1927 1926 CONECT 1928 1926 CONECT 1929 1926 CONECT 1930 1925 1931 1932 1933 CONECT 1931 1930 CONECT 1932 1930 CONECT 1933 1930 CONECT 1934 1925 CONECT 1935 1922 CONECT 1936 1921 CONECT 1937 1918 1938 1943 1944 CONECT 1938 1937 1939 1940 CONECT 1939 1938 CONECT 1940 1938 1941 1942 CONECT 1941 1940 CONECT 1942 1940 CONECT 1943 1937 CONECT 1944 1937 CONECT 1945 1918 CONECT 1946 1917 CONECT 1947 1914 1948 1953 1954 CONECT 1948 1947 1949 1950 CONECT 1949 1948 CONECT 1950 1948 1951 1952 CONECT 1951 1950 CONECT 1952 1950 CONECT 1953 1947 CONECT 1954 1947 CONECT 1955 1914 CONECT 1956 1913 CONECT 1957 1910 1958 1963 1964 CONECT 1958 1957 1959 1960 CONECT 1959 1958 CONECT 1960 1958 1961 1962 CONECT 1961 1960 CONECT 1962 1960 CONECT 1963 1957 CONECT 1964 1957 CONECT 1965 1910 CONECT 1966 1909 CONECT 1967 1906 1968 1975 1979 CONECT 1968 1967 1969 1973 1974 CONECT 1969 1968 1970 1971 1972 CONECT 1970 1969 CONECT 1971 1969 CONECT 1972 1969 CONECT 1973 1968 CONECT 1974 1968 CONECT 1975 1967 1976 1977 1978 CONECT 1976 1975 CONECT 1977 1975 CONECT 1978 1975 CONECT 1979 1967 CONECT 1980 1906 CONECT 1981 1905 CONECT 1982 1902 1983 1986 1987 CONECT 1983 1982 1984 1985 CONECT 1984 1983 CONECT 1985 1983 CONECT 1986 1982 CONECT 1987 1982 CONECT 1988 1902 CONECT 1989 1901 CONECT 1990 1898 CONECT 1991 1898 CONECT 1992 1897 CONECT 1993 1894 1994 2009 2010 CONECT 1994 1993 1995 2007 2008 CONECT 1995 1994 1996 2005 2006 CONECT 1996 1995 1997 2004 CONECT 1997 1996 1998 2001 CONECT 1998 1997 1999 2000 CONECT 1999 1998 CONECT 2000 1998 CONECT 2001 1997 2002 2003 CONECT 2002 2001 CONECT 2003 2001 CONECT 2004 1996 CONECT 2005 1995 CONECT 2006 1995 CONECT 2007 1994 CONECT 2008 1994 CONECT 2009 1993 CONECT 2010 1993 CONECT 2011 1893 1894 MASTER 0 0 0 0 0 0 0 0 2011 1 126 16 END
Display Options:
Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
Goto PDB code:
3D presentation of molecule is powered by
3Dmol
, which supports all modern browsers and mobile devices via WebGL.
Hold mouse button:
left to rotate,middle to shift,right to zoom
Related entries of code: 5xn3
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
6dn6
RCSB PDB
PDBbind
217aa, >6DN6_1|Chain... at 100%
6dn5
RCSB PDB
PDBbind
217aa, >6DN5_1|Chain... *
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
1fo0
RCSB PDB
PDBbind
8-mer
1fzj
RCSB PDB
PDBbind
8-mer
1fzm
RCSB PDB
PDBbind
8-mer
1g6r
RCSB PDB
PDBbind
8-mer
1g7q
RCSB PDB
PDBbind
8-mer
1leg
RCSB PDB
PDBbind
8-mer
1lek
RCSB PDB
PDBbind
8-mer
1nlp
RCSB PDB
PDBbind
8-mer
1nzl
RCSB PDB
PDBbind
8-mer
1nzv
RCSB PDB
PDBbind
8-mer
1obx
RCSB PDB
PDBbind
8-mer
1okx
RCSB PDB
PDBbind
8-mer
1p2g
RCSB PDB
PDBbind
8-mer
1pig
RCSB PDB
PDBbind
8-mer
1pz5
RCSB PDB
PDBbind
8-mer
1qja
RCSB PDB
PDBbind
8-mer
1qjb
RCSB PDB
PDBbind
8-mer
1qr3
RCSB PDB
PDBbind
8-mer
1sle
RCSB PDB
PDBbind
8-mer
1tps
RCSB PDB
PDBbind
8-mer
2c1n
RCSB PDB
PDBbind
8-mer
2clv
RCSB PDB
PDBbind
8-mer
2er0
RCSB PDB
PDBbind
8-mer
2er9
RCSB PDB
PDBbind
8-mer
2fo4
RCSB PDB
PDBbind
8-mer
2h6k
RCSB PDB
PDBbind
8-mer
2kbs
RCSB PDB
PDBbind
8-mer
2qbw
RCSB PDB
PDBbind
8-mer
2r03
RCSB PDB
PDBbind
8-mer
2r9b
RCSB PDB
PDBbind
8-mer
2rly
RCSB PDB
PDBbind
8-mer
2rt5
RCSB PDB
PDBbind
8-mer
2v88
RCSB PDB
PDBbind
8-mer
2w16
RCSB PDB
PDBbind
8-mer
2w3o
RCSB PDB
PDBbind
8-mer
2ynn
RCSB PDB
PDBbind
8-mer
2zpk
RCSB PDB
PDBbind
8-mer
3agm
RCSB PDB
PDBbind
8-mer
3av9
RCSB PDB
PDBbind
8-mer
3ava
RCSB PDB
PDBbind
8-mer
3avb
RCSB PDB
PDBbind
8-mer
3avf
RCSB PDB
PDBbind
8-mer
3avg
RCSB PDB
PDBbind
8-mer
3avh
RCSB PDB
PDBbind
8-mer
3avi
RCSB PDB
PDBbind
8-mer
3avj
RCSB PDB
PDBbind
8-mer
3avk
RCSB PDB
PDBbind
8-mer
3avl
RCSB PDB
PDBbind
8-mer
3avm
RCSB PDB
PDBbind
8-mer
3avn
RCSB PDB
PDBbind
8-mer
3drf
RCSB PDB
PDBbind
8-mer
3ds9
RCSB PDB
PDBbind
8-mer
3eyu
RCSB PDB
PDBbind
8-mer
3h85
RCSB PDB
PDBbind
8-mer
3i91
RCSB PDB
PDBbind
8-mer
3jvk
RCSB PDB
PDBbind
8-mer
3kze
RCSB PDB
PDBbind
8-mer
3muk
RCSB PDB
PDBbind
8-mer
3n5e
RCSB PDB
PDBbind
8-mer
3nf3
RCSB PDB
PDBbind
8-mer
3omc
RCSB PDB
PDBbind
8-mer
3omg
RCSB PDB
PDBbind
8-mer
3p9l
RCSB PDB
PDBbind
8-mer
3p9m
RCSB PDB
PDBbind
8-mer
3pab
RCSB PDB
PDBbind
8-mer
3qg6
RCSB PDB
PDBbind
8-mer
3rdv
RCSB PDB
PDBbind
8-mer
3rwh
RCSB PDB
PDBbind
8-mer
3rwj
RCSB PDB
PDBbind
8-mer
3unn
RCSB PDB
PDBbind
8-mer
3uqp
RCSB PDB
PDBbind
8-mer
3uri
RCSB PDB
PDBbind
8-mer
3uyr
RCSB PDB
PDBbind
8-mer
3zev
RCSB PDB
PDBbind
8-mer
3zvy
RCSB PDB
PDBbind
8-mer
3zyr
RCSB PDB
PDBbind
8-mer
4aa1
RCSB PDB
PDBbind
8-mer
4aph
RCSB PDB
PDBbind
8-mer
4apr
RCSB PDB
PDBbind
8-mer
4dv9
RCSB PDB
PDBbind
8-mer
4e67
RCSB PDB
PDBbind
8-mer
4eoy
RCSB PDB
PDBbind
8-mer
4ep2
RCSB PDB
PDBbind
8-mer
4eqj
RCSB PDB
PDBbind
8-mer
4ezr
RCSB PDB
PDBbind
8-mer
4fmo
RCSB PDB
PDBbind
8-mer
4fn5
RCSB PDB
PDBbind
8-mer
4gpk
RCSB PDB
PDBbind
8-mer
4gvc
RCSB PDB
PDBbind
8-mer
4gvd
RCSB PDB
PDBbind
8-mer
4gvu
RCSB PDB
PDBbind
8-mer
4h36
RCSB PDB
PDBbind
8-mer
4h75
RCSB PDB
PDBbind
8-mer
4ii9
RCSB PDB
PDBbind
8-mer
4jiz
RCSB PDB
PDBbind
8-mer
4lkl
RCSB PDB
PDBbind
8-mer
4lkm
RCSB PDB
PDBbind
8-mer
4mji
RCSB PDB
PDBbind
8-mer
4nxq
RCSB PDB
PDBbind
8-mer
4nxr
RCSB PDB
PDBbind
8-mer
4o2f
RCSB PDB
PDBbind
8-mer
4rxh
RCSB PDB
PDBbind
8-mer
4y7r
RCSB PDB
PDBbind
8-mer
4ysi
RCSB PDB
PDBbind
8-mer
5d7e
RCSB PDB
PDBbind
8-mer
5e2q
RCSB PDB
PDBbind
8-mer
5elq
RCSB PDB
PDBbind
8-mer
5em9
RCSB PDB
PDBbind
8-mer
5ema
RCSB PDB
PDBbind
8-mer
5emb
RCSB PDB
PDBbind
8-mer
5fjx
RCSB PDB
PDBbind
8-mer
5fpi
RCSB PDB
PDBbind
8-mer
5gmv
RCSB PDB
PDBbind
8-mer
5hjb
RCSB PDB
PDBbind
8-mer
5i25
RCSB PDB
PDBbind
8-mer
5iok
RCSB PDB
PDBbind
8-mer
5iql
RCSB PDB
PDBbind
8-mer
5jjm
RCSB PDB
PDBbind
8-mer
5mgx
RCSB PDB
PDBbind
8-mer
5n70
RCSB PDB
PDBbind
8-mer
5svi
RCSB PDB
PDBbind
8-mer
5sxm
RCSB PDB
PDBbind
8-mer
5t6p
RCSB PDB
PDBbind
8-mer
5t78
RCSB PDB
PDBbind
8-mer
5teg
RCSB PDB
PDBbind
8-mer
5tkj
RCSB PDB
PDBbind
8-mer
5tkk
RCSB PDB
PDBbind
8-mer
5vwi
RCSB PDB
PDBbind
8-mer
5vwk
RCSB PDB
PDBbind
8-mer
5wou
RCSB PDB
PDBbind
8-mer
5wtt
RCSB PDB
PDBbind
8-mer
5xjm
RCSB PDB
PDBbind
8-mer
5yba
RCSB PDB
PDBbind
8-mer
6cdm
RCSB PDB
PDBbind
8-mer
6cdo
RCSB PDB
PDBbind
8-mer
6cdp
RCSB PDB
PDBbind
8-mer
6e86
RCSB PDB
PDBbind
8-mer
6eww
RCSB PDB
PDBbind
8-mer
6fau
RCSB PDB
PDBbind
8-mer
6fav
RCSB PDB
PDBbind
8-mer
6faw
RCSB PDB
PDBbind
8-mer
6fbw
RCSB PDB
PDBbind
8-mer
6fby
RCSB PDB
PDBbind
8-mer
6fel
RCSB PDB
PDBbind
8-mer
6fi4
RCSB PDB
PDBbind
8-mer
6fi5
RCSB PDB
PDBbind
8-mer
6fmp
RCSB PDB
PDBbind
8-mer
6fx1
RCSB PDB
PDBbind
8-mer
6hpg
RCSB PDB
PDBbind
8-mer
6min
RCSB PDB
PDBbind
8-mer
6miq
RCSB PDB
PDBbind
8-mer
6q3q
RCSB PDB
PDBbind
8-mer
6r0x
RCSB PDB
PDBbind
8-mer
6qk8
RCSB PDB
PDBbind
8-mer
6q4q
RCSB PDB
PDBbind
8-mer
6mtv
RCSB PDB
PDBbind
8-mer
6mtu
RCSB PDB
PDBbind
8-mer
6ms1
RCSB PDB
PDBbind
8-mer
6mqe
RCSB PDB
PDBbind
8-mer
6mqc
RCSB PDB
PDBbind
8-mer
6jax
RCSB PDB
PDBbind
8-mer
6hmt
RCSB PDB
PDBbind
8-mer
6hhp
RCSB PDB
PDBbind
8-mer
6dtn
RCSB PDB
PDBbind
8-mer
6dql
RCSB PDB
PDBbind
8-mer
6do1
RCSB PDB
PDBbind
8-mer
Entry Information
PDB ID
5xn3
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
SPRY domain-containing SOCS box protein 2
Ligand Name
8-mer
EC.Number
E.C.-.-.-.-
Resolution
1.34(Å)
Affinity (Kd/Ki/IC50)
Kd=671nM
Release Year
2017
Protein/NA Sequence
Check fasta file
Primary Reference
(2017) Biochem. Biophys. Res. Commun. Vol. 489: pp. 346-352
Ligand Properties
Formula
C
3
5
H
5
7
N
1
4
O
1
4
Molecular Weight
897.912
Exact Mass
897.418
No. of atoms
120
No. of bonds
121
Polar Surface Area
468.89
LOGP Value
-3.30 (
Computed with XLOGP3
)
-3.83 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 10
No. of Hydrogen Bond Acceptors: 13
No. of Rotatable Bonds: 14
No. of Nitrogen and Oxygen Atoms: 28
No. of Rings: 2
Canonical SMILES
CC[C@@H]([C@@H]1NC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@@]2(CCC[NH+]=C(N)N)ON2C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CC(=O)N)CC(=O)N)CC(=O)N)C(C)C)C
InChI String
InChI=1S/C35H56N14O14/c1-5-15(4)26-31(60)46-17(10-21(37)51)28(57)44-16(9-20(36)50)27(56)45-18(11-22(38)52)29(58)47-25(14(2)3)32(61)49-35(63-49,7-6-8-41-34(39)40)33(62)42-13-23(53)43-19(12-24(54)55)30(59)48-26/h14-19,25-26H,5-13H2,1-4H3,(H2,36,50)(H2,37,51)(H2,38,52)(H,42,62)(H,43,53)(H,44,57)(H,45,56)(H,46,60)(H,47,58)(H,48,59)(H,54,55)(H4,39,40,41)/p+1/t15-,16-,17-,18-,19-,25-,26-,35?,49?/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
Q99619
P35228
Entrez Gene ID
NCBI Entrez Gene ID:
84727
4843
ASD
Information of known allosteric effects of PDB entries
This site has been visited
times since Nov 2007.
Copyright ©2007-2024 涓婃捣鐩堣禌鎬濅俊鎭鎶鏈夐檺鍏徃 缃戠珯澶囨鍙凤細
娌狪CP澶2021015625鍙-3
娌叕缃戝畨澶囷細
姝e湪鐢宠涓
Technical Support锛堟妧鏈敮鎸侊級:
yingsaisi@foxmail.com