Browse entries in the PDBbind-CN Database
HEADER 3DJO_COMPLEX COMPND 3DJO_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 124 LYS GLU SER ALA ALA ALA LYS PHE GLU ARG GLN HIS MET SEQRES 2 A 124 ASP SER GLY ASN SER PRO SER SER SER SER ASN TYR CYS SEQRES 3 A 124 ASN LEU MET MET CYS CYS ARG LYS MET THR GLN GLY LYS SEQRES 4 A 124 CYS LYS PRO VAL ASN THR PHE VAL HIS GLU SER LEU ALA SEQRES 5 A 124 ASP VAL LYS ALA VAL CYS SER GLN LYS LYS VAL THR CYS SEQRES 6 A 124 LYS ASN GLY GLN THR ASN CYS TYR GLN SER LYS SER THR SEQRES 7 A 124 MET ARG ILE THR ASP CYS ARG GLU THR GLY SER SER LYS SEQRES 8 A 124 TYR PRO ASN CYS ALA TYR LYS THR THR GLN VAL GLU LYS SEQRES 9 A 124 HIS ILE ILE VAL ALA CYS GLY GLY LYS PRO SER VAL PRO SEQRES 10 A 124 VAL HIS PHE ASP ALA SER VAL SEQRES 1 B 124 LYS GLU SER ALA ALA ALA LYS PHE GLU ARG GLN HIS MET SEQRES 2 B 124 ASP SER GLY ASN SER PRO SER SER SER SER ASN TYR CYS SEQRES 3 B 124 ASN LEU MET MET CYS CYS ARG LYS MET THR GLN GLY LYS SEQRES 4 B 124 CYS LYS PRO VAL ASN THR PHE VAL HIS GLU SER LEU ALA SEQRES 5 B 124 ASP VAL LYS ALA VAL CYS SER GLN LYS LYS VAL THR CYS SEQRES 6 B 124 LYS ASN GLY GLN THR ASN CYS TYR GLN SER LYS SER THR SEQRES 7 B 124 MET ARG ILE THR ASP CYS ARG GLU THR GLY SER SER LYS SEQRES 8 B 124 TYR PRO ASN CYS ALA TYR LYS THR THR GLN VAL GLU LYS SEQRES 9 B 124 HIS ILE ILE VAL ALA CYS GLY GLY LYS PRO SER VAL PRO SEQRES 10 B 124 VAL HIS PHE ASP ALA SER VAL HET U A 2P 32 SSBOND 1 CYS A 65 CYS A 72 SSBOND 2 CYS A 26 CYS A 84 SSBOND 3 CYS A 40 CYS A 95 SSBOND 4 CYS A 58 CYS A 110 SSBOND 5 CYS B 65 CYS B 72 SSBOND 6 CYS B 26 CYS B 84 SSBOND 7 CYS B 40 CYS B 95 SSBOND 8 CYS B 58 CYS B 110 SSBOND 9 CYS A 32 CYS B 31 SSBOND 10 CYS A 31 CYS B 32 ATOM 1 N LYS A 1 15.693 22.628 32.900 1.00 12.76 N ATOM 2 CA LYS A 1 15.436 21.423 32.057 1.00 12.64 C ATOM 3 C LYS A 1 14.453 21.750 30.932 1.00 12.00 C ATOM 4 O LYS A 1 13.348 22.234 31.195 1.00 12.41 O ATOM 5 CB LYS A 1 14.900 20.281 32.936 1.00 12.90 C ATOM 6 CG LYS A 1 14.300 19.087 32.187 1.00 14.04 C ATOM 7 CD LYS A 1 15.363 18.100 31.730 1.00 15.28 C ATOM 8 CE LYS A 1 14.727 16.847 31.158 1.00 16.28 C ATOM 9 NZ LYS A 1 15.735 15.934 30.545 1.00 17.24 N ATOM 10 HA LYS A 1 16.373 21.105 31.599 1.00 0.00 H ATOM 11 HB2 LYS A 1 15.725 19.913 33.546 1.00 0.00 H ATOM 12 HB3 LYS A 1 14.126 20.693 33.584 1.00 0.00 H ATOM 13 HG2 LYS A 1 13.604 18.572 32.849 1.00 0.00 H ATOM 14 HG3 LYS A 1 13.763 19.455 31.312 1.00 0.00 H ATOM 15 HD2 LYS A 1 15.980 18.569 30.964 1.00 0.00 H ATOM 16 HD3 LYS A 1 15.987 17.827 32.581 1.00 0.00 H ATOM 17 HE2 LYS A 1 14.005 17.136 30.395 1.00 0.00 H ATOM 18 HE3 LYS A 1 14.213 16.316 31.960 1.00 0.00 H ATOM 19 HZ1 LYS A 1 16.226 16.429 29.773 1.00 0.00 H ATOM 20 HZ2 LYS A 1 16.425 15.646 31.268 1.00 0.00 H ATOM 21 HZ3 LYS A 1 15.255 15.092 30.168 1.00 0.00 H ATOM 22 HN3 LYS A 1 14.798 22.954 33.319 1.00 0.00 H ATOM 23 HN2 LYS A 1 16.096 23.383 32.309 1.00 0.00 H ATOM 24 HN1 LYS A 1 16.363 22.383 33.657 1.00 0.00 H ATOM 25 N GLU A 2 14.856 21.497 29.686 1.00 11.07 N ATOM 26 CA GLU A 2 13.963 21.695 28.538 1.00 10.09 C ATOM 27 C GLU A 2 12.670 20.918 28.761 1.00 9.86 C ATOM 28 O GLU A 2 12.698 19.723 29.075 1.00 9.87 O ATOM 29 CB GLU A 2 14.630 21.241 27.237 1.00 10.26 C ATOM 30 CG GLU A 2 13.779 21.446 25.980 1.00 9.81 C ATOM 31 CD GLU A 2 14.447 20.905 24.732 1.00 9.52 C ATOM 32 OE1 GLU A 2 15.177 19.893 24.835 1.00 9.85 O ATOM 33 OE2 GLU A 2 14.243 21.492 23.646 1.00 10.06 O ATOM 34 HA GLU A 2 13.741 22.759 28.449 1.00 0.00 H ATOM 35 HB2 GLU A 2 15.557 21.802 27.116 1.00 0.00 H ATOM 36 HB3 GLU A 2 14.858 20.179 27.324 1.00 0.00 H ATOM 37 HG2 GLU A 2 12.826 20.935 26.116 1.00 0.00 H ATOM 38 HG3 GLU A 2 13.602 22.513 25.847 1.00 0.00 H ATOM 39 H GLU A 2 15.824 21.152 29.524 1.00 0.00 H ATOM 40 N SER A 3 11.541 21.603 28.626 1.00 8.81 N ATOM 41 CA SER A 3 10.256 20.950 28.822 1.00 8.55 C ATOM 42 C SER A 3 10.005 19.955 27.698 1.00 8.57 C ATOM 43 O SER A 3 10.533 20.111 26.592 1.00 7.93 O ATOM 44 CB SER A 3 9.125 21.973 28.890 1.00 8.67 C ATOM 45 OG SER A 3 8.741 22.383 27.587 1.00 9.27 O ATOM 46 HA SER A 3 10.282 20.417 29.772 1.00 0.00 H ATOM 47 HB2 SER A 3 9.462 22.843 29.454 1.00 0.00 H ATOM 48 HB3 SER A 3 8.267 21.526 29.392 1.00 0.00 H ATOM 49 HG SER A 3 8.008 23.045 27.653 1.00 0.00 H ATOM 50 H SER A 3 11.575 22.613 28.379 1.00 0.00 H ATOM 51 N ALA A 4 9.201 18.931 27.984 1.00 8.20 N ATOM 52 CA ALA A 4 8.838 17.951 26.965 1.00 8.22 C ATOM 53 C ALA A 4 8.115 18.610 25.788 1.00 8.13 C ATOM 54 O ALA A 4 8.382 18.285 24.626 1.00 7.91 O ATOM 55 CB ALA A 4 7.991 16.863 27.566 1.00 7.82 C ATOM 56 HA ALA A 4 9.757 17.509 26.581 1.00 0.00 H ATOM 57 HB1 ALA A 4 8.550 16.364 28.357 1.00 0.00 H ATOM 58 HB2 ALA A 4 7.082 17.299 27.981 1.00 0.00 H ATOM 59 HB3 ALA A 4 7.729 16.140 26.794 1.00 0.00 H ATOM 60 H ALA A 4 8.826 18.829 28.949 1.00 0.00 H ATOM 61 N ALA A 5 7.221 19.548 26.092 1.00 8.48 N ATOM 62 CA ALA A 5 6.502 20.289 25.058 1.00 8.60 C ATOM 63 C ALA A 5 7.475 21.032 24.143 1.00 8.70 C ATOM 64 O ALA A 5 7.373 20.931 22.921 1.00 9.10 O ATOM 65 CB ALA A 5 5.505 21.246 25.683 1.00 8.65 C ATOM 66 HA ALA A 5 5.950 19.574 24.448 1.00 0.00 H ATOM 67 HB1 ALA A 5 4.787 20.683 26.279 1.00 0.00 H ATOM 68 HB2 ALA A 5 6.034 21.953 26.322 1.00 0.00 H ATOM 69 HB3 ALA A 5 4.981 21.788 24.896 1.00 0.00 H ATOM 70 H ALA A 5 7.029 19.759 27.092 1.00 0.00 H ATOM 71 N ALA A 6 8.442 21.729 24.736 1.00 8.59 N ATOM 72 CA ALA A 6 9.439 22.466 23.958 1.00 8.57 C ATOM 73 C ALA A 6 10.363 21.536 23.179 1.00 8.46 C ATOM 74 O ALA A 6 10.771 21.855 22.060 1.00 8.95 O ATOM 75 CB ALA A 6 10.247 23.376 24.860 1.00 8.76 C ATOM 76 HA ALA A 6 8.898 23.071 23.231 1.00 0.00 H ATOM 77 HB1 ALA A 6 9.580 24.087 25.348 1.00 0.00 H ATOM 78 HB2 ALA A 6 10.757 22.778 25.615 1.00 0.00 H ATOM 79 HB3 ALA A 6 10.983 23.916 24.264 1.00 0.00 H ATOM 80 H ALA A 6 8.490 21.750 25.775 1.00 0.00 H ATOM 81 N LYS A 7 10.702 20.391 23.769 1.00 8.53 N ATOM 82 CA LYS A 7 11.539 19.408 23.079 1.00 8.50 C ATOM 83 C LYS A 7 10.830 18.856 21.846 1.00 7.91 C ATOM 84 O LYS A 7 11.451 18.701 20.793 1.00 8.41 O ATOM 85 CB LYS A 7 11.955 18.282 24.023 1.00 8.56 C ATOM 86 CG LYS A 7 12.781 17.180 23.376 1.00 9.92 C ATOM 87 CD LYS A 7 13.169 16.137 24.406 1.00 11.12 C ATOM 88 CE LYS A 7 13.790 14.909 23.755 1.00 12.27 C ATOM 89 NZ LYS A 7 14.130 13.880 24.781 1.00 14.08 N ATOM 90 HA LYS A 7 12.445 19.915 22.746 1.00 0.00 H ATOM 91 HB2 LYS A 7 12.543 18.717 24.832 1.00 0.00 H ATOM 92 HB3 LYS A 7 11.051 17.832 24.434 1.00 0.00 H ATOM 93 HG2 LYS A 7 12.195 16.707 22.588 1.00 0.00 H ATOM 94 HG3 LYS A 7 13.684 17.613 22.945 1.00 0.00 H ATOM 95 HD2 LYS A 7 13.890 16.574 25.097 1.00 0.00 H ATOM 96 HD3 LYS A 7 12.278 15.834 24.956 1.00 0.00 H ATOM 97 HE2 LYS A 7 14.698 15.204 23.229 1.00 0.00 H ATOM 98 HE3 LYS A 7 13.082 14.484 23.044 1.00 0.00 H ATOM 99 HZ1 LYS A 7 14.809 14.280 25.460 1.00 0.00 H ATOM 100 HZ2 LYS A 7 13.265 13.593 25.282 1.00 0.00 H ATOM 101 HZ3 LYS A 7 14.552 13.052 24.314 1.00 0.00 H ATOM 102 H LYS A 7 10.367 20.193 24.733 1.00 0.00 H ATOM 103 N PHE A 8 9.529 18.583 21.964 1.00 8.28 N ATOM 104 CA PHE A 8 8.760 18.153 20.794 1.00 7.62 C ATOM 105 C PHE A 8 8.763 19.227 19.702 1.00 8.14 C ATOM 106 O PHE A 8 8.970 18.929 18.528 1.00 7.88 O ATOM 107 CB PHE A 8 7.320 17.785 21.171 1.00 7.71 C ATOM 108 CG PHE A 8 6.490 17.372 19.982 1.00 7.46 C ATOM 109 CD1 PHE A 8 5.868 18.334 19.180 1.00 8.97 C ATOM 110 CD2 PHE A 8 6.374 16.030 19.628 1.00 7.42 C ATOM 111 CE1 PHE A 8 5.121 17.949 18.055 1.00 7.94 C ATOM 112 CE2 PHE A 8 5.638 15.643 18.512 1.00 6.25 C ATOM 113 CZ PHE A 8 5.013 16.602 17.721 1.00 7.83 C ATOM 114 HA PHE A 8 9.247 17.260 20.402 1.00 0.00 H ATOM 115 HB2 PHE A 8 7.346 16.959 21.881 1.00 0.00 H ATOM 116 HB3 PHE A 8 6.851 18.650 21.640 1.00 0.00 H ATOM 117 HD2 PHE A 8 6.868 15.271 20.235 1.00 0.00 H ATOM 118 HE2 PHE A 8 5.551 14.587 18.257 1.00 0.00 H ATOM 119 HZ PHE A 8 4.441 16.300 16.844 1.00 0.00 H ATOM 120 HE1 PHE A 8 4.626 18.704 17.444 1.00 0.00 H ATOM 121 HD1 PHE A 8 5.964 19.391 19.430 1.00 0.00 H ATOM 122 H PHE A 8 9.061 18.676 22.888 1.00 0.00 H ATOM 123 N GLU A 9 8.538 20.479 20.092 1.00 7.71 N ATOM 124 CA GLU A 9 8.532 21.573 19.115 1.00 8.04 C ATOM 125 C GLU A 9 9.888 21.726 18.419 1.00 7.28 C ATOM 126 O GLU A 9 9.951 21.877 17.187 1.00 7.98 O ATOM 127 CB GLU A 9 8.101 22.876 19.766 1.00 7.95 C ATOM 128 CG GLU A 9 6.639 22.874 20.162 1.00 9.84 C ATOM 129 CD GLU A 9 6.114 24.249 20.501 1.00 12.13 C ATOM 130 OE1 GLU A 9 6.474 25.231 19.810 1.00 13.04 O ATOM 131 OE2 GLU A 9 5.308 24.335 21.448 1.00 11.19 O ATOM 132 HA GLU A 9 7.804 21.318 18.345 1.00 0.00 H ATOM 133 HB2 GLU A 9 8.705 23.037 20.659 1.00 0.00 H ATOM 134 HB3 GLU A 9 8.271 23.691 19.063 1.00 0.00 H ATOM 135 HG2 GLU A 9 6.055 22.474 19.333 1.00 0.00 H ATOM 136 HG3 GLU A 9 6.516 22.231 21.034 1.00 0.00 H ATOM 137 H GLU A 9 8.365 20.683 21.097 1.00 0.00 H ATOM 138 N ARG A 10 10.961 21.678 19.212 1.00 7.03 N ATOM 139 CA ARG A 10 12.321 21.741 18.675 1.00 6.64 C ATOM 140 C ARG A 10 12.601 20.606 17.684 1.00 6.40 C ATOM 141 O ARG A 10 13.124 20.831 16.596 1.00 6.48 O ATOM 142 CB ARG A 10 13.351 21.698 19.802 1.00 6.36 C ATOM 143 CG ARG A 10 14.786 21.602 19.291 1.00 6.54 C ATOM 144 CD ARG A 10 15.805 21.687 20.417 1.00 7.31 C ATOM 145 NE ARG A 10 15.626 20.638 21.426 1.00 7.26 N ATOM 146 CZ ARG A 10 16.114 19.399 21.330 1.00 8.14 C ATOM 147 NH1 ARG A 10 16.831 19.033 20.266 1.00 7.25 N ATOM 148 NH2 ARG A 10 15.896 18.522 22.313 1.00 8.04 N ATOM 149 HA ARG A 10 12.405 22.687 18.141 1.00 0.00 H ATOM 150 HB2 ARG A 10 13.253 22.606 20.398 1.00 0.00 H ATOM 151 HB3 ARG A 10 13.146 20.830 20.428 1.00 0.00 H ATOM 152 HG2 ARG A 10 14.912 20.650 18.775 1.00 0.00 H ATOM 153 HG3 ARG A 10 14.965 22.419 18.593 1.00 0.00 H ATOM 154 HD2 ARG A 10 15.708 22.658 20.903 1.00 0.00 H ATOM 155 HD3 ARG A 10 16.804 21.594 19.991 1.00 0.00 H ATOM 156 HE ARG A 10 15.079 20.876 22.278 1.00 0.00 H ATOM 157 HH12 ARG A 10 17.207 18.066 20.200 1.00 0.00 H ATOM 158 HH11 ARG A 10 17.014 19.715 19.503 1.00 0.00 H ATOM 159 HH22 ARG A 10 16.275 17.556 22.242 1.00 0.00 H ATOM 160 HH21 ARG A 10 15.348 18.805 23.150 1.00 0.00 H ATOM 161 H ARG A 10 10.827 21.593 20.240 1.00 0.00 H ATOM 162 N GLN A 11 12.260 19.387 18.082 1.00 6.31 N ATOM 163 CA GLN A 11 12.601 18.215 17.303 1.00 6.41 C ATOM 164 C GLN A 11 11.694 17.978 16.108 1.00 6.37 C ATOM 165 O GLN A 11 12.127 17.376 15.123 1.00 6.67 O ATOM 166 CB GLN A 11 12.580 16.975 18.182 1.00 6.57 C ATOM 167 CG GLN A 11 13.695 16.909 19.204 1.00 6.63 C ATOM 168 CD GLN A 11 13.764 15.541 19.843 1.00 8.13 C ATOM 169 OE1 GLN A 11 14.815 14.893 19.835 1.00 9.93 O ATOM 170 NE2 GLN A 11 12.634 15.073 20.365 1.00 9.27 N ATOM 171 HA GLN A 11 13.601 18.407 16.914 1.00 0.00 H ATOM 172 HB2 GLN A 11 11.629 16.951 18.714 1.00 0.00 H ATOM 173 HB3 GLN A 11 12.657 16.099 17.537 1.00 0.00 H ATOM 174 HG2 GLN A 11 14.644 17.121 18.711 1.00 0.00 H ATOM 175 HG3 GLN A 11 13.514 17.655 19.978 1.00 0.00 H ATOM 176 HE22 GLN A 11 11.773 15.656 20.349 1.00 0.00 H ATOM 177 HE21 GLN A 11 12.611 14.124 20.790 1.00 0.00 H ATOM 178 H GLN A 11 11.736 19.271 18.973 1.00 0.00 H ATOM 179 N HIS A 12 10.446 18.431 16.189 1.00 6.52 N ATOM 180 CA HIS A 12 9.429 17.960 15.244 1.00 6.75 C ATOM 181 C HIS A 12 8.620 19.011 14.493 1.00 6.99 C ATOM 182 O HIS A 12 7.902 18.659 13.560 1.00 7.35 O ATOM 183 CB HIS A 12 8.453 16.989 15.932 1.00 6.19 C ATOM 184 CG HIS A 12 9.108 15.765 16.491 1.00 5.67 C ATOM 185 ND1 HIS A 12 9.771 14.841 15.707 1.00 5.05 N ATOM 186 CD2 HIS A 12 9.223 15.327 17.768 1.00 6.16 C ATOM 187 CE1 HIS A 12 10.253 13.884 16.480 1.00 5.46 C ATOM 188 NE2 HIS A 12 9.920 14.147 17.731 1.00 6.53 N ATOM 189 HA HIS A 12 10.032 17.474 14.477 1.00 0.00 H ATOM 190 HB2 HIS A 12 7.960 17.518 16.748 1.00 0.00 H ATOM 191 HB3 HIS A 12 7.707 16.676 15.201 1.00 0.00 H ATOM 192 HD2 HIS A 12 8.834 15.821 18.659 1.00 0.00 H ATOM 193 HE1 HIS A 12 10.829 13.022 16.142 1.00 0.00 H ATOM 194 H HIS A 12 10.191 19.121 16.924 1.00 0.00 H ATOM 195 N MET A 13 8.709 20.281 14.894 1.00 6.77 N ATOM 196 CA MET A 13 7.877 21.304 14.259 1.00 6.60 C ATOM 197 C MET A 13 8.654 22.180 13.300 1.00 6.42 C ATOM 198 O MET A 13 9.650 22.818 13.666 1.00 6.87 O ATOM 199 CB MET A 13 7.159 22.181 15.291 1.00 6.71 C ATOM 200 CG MET A 13 6.071 21.486 16.088 1.00 5.82 C ATOM 201 SD MET A 13 4.769 20.708 15.119 1.00 6.97 S ATOM 202 CE MET A 13 4.154 22.070 14.126 1.00 6.87 C ATOM 203 HA MET A 13 7.132 20.755 13.684 1.00 0.00 H ATOM 204 HB2 MET A 13 7.905 22.554 15.993 1.00 0.00 H ATOM 205 HB3 MET A 13 6.706 23.020 14.763 1.00 0.00 H ATOM 206 HG2 MET A 13 5.607 22.227 16.739 1.00 0.00 H ATOM 207 HG3 MET A 13 6.542 20.714 16.697 1.00 0.00 H ATOM 208 HE1 MET A 13 3.781 22.856 14.782 1.00 0.00 H ATOM 209 HE2 MET A 13 4.963 22.463 13.510 1.00 0.00 H ATOM 210 HE3 MET A 13 3.347 21.715 13.485 1.00 0.00 H ATOM 211 H MET A 13 9.367 20.543 15.655 1.00 0.00 H ATOM 212 N ASP A 14 8.191 22.206 12.058 1.00 6.31 N ATOM 213 CA ASP A 14 8.691 23.159 11.078 1.00 6.29 C ATOM 214 C ASP A 14 7.536 23.657 10.217 1.00 6.11 C ATOM 215 O ASP A 14 7.446 23.357 9.033 1.00 5.97 O ATOM 216 CB ASP A 14 9.803 22.547 10.219 1.00 6.77 C ATOM 217 CG ASP A 14 10.484 23.577 9.333 1.00 7.26 C ATOM 218 OD1 ASP A 14 10.378 24.788 9.616 1.00 8.42 O ATOM 219 OD2 ASP A 14 11.117 23.178 8.341 1.00 9.10 O ATOM 220 HA ASP A 14 9.129 24.007 11.605 1.00 0.00 H ATOM 221 HB2 ASP A 14 10.550 22.103 10.877 1.00 0.00 H ATOM 222 HB3 ASP A 14 9.371 21.772 9.586 1.00 0.00 H ATOM 223 H ASP A 14 7.453 21.529 11.777 1.00 0.00 H ATOM 224 N SER A 15 6.650 24.423 10.837 1.00 6.78 N ATOM 225 CA SER A 15 5.418 24.860 10.189 1.00 7.16 C ATOM 226 C SER A 15 5.690 25.780 9.003 1.00 8.28 C ATOM 227 O SER A 15 6.443 26.740 9.123 1.00 7.99 O ATOM 228 CB SER A 15 4.534 25.581 11.210 1.00 7.24 C ATOM 229 OG SER A 15 4.293 24.767 12.348 1.00 7.19 O ATOM 230 HA SER A 15 4.909 23.975 9.808 1.00 0.00 H ATOM 231 HB2 SER A 15 3.581 25.830 10.743 1.00 0.00 H ATOM 232 HB3 SER A 15 5.032 26.497 11.527 1.00 0.00 H ATOM 233 HG SER A 15 3.836 23.935 12.066 1.00 0.00 H ATOM 234 H SER A 15 6.839 24.722 11.815 1.00 0.00 H ATOM 235 N GLY A 16 5.070 25.471 7.866 1.00 9.05 N ATOM 236 CA GLY A 16 5.228 26.268 6.650 1.00 11.08 C ATOM 237 C GLY A 16 4.895 25.504 5.382 1.00 12.82 C ATOM 238 O GLY A 16 4.771 24.269 5.393 1.00 12.77 O ATOM 239 HA3 GLY A 16 6.263 26.605 6.589 1.00 0.00 H ATOM 240 HA2 GLY A 16 4.569 27.134 6.716 1.00 0.00 H ATOM 241 H GLY A 16 4.452 24.635 7.842 1.00 0.00 H ATOM 242 N ASN A 17 4.765 26.241 4.282 1.00 14.36 N ATOM 243 CA ASN A 17 4.345 25.670 3.004 1.00 16.13 C ATOM 244 C ASN A 17 5.461 25.039 2.178 1.00 17.04 C ATOM 245 O ASN A 17 5.224 24.062 1.463 1.00 17.58 O ATOM 246 CB ASN A 17 3.608 26.719 2.168 1.00 16.21 C ATOM 247 CG ASN A 17 2.175 26.916 2.614 1.00 17.07 C ATOM 248 OD1 ASN A 17 1.516 25.976 3.066 1.00 17.77 O ATOM 249 ND2 ASN A 17 1.679 28.140 2.481 1.00 18.48 N ATOM 250 HA ASN A 17 3.679 24.849 3.268 1.00 0.00 H ATOM 251 HB2 ASN A 17 4.135 27.669 2.256 1.00 0.00 H ATOM 252 HB3 ASN A 17 3.609 26.399 1.126 1.00 0.00 H ATOM 253 HD22 ASN A 17 2.272 28.902 2.095 1.00 0.00 H ATOM 254 HD21 ASN A 17 0.697 28.337 2.763 1.00 0.00 H ATOM 255 H ASN A 17 4.969 27.259 4.333 1.00 0.00 H ATOM 256 N SER A 18 6.665 25.600 2.267 1.00 18.03 N ATOM 257 CA SER A 18 7.795 25.127 1.465 1.00 18.96 C ATOM 258 C SER A 18 9.092 25.017 2.286 1.00 19.29 C ATOM 259 O SER A 18 10.040 25.772 2.050 1.00 19.79 O ATOM 260 CB SER A 18 8.006 26.042 0.250 1.00 19.13 C ATOM 261 OG SER A 18 6.798 26.240 -0.467 1.00 20.65 O ATOM 262 HA SER A 18 7.548 24.123 1.121 1.00 0.00 H ATOM 263 HB2 SER A 18 8.742 25.587 -0.413 1.00 0.00 H ATOM 264 HB3 SER A 18 8.377 27.008 0.593 1.00 0.00 H ATOM 265 HG SER A 18 6.969 26.833 -1.242 1.00 0.00 H ATOM 266 H SER A 18 6.807 26.395 2.923 1.00 0.00 H ATOM 267 N PRO A 19 9.144 24.062 3.242 1.00 19.40 N ATOM 268 CA PRO A 19 10.301 23.940 4.138 1.00 19.67 C ATOM 269 C PRO A 19 11.641 23.702 3.438 1.00 19.75 C ATOM 270 O PRO A 19 12.685 24.161 3.929 1.00 19.81 O ATOM 271 CB PRO A 19 9.947 22.724 5.004 1.00 19.52 C ATOM 272 CG PRO A 19 8.911 21.976 4.216 1.00 19.68 C ATOM 273 CD PRO A 19 8.124 23.042 3.541 1.00 19.61 C ATOM 274 HA PRO A 19 10.455 24.873 4.681 1.00 0.00 H ATOM 275 HD3 PRO A 19 7.661 22.670 2.627 1.00 0.00 H ATOM 276 HD2 PRO A 19 7.353 23.439 4.201 1.00 0.00 H ATOM 277 HG3 PRO A 19 8.276 21.385 4.876 1.00 0.00 H ATOM 278 HG2 PRO A 19 9.381 21.320 3.483 1.00 0.00 H ATOM 279 HB2 PRO A 19 10.826 22.102 5.169 1.00 0.00 H ATOM 280 HB3 PRO A 19 9.543 23.042 5.965 1.00 0.00 H ATOM 281 N SER A 20 11.605 22.999 2.307 1.00 19.90 N ATOM 282 CA SER A 20 12.825 22.584 1.609 1.00 20.19 C ATOM 283 C SER A 20 13.225 23.519 0.463 1.00 20.07 C ATOM 284 O SER A 20 14.293 23.346 -0.139 1.00 20.43 O ATOM 285 CB SER A 20 12.690 21.151 1.092 1.00 20.16 C ATOM 286 OG SER A 20 11.762 21.085 0.024 1.00 20.25 O ATOM 287 HA SER A 20 13.625 22.637 2.348 1.00 0.00 H ATOM 288 HB2 SER A 20 12.347 20.509 1.904 1.00 0.00 H ATOM 289 HB3 SER A 20 13.662 20.804 0.742 1.00 0.00 H ATOM 290 HG SER A 20 10.876 21.396 0.338 1.00 0.00 H ATOM 291 H SER A 20 10.682 22.736 1.907 1.00 0.00 H ATOM 292 N SER A 21 12.367 24.495 0.164 1.00 19.55 N ATOM 293 CA SER A 21 12.638 25.503 -0.865 1.00 19.01 C ATOM 294 C SER A 21 14.025 26.120 -0.721 1.00 18.28 C ATOM 295 O SER A 21 14.533 26.276 0.398 1.00 18.20 O ATOM 296 CB SER A 21 11.600 26.618 -0.798 1.00 19.09 C ATOM 297 OG SER A 21 11.906 27.654 -1.722 1.00 20.79 O ATOM 298 HA SER A 21 12.588 24.991 -1.826 1.00 0.00 H ATOM 299 HB2 SER A 21 11.585 27.032 0.210 1.00 0.00 H ATOM 300 HB3 SER A 21 10.619 26.207 -1.035 1.00 0.00 H ATOM 301 HG SER A 21 11.916 27.283 -2.640 1.00 0.00 H ATOM 302 H SER A 21 11.467 24.543 0.683 1.00 0.00 H ATOM 303 N SER A 22 14.619 26.484 -1.858 1.00 17.35 N ATOM 304 CA SER A 22 15.939 27.118 -1.885 1.00 16.55 C ATOM 305 C SER A 22 15.951 28.427 -1.095 1.00 15.78 C ATOM 306 O SER A 22 16.978 28.809 -0.536 1.00 15.62 O ATOM 307 CB SER A 22 16.393 27.365 -3.325 1.00 16.62 C ATOM 308 OG SER A 22 15.473 28.191 -4.018 1.00 17.07 O ATOM 309 HA SER A 22 16.639 26.432 -1.408 1.00 0.00 H ATOM 310 HB2 SER A 22 16.472 26.409 -3.842 1.00 0.00 H ATOM 311 HB3 SER A 22 17.368 27.852 -3.312 1.00 0.00 H ATOM 312 HG SER A 22 15.792 28.333 -4.944 1.00 0.00 H ATOM 313 H SER A 22 14.127 26.311 -2.758 1.00 0.00 H ATOM 314 N SER A 23 14.802 29.098 -1.040 1.00 14.89 N ATOM 315 CA SER A 23 14.679 30.360 -0.311 1.00 14.35 C ATOM 316 C SER A 23 14.936 30.183 1.189 1.00 13.22 C ATOM 317 O SER A 23 15.230 31.156 1.884 1.00 13.36 O ATOM 318 CB SER A 23 13.302 30.990 -0.541 1.00 14.52 C ATOM 319 OG SER A 23 12.289 30.243 0.115 1.00 17.53 O ATOM 320 HA SER A 23 15.444 31.031 -0.702 1.00 0.00 H ATOM 321 HB2 SER A 23 13.093 31.013 -1.611 1.00 0.00 H ATOM 322 HB3 SER A 23 13.305 32.008 -0.151 1.00 0.00 H ATOM 323 HG SER A 23 12.280 29.319 -0.239 1.00 0.00 H ATOM 324 H SER A 23 13.969 28.714 -1.529 1.00 0.00 H ATOM 325 N ASN A 24 14.807 28.945 1.672 1.00 11.70 N ATOM 326 CA ASN A 24 15.012 28.616 3.082 1.00 10.76 C ATOM 327 C ASN A 24 16.439 28.264 3.459 1.00 9.65 C ATOM 328 O ASN A 24 16.731 28.047 4.632 1.00 9.24 O ATOM 329 CB ASN A 24 14.113 27.451 3.493 1.00 10.99 C ATOM 330 CG ASN A 24 13.076 27.859 4.484 1.00 14.16 C ATOM 331 OD1 ASN A 24 11.889 27.919 4.161 1.00 17.87 O ATOM 332 ND2 ASN A 24 13.513 28.175 5.705 1.00 15.85 N ATOM 333 HA ASN A 24 14.760 29.533 3.614 1.00 0.00 H ATOM 334 HB2 ASN A 24 13.616 27.061 2.605 1.00 0.00 H ATOM 335 HB3 ASN A 24 14.731 26.669 3.934 1.00 0.00 H ATOM 336 HD22 ASN A 24 14.527 28.108 5.928 1.00 0.00 H ATOM 337 HD21 ASN A 24 12.840 28.489 6.433 1.00 0.00 H ATOM 338 H ASN A 24 14.549 28.180 1.016 1.00 0.00 H ATOM 339 N TYR A 25 17.325 28.209 2.469 1.00 8.73 N ATOM 340 CA TYR A 25 18.695 27.760 2.699 1.00 8.15 C ATOM 341 C TYR A 25 19.358 28.529 3.831 1.00 7.68 C ATOM 342 O TYR A 25 19.888 27.932 4.767 1.00 7.97 O ATOM 343 CB TYR A 25 19.507 27.879 1.410 1.00 8.07 C ATOM 344 CG TYR A 25 20.997 27.653 1.550 1.00 8.09 C ATOM 345 CD1 TYR A 25 21.544 26.367 1.554 1.00 8.63 C ATOM 346 CD2 TYR A 25 21.866 28.738 1.659 1.00 8.02 C ATOM 347 CE1 TYR A 25 22.930 26.175 1.662 1.00 7.91 C ATOM 348 CE2 TYR A 25 23.242 28.556 1.778 1.00 8.92 C ATOM 349 CZ TYR A 25 23.769 27.279 1.774 1.00 9.06 C ATOM 350 OH TYR A 25 25.139 27.129 1.884 1.00 9.98 O ATOM 351 HA TYR A 25 18.661 26.713 3.001 1.00 0.00 H ATOM 352 HB3 TYR A 25 19.356 28.882 1.010 1.00 0.00 H ATOM 353 HB2 TYR A 25 19.122 27.145 0.702 1.00 0.00 H ATOM 354 HD2 TYR A 25 21.460 29.750 1.651 1.00 0.00 H ATOM 355 HE2 TYR A 25 23.901 29.419 1.874 1.00 0.00 H ATOM 356 HE1 TYR A 25 23.346 25.168 1.658 1.00 0.00 H ATOM 357 HD1 TYR A 25 20.886 25.502 1.472 1.00 0.00 H ATOM 358 HH TYR A 25 25.367 26.166 1.867 1.00 0.00 H ATOM 359 H TYR A 25 17.036 28.492 1.511 1.00 0.00 H ATOM 360 N CYS A 26 19.315 29.857 3.763 1.00 7.57 N ATOM 361 CA CYS A 26 19.958 30.661 4.800 1.00 7.66 C ATOM 362 C CYS A 26 19.360 30.448 6.193 1.00 7.49 C ATOM 363 O CYS A 26 20.094 30.386 7.179 1.00 7.78 O ATOM 364 CB CYS A 26 19.933 32.131 4.412 1.00 6.96 C ATOM 365 SG CYS A 26 21.069 32.514 3.076 1.00 7.46 S ATOM 366 HA CYS A 26 20.992 30.322 4.867 1.00 0.00 H ATOM 367 HB2 CYS A 26 20.205 32.727 5.283 1.00 0.00 H ATOM 368 HB3 CYS A 26 18.923 32.392 4.097 1.00 0.00 H ATOM 369 H CYS A 26 18.824 30.322 2.973 1.00 0.00 H ATOM 370 N ASN A 27 18.038 30.342 6.283 1.00 7.94 N ATOM 371 CA ASN A 27 17.413 30.046 7.568 1.00 8.49 C ATOM 372 C ASN A 27 17.981 28.767 8.181 1.00 8.71 C ATOM 373 O ASN A 27 18.345 28.737 9.357 1.00 10.03 O ATOM 374 CB ASN A 27 15.896 29.940 7.418 1.00 8.14 C ATOM 375 CG ASN A 27 15.254 31.269 7.059 1.00 8.88 C ATOM 376 OD1 ASN A 27 15.793 32.329 7.364 1.00 9.25 O ATOM 377 ND2 ASN A 27 14.101 31.214 6.403 1.00 9.40 N ATOM 378 HA ASN A 27 17.639 30.870 8.245 1.00 0.00 H ATOM 379 HB2 ASN A 27 15.671 29.219 6.632 1.00 0.00 H ATOM 380 HB3 ASN A 27 15.475 29.591 8.361 1.00 0.00 H ATOM 381 HD22 ASN A 27 13.681 30.293 6.166 1.00 0.00 H ATOM 382 HD21 ASN A 27 13.618 32.092 6.127 1.00 0.00 H ATOM 383 H ASN A 27 17.448 30.470 5.436 1.00 0.00 H ATOM 384 N LEU A 28 18.076 27.715 7.371 1.00 8.92 N ATOM 385 CA LEU A 28 18.612 26.430 7.830 1.00 8.91 C ATOM 386 C LEU A 28 20.095 26.519 8.177 1.00 8.64 C ATOM 387 O LEU A 28 20.530 26.035 9.230 1.00 8.23 O ATOM 388 CB LEU A 28 18.408 25.364 6.754 1.00 9.45 C ATOM 389 CG LEU A 28 16.965 25.046 6.361 1.00 11.27 C ATOM 390 CD1 LEU A 28 16.911 23.981 5.270 1.00 13.17 C ATOM 391 CD2 LEU A 28 16.182 24.595 7.570 1.00 13.44 C ATOM 392 HA LEU A 28 18.070 26.158 8.736 1.00 0.00 H ATOM 393 HB2 LEU A 28 18.928 25.698 5.856 1.00 0.00 H ATOM 394 HB3 LEU A 28 18.863 24.441 7.114 1.00 0.00 H ATOM 395 HG LEU A 28 16.515 25.957 5.965 1.00 0.00 H ATOM 396 HD21 LEU A 28 16.644 23.700 7.987 1.00 0.00 H ATOM 397 HD22 LEU A 28 16.182 25.388 8.318 1.00 0.00 H ATOM 398 HD23 LEU A 28 15.157 24.372 7.275 1.00 0.00 H ATOM 399 HD11 LEU A 28 17.441 24.339 4.388 1.00 0.00 H ATOM 400 HD12 LEU A 28 17.382 23.067 5.632 1.00 0.00 H ATOM 401 HD13 LEU A 28 15.871 23.778 5.013 1.00 0.00 H ATOM 402 H LEU A 28 17.761 27.807 6.384 1.00 0.00 H ATOM 403 N MET A 29 20.864 27.128 7.276 1.00 7.93 N ATOM 404 CA MET A 29 22.316 27.206 7.409 1.00 8.63 C ATOM 405 C MET A 29 22.763 28.094 8.564 1.00 8.37 C ATOM 406 O MET A 29 23.662 27.720 9.323 1.00 8.32 O ATOM 407 CB MET A 29 22.942 27.708 6.108 1.00 9.08 C ATOM 408 CG MET A 29 23.031 26.651 5.024 1.00 10.94 C ATOM 409 SD MET A 29 24.155 25.296 5.448 1.00 12.09 S ATOM 410 CE MET A 29 25.761 26.050 5.139 1.00 12.32 C ATOM 411 HA MET A 29 22.660 26.195 7.626 1.00 0.00 H ATOM 412 HB2 MET A 29 22.339 28.535 5.733 1.00 0.00 H ATOM 413 HB3 MET A 29 23.949 28.063 6.326 1.00 0.00 H ATOM 414 HG2 MET A 29 23.385 27.122 4.107 1.00 0.00 H ATOM 415 HG3 MET A 29 22.036 26.238 4.858 1.00 0.00 H ATOM 416 HE1 MET A 29 25.824 26.352 4.093 1.00 0.00 H ATOM 417 HE2 MET A 29 25.879 26.925 5.779 1.00 0.00 H ATOM 418 HE3 MET A 29 26.548 25.329 5.359 1.00 0.00 H ATOM 419 H MET A 29 20.413 27.564 6.447 1.00 0.00 H ATOM 420 N MET A 30 22.144 29.264 8.698 1.00 7.97 N ATOM 421 CA MET A 30 22.497 30.176 9.777 1.00 7.95 C ATOM 422 C MET A 30 22.224 29.535 11.120 1.00 8.18 C ATOM 423 O MET A 30 22.956 29.766 12.084 1.00 8.73 O ATOM 424 CB MET A 30 21.755 31.508 9.640 1.00 8.13 C ATOM 425 CG MET A 30 22.177 32.299 8.413 1.00 7.65 C ATOM 426 SD MET A 30 23.919 32.746 8.403 1.00 7.76 S ATOM 427 CE MET A 30 23.880 34.123 9.545 1.00 8.13 C ATOM 428 HA MET A 30 23.564 30.387 9.710 1.00 0.00 H ATOM 429 HB2 MET A 30 20.686 31.305 9.572 1.00 0.00 H ATOM 430 HB3 MET A 30 21.954 32.110 10.527 1.00 0.00 H ATOM 431 HG2 MET A 30 21.587 33.214 8.374 1.00 0.00 H ATOM 432 HG3 MET A 30 21.971 31.697 7.528 1.00 0.00 H ATOM 433 HE1 MET A 30 23.218 34.897 9.156 1.00 0.00 H ATOM 434 HE2 MET A 30 23.512 33.781 10.512 1.00 0.00 H ATOM 435 HE3 MET A 30 24.886 34.527 9.659 1.00 0.00 H ATOM 436 H MET A 30 21.399 29.531 8.024 1.00 0.00 H ATOM 437 N CYS A 31 21.179 28.713 11.165 1.00 8.20 N ATOM 438 CA CYS A 31 20.864 27.950 12.364 1.00 7.97 C ATOM 439 C CYS A 31 21.889 26.841 12.596 1.00 8.36 C ATOM 440 O CYS A 31 22.508 26.776 13.662 1.00 8.53 O ATOM 441 CB CYS A 31 19.459 27.367 12.288 1.00 8.52 C ATOM 442 SG CYS A 31 19.084 26.350 13.728 1.00 7.91 S ATOM 443 HA CYS A 31 20.905 28.635 13.210 1.00 0.00 H ATOM 444 HB2 CYS A 31 19.378 26.754 11.391 1.00 0.00 H ATOM 445 HB3 CYS A 31 18.739 28.184 12.234 1.00 0.00 H ATOM 446 H CYS A 31 20.574 28.613 10.325 1.00 0.00 H ATOM 447 N CYS A 32 22.058 25.973 11.601 1.00 8.36 N ATOM 448 CA CYS A 32 22.934 24.811 11.737 1.00 7.96 C ATOM 449 C CYS A 32 24.378 25.206 12.063 1.00 8.19 C ATOM 450 O CYS A 32 25.038 24.570 12.896 1.00 8.46 O ATOM 451 CB CYS A 32 22.882 23.948 10.471 1.00 7.91 C ATOM 452 SG CYS A 32 24.211 22.732 10.341 1.00 8.80 S ATOM 453 HA CYS A 32 22.565 24.226 12.580 1.00 0.00 H ATOM 454 HB2 CYS A 32 22.938 24.608 9.606 1.00 0.00 H ATOM 455 HB3 CYS A 32 21.931 23.416 10.460 1.00 0.00 H ATOM 456 H CYS A 32 21.554 26.126 10.704 1.00 0.00 H ATOM 457 N ARG A 33 24.858 26.257 11.401 1.00 8.27 N ATOM 458 CA ARG A 33 26.241 26.710 11.565 1.00 8.51 C ATOM 459 C ARG A 33 26.441 27.670 12.748 1.00 9.21 C ATOM 460 O ARG A 33 27.474 28.332 12.855 1.00 9.59 O ATOM 461 CB ARG A 33 26.787 27.294 10.256 1.00 8.32 C ATOM 462 CG ARG A 33 26.759 26.341 9.063 1.00 8.77 C ATOM 463 CD ARG A 33 27.650 25.127 9.257 1.00 8.05 C ATOM 464 NE ARG A 33 27.768 24.338 8.026 1.00 7.91 N ATOM 465 CZ ARG A 33 28.587 24.631 7.018 1.00 8.24 C ATOM 466 NH1 ARG A 33 29.383 25.691 7.085 1.00 7.02 N ATOM 467 NH2 ARG A 33 28.620 23.860 5.937 1.00 8.94 N ATOM 468 HA ARG A 33 26.824 25.824 11.814 1.00 0.00 H ATOM 469 HB2 ARG A 33 26.192 28.171 10.002 1.00 0.00 H ATOM 470 HB3 ARG A 33 27.821 27.595 10.425 1.00 0.00 H ATOM 471 HG2 ARG A 33 25.734 26.001 8.913 1.00 0.00 H ATOM 472 HG3 ARG A 33 27.094 26.881 8.178 1.00 0.00 H ATOM 473 HD2 ARG A 33 27.226 24.499 10.040 1.00 0.00 H ATOM 474 HD3 ARG A 33 28.642 25.462 9.559 1.00 0.00 H ATOM 475 HE ARG A 33 27.171 23.491 7.934 1.00 0.00 H ATOM 476 HH12 ARG A 33 30.020 25.914 6.294 1.00 0.00 H ATOM 477 HH11 ARG A 33 29.370 26.299 7.929 1.00 0.00 H ATOM 478 HH22 ARG A 33 29.261 24.092 5.152 1.00 0.00 H ATOM 479 HH21 ARG A 33 28.005 23.024 5.876 1.00 0.00 H ATOM 480 H ARG A 33 24.232 26.771 10.748 1.00 0.00 H ATOM 481 N LYS A 34 25.433 27.735 13.620 1.00 10.32 N ATOM 482 CA LYS A 34 25.530 28.386 14.938 1.00 10.86 C ATOM 483 C LYS A 34 25.739 29.896 14.864 1.00 11.54 C ATOM 484 O LYS A 34 26.555 30.467 15.608 1.00 12.39 O ATOM 485 CB LYS A 34 26.605 27.711 15.806 1.00 10.65 C ATOM 486 CG LYS A 34 26.548 26.183 15.824 1.00 10.83 C ATOM 487 CD LYS A 34 25.240 25.659 16.393 1.00 11.99 C ATOM 488 CE LYS A 34 25.214 24.137 16.411 1.00 12.51 C ATOM 489 NZ LYS A 34 24.005 23.641 17.118 1.00 12.89 N ATOM 490 HA LYS A 34 24.560 28.249 15.415 1.00 0.00 H ATOM 491 HB2 LYS A 34 27.583 28.010 15.429 1.00 0.00 H ATOM 492 HB3 LYS A 34 26.488 28.067 16.829 1.00 0.00 H ATOM 493 HG2 LYS A 34 26.658 25.816 14.803 1.00 0.00 H ATOM 494 HG3 LYS A 34 27.370 25.809 16.434 1.00 0.00 H ATOM 495 HD2 LYS A 34 25.123 26.028 17.412 1.00 0.00 H ATOM 496 HD3 LYS A 34 24.415 26.021 15.779 1.00 0.00 H ATOM 497 HE2 LYS A 34 26.104 23.770 16.922 1.00 0.00 H ATOM 498 HE3 LYS A 34 25.207 23.767 15.386 1.00 0.00 H ATOM 499 HZ1 LYS A 34 24.011 23.989 18.098 1.00 0.00 H ATOM 500 HZ2 LYS A 34 23.154 23.987 16.631 1.00 0.00 H ATOM 501 HZ3 LYS A 34 24.007 22.601 17.119 1.00 0.00 H ATOM 502 H LYS A 34 24.526 27.301 13.354 1.00 0.00 H ATOM 503 N MET A 35 24.986 30.536 13.972 1.00 11.95 N ATOM 504 CA MET A 35 25.028 31.990 13.849 1.00 12.47 C ATOM 505 C MET A 35 23.712 32.674 14.246 1.00 13.05 C ATOM 506 O MET A 35 23.490 33.855 13.935 1.00 13.22 O ATOM 507 CB MET A 35 25.491 32.397 12.454 1.00 12.16 C ATOM 508 CG MET A 35 26.989 32.207 12.264 1.00 11.83 C ATOM 509 SD MET A 35 27.530 32.415 10.571 1.00 11.92 S ATOM 510 CE MET A 35 26.954 30.877 9.849 1.00 11.16 C ATOM 511 HA MET A 35 25.763 32.348 14.570 1.00 0.00 H ATOM 512 HB2 MET A 35 24.964 31.789 11.718 1.00 0.00 H ATOM 513 HB3 MET A 35 25.248 33.448 12.296 1.00 0.00 H ATOM 514 HG2 MET A 35 27.253 31.201 12.589 1.00 0.00 H ATOM 515 HG3 MET A 35 27.510 32.936 12.884 1.00 0.00 H ATOM 516 HE1 MET A 35 27.426 30.038 10.360 1.00 0.00 H ATOM 517 HE2 MET A 35 25.872 30.809 9.958 1.00 0.00 H ATOM 518 HE3 MET A 35 27.216 30.853 8.791 1.00 0.00 H ATOM 519 H MET A 35 24.356 29.990 13.351 1.00 0.00 H ATOM 520 N THR A 36 22.862 31.933 14.958 1.00 13.27 N ATOM 521 CA THR A 36 21.605 32.480 15.493 1.00 14.03 C ATOM 522 C THR A 36 21.454 32.195 16.991 1.00 14.63 C ATOM 523 O THR A 36 20.339 32.038 17.495 1.00 14.85 O ATOM 524 CB THR A 36 20.359 31.938 14.748 1.00 13.88 C ATOM 525 OG1 THR A 36 20.294 30.514 14.885 1.00 13.32 O ATOM 526 CG2 THR A 36 20.374 32.322 13.262 1.00 14.60 C ATOM 527 HA THR A 36 21.662 33.557 15.335 1.00 0.00 H ATOM 528 HB THR A 36 19.476 32.391 15.198 1.00 0.00 H ATOM 529 HG1 THR A 36 19.496 30.174 14.407 1.00 0.00 H ATOM 530 HG23 THR A 36 20.424 33.407 13.169 1.00 0.00 H ATOM 531 HG21 THR A 36 21.244 31.875 12.781 1.00 0.00 H ATOM 532 HG22 THR A 36 19.465 31.956 12.784 1.00 0.00 H ATOM 533 H THR A 36 23.095 30.936 15.141 1.00 0.00 H ATOM 534 N GLN A 37 22.579 32.123 17.697 1.00 15.48 N ATOM 535 CA GLN A 37 22.554 31.921 19.144 1.00 16.16 C ATOM 536 C GLN A 37 22.781 33.244 19.876 1.00 16.04 C ATOM 537 O GLN A 37 23.843 33.858 19.742 1.00 16.69 O ATOM 538 CB GLN A 37 23.589 30.870 19.561 1.00 16.55 C ATOM 539 CG GLN A 37 23.640 29.663 18.634 1.00 18.14 C ATOM 540 CD GLN A 37 23.956 28.376 19.350 1.00 20.25 C ATOM 541 OE1 GLN A 37 23.111 27.816 20.056 1.00 21.73 O ATOM 542 NE2 GLN A 37 25.175 27.886 19.164 1.00 21.62 N ATOM 543 HA GLN A 37 21.569 31.548 19.425 1.00 0.00 H ATOM 544 HB2 GLN A 37 24.573 31.339 19.570 1.00 0.00 H ATOM 545 HB3 GLN A 37 23.344 30.524 20.565 1.00 0.00 H ATOM 546 HG2 GLN A 37 22.671 29.559 18.147 1.00 0.00 H ATOM 547 HG3 GLN A 37 24.408 29.837 17.880 1.00 0.00 H ATOM 548 HE22 GLN A 37 25.853 28.393 18.560 1.00 0.00 H ATOM 549 HE21 GLN A 37 25.453 26.994 19.622 1.00 0.00 H ATOM 550 H GLN A 37 23.494 32.212 17.210 1.00 0.00 H ATOM 551 N GLY A 38 21.775 33.686 20.630 1.00 15.51 N ATOM 552 CA GLY A 38 21.855 34.945 21.376 1.00 15.01 C ATOM 553 C GLY A 38 21.318 36.122 20.584 1.00 14.60 C ATOM 554 O GLY A 38 20.538 36.925 21.100 1.00 14.48 O ATOM 555 HA3 GLY A 38 22.898 35.138 21.627 1.00 0.00 H ATOM 556 HA2 GLY A 38 21.275 34.846 22.293 1.00 0.00 H ATOM 557 H GLY A 38 20.905 33.119 20.691 1.00 0.00 H ATOM 558 N LYS A 39 21.756 36.227 19.330 1.00 14.17 N ATOM 559 CA LYS A 39 21.215 37.190 18.375 1.00 13.77 C ATOM 560 C LYS A 39 21.343 36.615 16.963 1.00 12.78 C ATOM 561 O LYS A 39 22.078 35.659 16.742 1.00 13.08 O ATOM 562 CB LYS A 39 21.903 38.568 18.497 1.00 14.35 C ATOM 563 CG LYS A 39 23.078 38.835 17.551 1.00 16.08 C ATOM 564 CD LYS A 39 24.430 38.609 18.216 1.00 17.81 C ATOM 565 CE LYS A 39 25.594 38.961 17.276 1.00 17.30 C ATOM 566 NZ LYS A 39 25.750 37.993 16.135 1.00 18.45 N ATOM 567 HA LYS A 39 20.161 37.358 18.597 1.00 0.00 H ATOM 568 HB2 LYS A 39 21.148 39.332 18.311 1.00 0.00 H ATOM 569 HB3 LYS A 39 22.272 38.664 19.518 1.00 0.00 H ATOM 570 HG2 LYS A 39 22.995 38.167 16.694 1.00 0.00 H ATOM 571 HG3 LYS A 39 23.025 39.869 17.211 1.00 0.00 H ATOM 572 HD2 LYS A 39 24.494 39.234 19.107 1.00 0.00 H ATOM 573 HD3 LYS A 39 24.512 37.560 18.502 1.00 0.00 H ATOM 574 HE2 LYS A 39 26.518 38.966 17.855 1.00 0.00 H ATOM 575 HE3 LYS A 39 25.419 39.955 16.865 1.00 0.00 H ATOM 576 HZ1 LYS A 39 25.928 37.040 16.512 1.00 0.00 H ATOM 577 HZ2 LYS A 39 24.879 37.985 15.567 1.00 0.00 H ATOM 578 HZ3 LYS A 39 26.551 38.287 15.540 1.00 0.00 H ATOM 579 H LYS A 39 22.519 35.593 19.017 1.00 0.00 H ATOM 580 N CYS A 40 20.604 37.184 16.020 1.00 11.88 N ATOM 581 CA CYS A 40 20.745 36.804 14.627 1.00 10.74 C ATOM 582 C CYS A 40 21.945 37.527 14.043 1.00 10.36 C ATOM 583 O CYS A 40 22.003 38.755 14.070 1.00 10.57 O ATOM 584 CB CYS A 40 19.505 37.200 13.834 1.00 10.82 C ATOM 585 SG CYS A 40 17.951 36.814 14.628 1.00 9.74 S ATOM 586 HA CYS A 40 20.875 35.723 14.567 1.00 0.00 H ATOM 587 HB2 CYS A 40 19.535 36.681 12.876 1.00 0.00 H ATOM 588 HB3 CYS A 40 19.541 38.276 13.664 1.00 0.00 H ATOM 589 H CYS A 40 19.912 37.914 16.283 1.00 0.00 H ATOM 590 N LYS A 41 22.901 36.773 13.507 1.00 9.65 N ATOM 591 CA LYS A 41 23.978 37.393 12.763 1.00 8.97 C ATOM 592 C LYS A 41 23.341 38.091 11.562 1.00 8.84 C ATOM 593 O LYS A 41 22.616 37.463 10.801 1.00 8.86 O ATOM 594 CB LYS A 41 25.015 36.367 12.316 1.00 8.58 C ATOM 595 CG LYS A 41 26.221 36.996 11.626 1.00 8.02 C ATOM 596 CD LYS A 41 27.316 35.985 11.391 1.00 8.63 C ATOM 597 CE LYS A 41 28.503 36.616 10.668 1.00 9.27 C ATOM 598 NZ LYS A 41 29.551 35.598 10.349 1.00 9.17 N ATOM 599 HA LYS A 41 24.511 38.107 13.390 1.00 0.00 H ATOM 600 HB2 LYS A 41 25.363 35.820 13.193 1.00 0.00 H ATOM 601 HB3 LYS A 41 24.540 35.674 11.622 1.00 0.00 H ATOM 602 HG2 LYS A 41 25.906 37.406 10.667 1.00 0.00 H ATOM 603 HG3 LYS A 41 26.609 37.799 12.253 1.00 0.00 H ATOM 604 HD2 LYS A 41 27.651 35.594 12.351 1.00 0.00 H ATOM 605 HD3 LYS A 41 26.923 35.169 10.785 1.00 0.00 H ATOM 606 HE2 LYS A 41 28.938 37.386 11.305 1.00 0.00 H ATOM 607 HE3 LYS A 41 28.154 37.069 9.740 1.00 0.00 H ATOM 608 HZ1 LYS A 41 29.893 35.166 11.231 1.00 0.00 H ATOM 609 HZ2 LYS A 41 29.143 34.863 9.737 1.00 0.00 H ATOM 610 HZ3 LYS A 41 30.343 36.060 9.858 1.00 0.00 H ATOM 611 H LYS A 41 22.875 35.740 13.622 1.00 0.00 H ATOM 612 N PRO A 42 23.578 39.406 11.414 1.00 8.84 N ATOM 613 CA PRO A 42 22.871 40.181 10.389 1.00 8.56 C ATOM 614 C PRO A 42 23.198 39.806 8.945 1.00 7.81 C ATOM 615 O PRO A 42 22.301 39.767 8.106 1.00 8.06 O ATOM 616 CB PRO A 42 23.315 41.626 10.666 1.00 8.65 C ATOM 617 CG PRO A 42 23.905 41.608 12.042 1.00 9.18 C ATOM 618 CD PRO A 42 24.485 40.250 12.215 1.00 9.34 C ATOM 619 HA PRO A 42 21.799 40.000 10.461 1.00 0.00 H ATOM 620 HD3 PRO A 42 25.504 40.206 11.832 1.00 0.00 H ATOM 621 HD2 PRO A 42 24.479 39.950 13.263 1.00 0.00 H ATOM 622 HG3 PRO A 42 23.132 41.789 12.789 1.00 0.00 H ATOM 623 HG2 PRO A 42 24.682 42.367 12.133 1.00 0.00 H ATOM 624 HB2 PRO A 42 24.060 41.942 9.936 1.00 0.00 H ATOM 625 HB3 PRO A 42 22.460 42.301 10.627 1.00 0.00 H ATOM 626 N VAL A 43 24.473 39.559 8.660 1.00 7.03 N ATOM 627 CA VAL A 43 24.940 39.297 7.298 1.00 6.74 C ATOM 628 C VAL A 43 25.984 38.198 7.365 1.00 6.99 C ATOM 629 O VAL A 43 26.884 38.245 8.192 1.00 7.62 O ATOM 630 CB VAL A 43 25.545 40.578 6.635 1.00 6.46 C ATOM 631 CG1 VAL A 43 26.141 40.271 5.265 1.00 6.38 C ATOM 632 CG2 VAL A 43 24.494 41.675 6.504 1.00 7.04 C ATOM 633 HA VAL A 43 24.095 38.991 6.682 1.00 0.00 H ATOM 634 HB VAL A 43 26.344 40.929 7.288 1.00 0.00 H ATOM 635 HG11 VAL A 43 26.934 39.531 5.373 1.00 0.00 H ATOM 636 HG12 VAL A 43 25.362 39.879 4.611 1.00 0.00 H ATOM 637 HG13 VAL A 43 26.551 41.185 4.836 1.00 0.00 H ATOM 638 HG21 VAL A 43 23.671 41.316 5.885 1.00 0.00 H ATOM 639 HG22 VAL A 43 24.119 41.937 7.493 1.00 0.00 H ATOM 640 HG23 VAL A 43 24.943 42.553 6.040 1.00 0.00 H ATOM 641 H VAL A 43 25.166 39.552 9.436 1.00 0.00 H ATOM 642 N ASN A 44 25.843 37.200 6.498 1.00 6.90 N ATOM 643 CA ASN A 44 26.829 36.133 6.411 1.00 6.75 C ATOM 644 C ASN A 44 26.875 35.509 5.028 1.00 6.78 C ATOM 645 O ASN A 44 25.840 35.222 4.438 1.00 7.06 O ATOM 646 CB ASN A 44 26.542 35.038 7.434 1.00 6.97 C ATOM 647 CG ASN A 44 27.652 34.026 7.506 1.00 6.58 C ATOM 648 OD1 ASN A 44 28.705 34.304 8.070 1.00 7.25 O ATOM 649 ND2 ASN A 44 27.437 32.854 6.924 1.00 5.67 N ATOM 650 HA ASN A 44 27.796 36.591 6.620 1.00 0.00 H ATOM 651 HB2 ASN A 44 26.420 35.497 8.415 1.00 0.00 H ATOM 652 HB3 ASN A 44 25.619 34.529 7.155 1.00 0.00 H ATOM 653 HD22 ASN A 44 26.527 32.664 6.458 1.00 0.00 H ATOM 654 HD21 ASN A 44 28.178 32.125 6.934 1.00 0.00 H ATOM 655 H ASN A 44 25.014 37.181 5.871 1.00 0.00 H ATOM 656 N THR A 45 28.090 35.308 4.532 1.00 6.28 N ATOM 657 CA THR A 45 28.328 34.729 3.213 1.00 6.48 C ATOM 658 C THR A 45 28.823 33.277 3.290 1.00 5.96 C ATOM 659 O THR A 45 29.748 32.962 4.048 1.00 6.42 O ATOM 660 CB THR A 45 29.369 35.563 2.441 1.00 6.53 C ATOM 661 OG1 THR A 45 29.015 36.950 2.526 1.00 8.49 O ATOM 662 CG2 THR A 45 29.440 35.137 0.964 1.00 7.10 C ATOM 663 HA THR A 45 27.370 34.738 2.693 1.00 0.00 H ATOM 664 HB THR A 45 30.349 35.396 2.888 1.00 0.00 H ATOM 665 HG1 THR A 45 28.118 37.085 2.129 1.00 0.00 H ATOM 666 HG23 THR A 45 29.709 34.082 0.904 1.00 0.00 H ATOM 667 HG21 THR A 45 28.468 35.293 0.495 1.00 0.00 H ATOM 668 HG22 THR A 45 30.193 35.735 0.450 1.00 0.00 H ATOM 669 H THR A 45 28.912 35.576 5.111 1.00 0.00 H ATOM 670 N PHE A 46 28.209 32.409 2.493 1.00 6.14 N ATOM 671 CA PHE A 46 28.719 31.050 2.304 1.00 5.80 C ATOM 672 C PHE A 46 29.357 30.941 0.933 1.00 6.09 C ATOM 673 O PHE A 46 28.870 31.524 -0.040 1.00 6.05 O ATOM 674 CB PHE A 46 27.598 30.019 2.446 1.00 6.17 C ATOM 675 CG PHE A 46 27.069 29.914 3.840 1.00 5.40 C ATOM 676 CD1 PHE A 46 27.770 29.202 4.812 1.00 5.90 C ATOM 677 CD2 PHE A 46 25.890 30.552 4.194 1.00 5.96 C ATOM 678 CE1 PHE A 46 27.293 29.122 6.120 1.00 5.95 C ATOM 679 CE2 PHE A 46 25.403 30.473 5.491 1.00 5.67 C ATOM 680 CZ PHE A 46 26.102 29.755 6.452 1.00 6.18 C ATOM 681 HA PHE A 46 29.463 30.844 3.073 1.00 0.00 H ATOM 682 HB2 PHE A 46 26.779 30.303 1.785 1.00 0.00 H ATOM 683 HB3 PHE A 46 27.983 29.044 2.147 1.00 0.00 H ATOM 684 HD2 PHE A 46 25.340 31.122 3.445 1.00 0.00 H ATOM 685 HE2 PHE A 46 24.472 30.974 5.755 1.00 0.00 H ATOM 686 HZ PHE A 46 25.715 29.688 7.469 1.00 0.00 H ATOM 687 HE1 PHE A 46 27.850 28.568 6.875 1.00 0.00 H ATOM 688 HD1 PHE A 46 28.702 28.702 4.547 1.00 0.00 H ATOM 689 H PHE A 46 27.346 32.702 1.992 1.00 0.00 H ATOM 690 N VAL A 47 30.450 30.197 0.869 1.00 6.64 N ATOM 691 CA VAL A 47 31.206 30.033 -0.369 1.00 7.19 C ATOM 692 C VAL A 47 31.085 28.591 -0.833 1.00 7.69 C ATOM 693 O VAL A 47 31.284 27.654 -0.050 1.00 7.66 O ATOM 694 CB VAL A 47 32.697 30.418 -0.188 1.00 7.55 C ATOM 695 CG1 VAL A 47 33.429 30.377 -1.535 1.00 8.27 C ATOM 696 CG2 VAL A 47 32.818 31.803 0.443 1.00 8.00 C ATOM 697 HA VAL A 47 30.791 30.704 -1.121 1.00 0.00 H ATOM 698 HB VAL A 47 33.162 29.693 0.480 1.00 0.00 H ATOM 699 HG11 VAL A 47 33.370 29.370 -1.949 1.00 0.00 H ATOM 700 HG12 VAL A 47 32.961 31.082 -2.223 1.00 0.00 H ATOM 701 HG13 VAL A 47 34.474 30.650 -1.388 1.00 0.00 H ATOM 702 HG21 VAL A 47 32.337 32.538 -0.202 1.00 0.00 H ATOM 703 HG22 VAL A 47 32.331 31.800 1.418 1.00 0.00 H ATOM 704 HG23 VAL A 47 33.872 32.056 0.562 1.00 0.00 H ATOM 705 H VAL A 47 30.781 29.714 1.728 1.00 0.00 H ATOM 706 N HIS A 48 30.764 28.416 -2.112 1.00 8.14 N ATOM 707 CA HIS A 48 30.496 27.088 -2.653 1.00 8.60 C ATOM 708 C HIS A 48 31.658 26.464 -3.426 1.00 9.25 C ATOM 709 O HIS A 48 31.553 25.330 -3.915 1.00 10.05 O ATOM 710 CB HIS A 48 29.203 27.129 -3.462 1.00 8.60 C ATOM 711 CG HIS A 48 28.045 27.613 -2.657 1.00 8.55 C ATOM 712 ND1 HIS A 48 27.592 26.943 -1.541 1.00 8.29 N ATOM 713 CD2 HIS A 48 27.293 28.732 -2.757 1.00 9.60 C ATOM 714 CE1 HIS A 48 26.582 27.608 -1.012 1.00 7.54 C ATOM 715 NE2 HIS A 48 26.384 28.700 -1.729 1.00 8.71 N ATOM 716 HA HIS A 48 30.373 26.414 -1.805 1.00 0.00 H ATOM 717 HB2 HIS A 48 29.342 27.797 -4.312 1.00 0.00 H ATOM 718 HB3 HIS A 48 28.983 26.124 -3.823 1.00 0.00 H ATOM 719 HD2 HIS A 48 27.390 29.512 -3.512 1.00 0.00 H ATOM 720 HE1 HIS A 48 26.010 27.308 -0.134 1.00 0.00 H ATOM 721 H HIS A 48 30.703 29.243 -2.739 1.00 0.00 H ATOM 722 N GLU A 49 32.774 27.187 -3.489 1.00 9.42 N ATOM 723 CA GLU A 49 33.986 26.718 -4.155 1.00 9.33 C ATOM 724 C GLU A 49 34.781 25.771 -3.261 1.00 9.12 C ATOM 725 O GLU A 49 34.537 25.688 -2.054 1.00 8.88 O ATOM 726 CB GLU A 49 34.869 27.908 -4.549 1.00 9.39 C ATOM 727 CG GLU A 49 34.187 28.951 -5.422 1.00 10.22 C ATOM 728 CD GLU A 49 33.760 28.440 -6.791 1.00 10.65 C ATOM 729 OE1 GLU A 49 34.328 27.438 -7.294 1.00 10.61 O ATOM 730 OE2 GLU A 49 32.849 29.059 -7.377 1.00 10.79 O ATOM 731 HA GLU A 49 33.682 26.175 -5.050 1.00 0.00 H ATOM 732 HB2 GLU A 49 35.205 28.398 -3.635 1.00 0.00 H ATOM 733 HB3 GLU A 49 35.733 27.524 -5.092 1.00 0.00 H ATOM 734 HG2 GLU A 49 33.300 29.308 -4.898 1.00 0.00 H ATOM 735 HG3 GLU A 49 34.879 29.780 -5.568 1.00 0.00 H ATOM 736 H GLU A 49 32.783 28.127 -3.044 1.00 0.00 H ATOM 737 N SER A 50 35.724 25.055 -3.872 1.00 8.41 N ATOM 738 CA SER A 50 36.669 24.207 -3.156 1.00 8.84 C ATOM 739 C SER A 50 37.330 24.977 -2.023 1.00 8.64 C ATOM 740 O SER A 50 37.684 26.146 -2.199 1.00 8.57 O ATOM 741 CB SER A 50 37.765 23.771 -4.122 1.00 8.70 C ATOM 742 OG SER A 50 38.589 22.785 -3.544 1.00 10.29 O ATOM 743 HA SER A 50 36.130 23.351 -2.750 1.00 0.00 H ATOM 744 HB2 SER A 50 38.374 24.636 -4.383 1.00 0.00 H ATOM 745 HB3 SER A 50 37.305 23.367 -5.024 1.00 0.00 H ATOM 746 HG SER A 50 39.290 22.521 -4.192 1.00 0.00 H ATOM 747 H SER A 50 35.789 25.103 -4.909 1.00 0.00 H ATOM 748 N LEU A 51 37.522 24.318 -0.880 1.00 8.25 N ATOM 749 CA LEU A 51 38.318 24.899 0.206 1.00 8.47 C ATOM 750 C LEU A 51 39.725 25.276 -0.287 1.00 8.47 C ATOM 751 O LEU A 51 40.282 26.294 0.134 1.00 8.35 O ATOM 752 CB LEU A 51 38.410 23.945 1.406 1.00 8.56 C ATOM 753 CG LEU A 51 39.131 24.488 2.649 1.00 8.87 C ATOM 754 CD1 LEU A 51 38.442 25.733 3.209 1.00 10.74 C ATOM 755 CD2 LEU A 51 39.291 23.421 3.726 1.00 9.16 C ATOM 756 HA LEU A 51 37.811 25.806 0.535 1.00 0.00 H ATOM 757 HB2 LEU A 51 37.394 23.680 1.699 1.00 0.00 H ATOM 758 HB3 LEU A 51 38.938 23.049 1.080 1.00 0.00 H ATOM 759 HG LEU A 51 40.130 24.781 2.326 1.00 0.00 H ATOM 760 HD21 LEU A 51 38.307 23.064 4.031 1.00 0.00 H ATOM 761 HD22 LEU A 51 39.874 22.590 3.329 1.00 0.00 H ATOM 762 HD23 LEU A 51 39.806 23.849 4.586 1.00 0.00 H ATOM 763 HD11 LEU A 51 38.434 26.515 2.449 1.00 0.00 H ATOM 764 HD12 LEU A 51 37.418 25.485 3.488 1.00 0.00 H ATOM 765 HD13 LEU A 51 38.985 26.083 4.087 1.00 0.00 H ATOM 766 H LEU A 51 37.100 23.376 -0.756 1.00 0.00 H ATOM 767 N ALA A 52 40.288 24.463 -1.185 1.00 8.45 N ATOM 768 CA ALA A 52 41.594 24.772 -1.789 1.00 8.23 C ATOM 769 C ALA A 52 41.576 26.099 -2.545 1.00 7.93 C ATOM 770 O ALA A 52 42.535 26.868 -2.466 1.00 8.21 O ATOM 771 CB ALA A 52 42.053 23.634 -2.718 1.00 8.23 C ATOM 772 HA ALA A 52 42.308 24.868 -0.971 1.00 0.00 H ATOM 773 HB1 ALA A 52 42.141 22.711 -2.144 1.00 0.00 H ATOM 774 HB2 ALA A 52 41.321 23.499 -3.514 1.00 0.00 H ATOM 775 HB3 ALA A 52 43.021 23.888 -3.151 1.00 0.00 H ATOM 776 H ALA A 52 39.792 23.592 -1.464 1.00 0.00 H ATOM 777 N ASP A 53 40.490 26.362 -3.274 1.00 7.57 N ATOM 778 CA ASP A 53 40.346 27.620 -4.000 1.00 7.54 C ATOM 779 C ASP A 53 40.195 28.807 -3.051 1.00 6.87 C ATOM 780 O ASP A 53 40.716 29.891 -3.310 1.00 7.09 O ATOM 781 CB ASP A 53 39.175 27.563 -4.982 1.00 7.67 C ATOM 782 CG ASP A 53 39.541 26.881 -6.287 1.00 8.55 C ATOM 783 OD1 ASP A 53 40.746 26.655 -6.544 1.00 9.27 O ATOM 784 OD2 ASP A 53 38.622 26.585 -7.073 1.00 8.68 O ATOM 785 HA ASP A 53 41.263 27.766 -4.571 1.00 0.00 H ATOM 786 HB2 ASP A 53 38.356 27.013 -4.518 1.00 0.00 H ATOM 787 HB3 ASP A 53 38.851 28.581 -5.199 1.00 0.00 H ATOM 788 H ASP A 53 39.729 25.655 -3.326 1.00 0.00 H ATOM 789 N VAL A 54 39.490 28.595 -1.944 1.00 6.73 N ATOM 790 CA VAL A 54 39.293 29.657 -0.957 1.00 6.42 C ATOM 791 C VAL A 54 40.601 29.937 -0.215 1.00 6.69 C ATOM 792 O VAL A 54 40.986 31.094 -0.048 1.00 7.26 O ATOM 793 CB VAL A 54 38.087 29.361 -0.018 1.00 6.96 C ATOM 794 CG1 VAL A 54 37.862 30.491 0.977 1.00 6.52 C ATOM 795 CG2 VAL A 54 36.820 29.163 -0.857 1.00 5.51 C ATOM 796 HA VAL A 54 39.023 30.577 -1.476 1.00 0.00 H ATOM 797 HB VAL A 54 38.313 28.454 0.543 1.00 0.00 H ATOM 798 HG11 VAL A 54 38.754 30.616 1.590 1.00 0.00 H ATOM 799 HG12 VAL A 54 37.659 31.415 0.436 1.00 0.00 H ATOM 800 HG13 VAL A 54 37.012 30.248 1.615 1.00 0.00 H ATOM 801 HG21 VAL A 54 36.620 30.068 -1.430 1.00 0.00 H ATOM 802 HG22 VAL A 54 36.964 28.324 -1.538 1.00 0.00 H ATOM 803 HG23 VAL A 54 35.977 28.956 -0.197 1.00 0.00 H ATOM 804 H VAL A 54 39.071 27.658 -1.777 1.00 0.00 H ATOM 805 N LYS A 55 41.293 28.876 0.193 1.00 6.34 N ATOM 806 CA LYS A 55 42.636 29.028 0.780 1.00 6.52 C ATOM 807 C LYS A 55 43.618 29.738 -0.160 1.00 6.35 C ATOM 808 O LYS A 55 44.450 30.531 0.296 1.00 6.47 O ATOM 809 CB LYS A 55 43.195 27.668 1.214 1.00 6.48 C ATOM 810 CG LYS A 55 42.558 27.122 2.476 1.00 7.54 C ATOM 811 CD LYS A 55 43.082 25.722 2.763 1.00 9.76 C ATOM 812 CE LYS A 55 42.507 25.178 4.055 1.00 12.15 C ATOM 813 NZ LYS A 55 43.042 23.821 4.379 1.00 13.89 N ATOM 814 HA LYS A 55 42.523 29.664 1.658 1.00 0.00 H ATOM 815 HB2 LYS A 55 43.028 26.954 0.407 1.00 0.00 H ATOM 816 HB3 LYS A 55 44.266 27.775 1.387 1.00 0.00 H ATOM 817 HG2 LYS A 55 42.799 27.776 3.314 1.00 0.00 H ATOM 818 HG3 LYS A 55 41.476 27.083 2.346 1.00 0.00 H ATOM 819 HD2 LYS A 55 42.802 25.062 1.942 1.00 0.00 H ATOM 820 HD3 LYS A 55 44.168 25.758 2.844 1.00 0.00 H ATOM 821 HE2 LYS A 55 41.423 25.115 3.959 1.00 0.00 H ATOM 822 HE3 LYS A 55 42.760 25.859 4.867 1.00 0.00 H ATOM 823 HZ1 LYS A 55 42.799 23.162 3.612 1.00 0.00 H ATOM 824 HZ2 LYS A 55 44.076 23.872 4.479 1.00 0.00 H ATOM 825 HZ3 LYS A 55 42.622 23.488 5.270 1.00 0.00 H ATOM 826 H LYS A 55 40.880 27.926 0.096 1.00 0.00 H ATOM 827 N ALA A 56 43.508 29.463 -1.462 1.00 5.90 N ATOM 828 CA ALA A 56 44.387 30.068 -2.470 1.00 6.47 C ATOM 829 C ALA A 56 44.310 31.592 -2.475 1.00 6.48 C ATOM 830 O ALA A 56 45.276 32.266 -2.852 1.00 7.25 O ATOM 831 CB ALA A 56 44.075 29.514 -3.865 1.00 6.33 C ATOM 832 HA ALA A 56 45.408 29.798 -2.199 1.00 0.00 H ATOM 833 HB1 ALA A 56 44.226 28.434 -3.868 1.00 0.00 H ATOM 834 HB2 ALA A 56 43.039 29.738 -4.120 1.00 0.00 H ATOM 835 HB3 ALA A 56 44.739 29.977 -4.595 1.00 0.00 H ATOM 836 H ALA A 56 42.773 28.796 -1.773 1.00 0.00 H ATOM 837 N VAL A 57 43.157 32.128 -2.074 1.00 6.32 N ATOM 838 CA VAL A 57 42.952 33.575 -2.036 1.00 6.57 C ATOM 839 C VAL A 57 44.014 34.277 -1.182 1.00 6.83 C ATOM 840 O VAL A 57 44.395 35.412 -1.485 1.00 7.02 O ATOM 841 CB VAL A 57 41.527 33.922 -1.580 1.00 6.50 C ATOM 842 CG1 VAL A 57 41.325 35.443 -1.486 1.00 6.09 C ATOM 843 CG2 VAL A 57 40.520 33.313 -2.543 1.00 6.09 C ATOM 844 HA VAL A 57 43.068 33.951 -3.053 1.00 0.00 H ATOM 845 HB VAL A 57 41.373 33.506 -0.584 1.00 0.00 H ATOM 846 HG11 VAL A 57 42.031 35.858 -0.766 1.00 0.00 H ATOM 847 HG12 VAL A 57 41.495 35.892 -2.464 1.00 0.00 H ATOM 848 HG13 VAL A 57 40.306 35.654 -1.161 1.00 0.00 H ATOM 849 HG21 VAL A 57 40.688 33.713 -3.543 1.00 0.00 H ATOM 850 HG22 VAL A 57 40.642 32.230 -2.558 1.00 0.00 H ATOM 851 HG23 VAL A 57 39.510 33.561 -2.216 1.00 0.00 H ATOM 852 H VAL A 57 42.382 31.500 -1.780 1.00 0.00 H ATOM 853 N CYS A 58 44.510 33.582 -0.156 1.00 7.07 N ATOM 854 CA CYS A 58 45.537 34.108 0.749 1.00 7.19 C ATOM 855 C CYS A 58 46.888 34.321 0.056 1.00 7.63 C ATOM 856 O CYS A 58 47.828 34.848 0.666 1.00 8.43 O ATOM 857 CB CYS A 58 45.700 33.199 1.974 1.00 7.45 C ATOM 858 SG CYS A 58 44.234 33.087 2.980 1.00 8.47 S ATOM 859 HA CYS A 58 45.191 35.088 1.076 1.00 0.00 H ATOM 860 HB2 CYS A 58 46.511 33.591 2.588 1.00 0.00 H ATOM 861 HB3 CYS A 58 45.958 32.198 1.629 1.00 0.00 H ATOM 862 H CYS A 58 44.150 32.620 0.010 1.00 0.00 H ATOM 863 N SER A 59 46.980 33.916 -1.208 1.00 7.47 N ATOM 864 CA SER A 59 48.180 34.152 -2.005 1.00 8.08 C ATOM 865 C SER A 59 47.877 35.017 -3.221 1.00 8.37 C ATOM 866 O SER A 59 48.707 35.136 -4.124 1.00 7.97 O ATOM 867 CB SER A 59 48.810 32.831 -2.438 1.00 8.12 C ATOM 868 OG SER A 59 47.983 32.165 -3.367 1.00 8.91 O ATOM 869 HA SER A 59 48.891 34.689 -1.378 1.00 0.00 H ATOM 870 HB2 SER A 59 48.949 32.196 -1.563 1.00 0.00 H ATOM 871 HB3 SER A 59 49.778 33.030 -2.898 1.00 0.00 H ATOM 872 HG SER A 59 47.104 31.980 -2.951 1.00 0.00 H ATOM 873 H SER A 59 46.176 33.418 -1.640 1.00 0.00 H ATOM 874 N GLN A 60 46.688 35.614 -3.244 1.00 9.57 N ATOM 875 CA GLN A 60 46.264 36.429 -4.383 1.00 10.96 C ATOM 876 C GLN A 60 46.398 37.941 -4.141 1.00 11.72 C ATOM 877 O GLN A 60 47.413 38.383 -3.593 1.00 12.85 O ATOM 878 CB GLN A 60 44.881 35.985 -4.873 1.00 10.43 C ATOM 879 CG GLN A 60 44.964 34.597 -5.532 1.00 10.21 C ATOM 880 CD GLN A 60 43.632 33.888 -5.675 1.00 10.25 C ATOM 881 OE1 GLN A 60 42.576 34.513 -5.710 1.00 10.69 O ATOM 882 NE2 GLN A 60 43.682 32.566 -5.781 1.00 10.90 N ATOM 883 HA GLN A 60 46.961 36.247 -5.201 1.00 0.00 H ATOM 884 HB2 GLN A 60 44.197 35.940 -4.025 1.00 0.00 H ATOM 885 HB3 GLN A 60 44.509 36.706 -5.601 1.00 0.00 H ATOM 886 HG2 GLN A 60 45.394 34.717 -6.526 1.00 0.00 H ATOM 887 HG3 GLN A 60 45.620 33.971 -4.927 1.00 0.00 H ATOM 888 HE22 GLN A 60 44.599 32.076 -5.746 1.00 0.00 H ATOM 889 HE21 GLN A 60 42.805 32.020 -5.899 1.00 0.00 H ATOM 890 H GLN A 60 46.046 35.499 -2.434 1.00 0.00 H ATOM 891 N LYS A 61 45.398 38.728 -4.545 1.00 12.46 N ATOM 892 CA LYS A 61 45.497 40.196 -4.516 1.00 13.21 C ATOM 893 C LYS A 61 45.314 40.747 -3.098 1.00 12.51 C ATOM 894 O LYS A 61 44.254 40.582 -2.505 1.00 13.22 O ATOM 895 CB LYS A 61 44.471 40.808 -5.493 1.00 13.26 C ATOM 896 CG LYS A 61 44.229 42.316 -5.405 1.00 15.51 C ATOM 897 CD LYS A 61 43.236 42.762 -6.490 1.00 14.87 C ATOM 898 CE LYS A 61 42.583 44.095 -6.145 1.00 17.55 C ATOM 899 NZ LYS A 61 41.531 44.507 -7.126 1.00 19.09 N ATOM 900 HA LYS A 61 46.499 40.480 -4.837 1.00 0.00 H ATOM 901 HB2 LYS A 61 44.812 40.590 -6.505 1.00 0.00 H ATOM 902 HB3 LYS A 61 43.516 40.312 -5.318 1.00 0.00 H ATOM 903 HG2 LYS A 61 43.822 42.558 -4.423 1.00 0.00 H ATOM 904 HG3 LYS A 61 45.174 42.841 -5.545 1.00 0.00 H ATOM 905 HD2 LYS A 61 43.768 42.864 -7.436 1.00 0.00 H ATOM 906 HD3 LYS A 61 42.459 42.004 -6.591 1.00 0.00 H ATOM 907 HE2 LYS A 61 43.355 44.864 -6.121 1.00 0.00 H ATOM 908 HE3 LYS A 61 42.125 44.012 -5.160 1.00 0.00 H ATOM 909 HZ1 LYS A 61 41.957 44.600 -8.070 1.00 0.00 H ATOM 910 HZ2 LYS A 61 40.781 43.787 -7.152 1.00 0.00 H ATOM 911 HZ3 LYS A 61 41.126 45.420 -6.835 1.00 0.00 H ATOM 912 H LYS A 61 44.521 38.289 -4.891 1.00 0.00 H ATOM 913 N LYS A 62 46.344 41.396 -2.555 1.00 12.15 N ATOM 914 CA LYS A 62 46.209 42.080 -1.267 1.00 11.77 C ATOM 915 C LYS A 62 45.242 43.249 -1.410 1.00 11.28 C ATOM 916 O LYS A 62 45.309 43.994 -2.392 1.00 11.39 O ATOM 917 CB LYS A 62 47.554 42.609 -0.763 1.00 12.15 C ATOM 918 CG LYS A 62 48.575 41.539 -0.421 1.00 12.61 C ATOM 919 CD LYS A 62 49.825 42.139 0.213 1.00 13.08 C ATOM 920 CE LYS A 62 50.898 41.072 0.393 1.00 13.98 C ATOM 921 NZ LYS A 62 52.218 41.673 0.746 1.00 15.17 N ATOM 922 HA LYS A 62 45.832 41.356 -0.545 1.00 0.00 H ATOM 923 HB2 LYS A 62 47.979 43.247 -1.538 1.00 0.00 H ATOM 924 HB3 LYS A 62 47.371 43.201 0.134 1.00 0.00 H ATOM 925 HG2 LYS A 62 48.127 40.833 0.278 1.00 0.00 H ATOM 926 HG3 LYS A 62 48.858 41.015 -1.334 1.00 0.00 H ATOM 927 HD2 LYS A 62 50.210 42.930 -0.431 1.00 0.00 H ATOM 928 HD3 LYS A 62 49.568 42.557 1.186 1.00 0.00 H ATOM 929 HE2 LYS A 62 51.001 40.513 -0.537 1.00 0.00 H ATOM 930 HE3 LYS A 62 50.593 40.394 1.191 1.00 0.00 H ATOM 931 HZ1 LYS A 62 52.519 42.317 -0.014 1.00 0.00 H ATOM 932 HZ2 LYS A 62 52.129 42.203 1.636 1.00 0.00 H ATOM 933 HZ3 LYS A 62 52.922 40.917 0.860 1.00 0.00 H ATOM 934 H LYS A 62 47.257 41.417 -3.053 1.00 0.00 H ATOM 935 N VAL A 63 44.334 43.381 -0.444 1.00 10.82 N ATOM 936 CA VAL A 63 43.441 44.535 -0.346 1.00 10.32 C ATOM 937 C VAL A 63 43.227 44.868 1.126 1.00 10.26 C ATOM 938 O VAL A 63 43.270 43.990 1.981 1.00 10.28 O ATOM 939 CB VAL A 63 42.059 44.296 -1.020 1.00 10.24 C ATOM 940 CG1 VAL A 63 42.206 44.088 -2.525 1.00 11.48 C ATOM 941 CG2 VAL A 63 41.326 43.128 -0.365 1.00 10.50 C ATOM 942 HA VAL A 63 43.917 45.360 -0.876 1.00 0.00 H ATOM 943 HB VAL A 63 41.455 45.191 -0.872 1.00 0.00 H ATOM 944 HG11 VAL A 63 42.662 44.973 -2.970 1.00 0.00 H ATOM 945 HG12 VAL A 63 42.838 43.220 -2.710 1.00 0.00 H ATOM 946 HG13 VAL A 63 41.223 43.924 -2.966 1.00 0.00 H ATOM 947 HG21 VAL A 63 41.925 42.223 -0.464 1.00 0.00 H ATOM 948 HG22 VAL A 63 41.168 43.346 0.691 1.00 0.00 H ATOM 949 HG23 VAL A 63 40.364 42.984 -0.856 1.00 0.00 H ATOM 950 H VAL A 63 44.257 42.630 0.272 1.00 0.00 H ATOM 951 N THR A 64 42.989 46.137 1.426 1.00 9.85 N ATOM 952 CA THR A 64 42.777 46.522 2.809 1.00 9.80 C ATOM 953 C THR A 64 41.420 46.018 3.296 1.00 9.64 C ATOM 954 O THR A 64 40.432 46.087 2.573 1.00 9.95 O ATOM 955 CB THR A 64 42.885 48.040 2.973 1.00 9.78 C ATOM 956 OG1 THR A 64 44.131 48.475 2.417 1.00 10.09 O ATOM 957 CG2 THR A 64 42.812 48.427 4.452 1.00 10.11 C ATOM 958 HA THR A 64 43.555 46.063 3.419 1.00 0.00 H ATOM 959 HB THR A 64 42.056 48.520 2.453 1.00 0.00 H ATOM 960 HG1 THR A 64 44.877 48.031 2.894 1.00 0.00 H ATOM 961 HG23 THR A 64 41.861 48.093 4.867 1.00 0.00 H ATOM 962 HG21 THR A 64 43.632 47.953 4.991 1.00 0.00 H ATOM 963 HG22 THR A 64 42.891 49.510 4.547 1.00 0.00 H ATOM 964 H THR A 64 42.954 46.854 0.673 1.00 0.00 H ATOM 965 N CYS A 65 41.384 45.504 4.524 1.00 9.74 N ATOM 966 CA CYS A 65 40.122 45.088 5.123 1.00 10.36 C ATOM 967 C CYS A 65 39.255 46.319 5.377 1.00 10.72 C ATOM 968 O CYS A 65 39.779 47.436 5.557 1.00 11.41 O ATOM 969 CB CYS A 65 40.367 44.348 6.438 1.00 10.05 C ATOM 970 SG CYS A 65 41.563 43.001 6.349 1.00 10.42 S ATOM 971 HA CYS A 65 39.612 44.411 4.437 1.00 0.00 H ATOM 972 HB2 CYS A 65 39.417 43.934 6.775 1.00 0.00 H ATOM 973 HB3 CYS A 65 40.727 45.071 7.170 1.00 0.00 H ATOM 974 H CYS A 65 42.267 45.398 5.062 1.00 0.00 H ATOM 975 N LYS A 66 37.938 46.118 5.405 1.00 10.92 N ATOM 976 CA LYS A 66 36.988 47.191 5.713 1.00 11.15 C ATOM 977 C LYS A 66 37.336 47.884 7.033 1.00 11.01 C ATOM 978 O LYS A 66 37.207 49.102 7.155 1.00 11.32 O ATOM 979 CB LYS A 66 35.559 46.642 5.794 1.00 11.35 C ATOM 980 CG LYS A 66 34.919 46.282 4.468 1.00 12.90 C ATOM 981 CD LYS A 66 33.444 45.988 4.681 1.00 15.19 C ATOM 982 CE LYS A 66 32.756 45.583 3.384 1.00 16.41 C ATOM 983 NZ LYS A 66 31.277 45.662 3.503 1.00 19.05 N ATOM 984 HA LYS A 66 37.053 47.921 4.906 1.00 0.00 H ATOM 985 HB2 LYS A 66 35.579 45.744 6.412 1.00 0.00 H ATOM 986 HB3 LYS A 66 34.936 47.397 6.273 1.00 0.00 H ATOM 987 HG2 LYS A 66 35.027 47.115 3.774 1.00 0.00 H ATOM 988 HG3 LYS A 66 35.410 45.401 4.055 1.00 0.00 H ATOM 989 HD2 LYS A 66 33.346 45.176 5.401 1.00 0.00 H ATOM 990 HD3 LYS A 66 32.959 46.881 5.074 1.00 0.00 H ATOM 991 HE2 LYS A 66 33.037 44.559 3.138 1.00 0.00 H ATOM 992 HE3 LYS A 66 33.083 46.250 2.586 1.00 0.00 H ATOM 993 HZ1 LYS A 66 30.957 45.024 4.259 1.00 0.00 H ATOM 994 HZ2 LYS A 66 31.000 46.638 3.732 1.00 0.00 H ATOM 995 HZ3 LYS A 66 30.842 45.379 2.601 1.00 0.00 H ATOM 996 H LYS A 66 37.571 45.166 5.201 1.00 0.00 H ATOM 997 N ASN A 67 37.795 47.108 8.013 1.00 11.02 N ATOM 998 CA ASN A 67 38.110 47.652 9.338 1.00 11.01 C ATOM 999 C ASN A 67 39.524 48.224 9.462 1.00 10.91 C ATOM 1000 O ASN A 67 39.975 48.554 10.559 1.00 10.81 O ATOM 1001 CB ASN A 67 37.855 46.602 10.425 1.00 10.85 C ATOM 1002 CG ASN A 67 38.863 45.457 10.397 1.00 11.20 C ATOM 1003 OD1 ASN A 67 39.805 45.449 9.600 1.00 10.87 O ATOM 1004 ND2 ASN A 67 38.658 44.476 11.270 1.00 10.01 N ATOM 1005 HA ASN A 67 37.437 48.498 9.478 1.00 0.00 H ATOM 1006 HB2 ASN A 67 37.910 47.089 11.398 1.00 0.00 H ATOM 1007 HB3 ASN A 67 36.856 46.189 10.282 1.00 0.00 H ATOM 1008 HD22 ASN A 67 37.851 44.523 11.924 1.00 0.00 H ATOM 1009 HD21 ASN A 67 39.305 43.662 11.299 1.00 0.00 H ATOM 1010 H ASN A 67 37.933 46.093 7.835 1.00 0.00 H ATOM 1011 N GLY A 68 40.237 48.323 8.345 1.00 10.56 N ATOM 1012 CA GLY A 68 41.560 48.938 8.368 1.00 10.86 C ATOM 1013 C GLY A 68 42.705 47.987 8.645 1.00 10.65 C ATOM 1014 O GLY A 68 43.873 48.386 8.555 1.00 11.51 O ATOM 1015 HA3 GLY A 68 41.563 49.705 9.142 1.00 0.00 H ATOM 1016 HA2 GLY A 68 41.734 49.403 7.397 1.00 0.00 H ATOM 1017 H GLY A 68 39.850 47.960 7.450 1.00 0.00 H ATOM 1018 N GLN A 69 42.398 46.734 8.984 1.00 10.49 N ATOM 1019 CA GLN A 69 43.455 45.719 9.070 1.00 9.67 C ATOM 1020 C GLN A 69 44.054 45.460 7.689 1.00 9.34 C ATOM 1021 O GLN A 69 43.450 45.774 6.660 1.00 8.74 O ATOM 1022 CB GLN A 69 42.968 44.430 9.744 1.00 10.17 C ATOM 1023 CG GLN A 69 42.635 44.657 11.212 1.00 10.22 C ATOM 1024 CD GLN A 69 42.320 43.386 11.970 1.00 11.07 C ATOM 1025 OE1 GLN A 69 41.163 43.117 12.293 1.00 13.14 O ATOM 1026 NE2 GLN A 69 43.349 42.607 12.280 1.00 9.86 N ATOM 1027 HA GLN A 69 44.246 46.109 9.711 1.00 0.00 H ATOM 1028 HB2 GLN A 69 42.075 44.077 9.229 1.00 0.00 H ATOM 1029 HB3 GLN A 69 43.751 43.675 9.671 1.00 0.00 H ATOM 1030 HG2 GLN A 69 43.489 45.139 11.688 1.00 0.00 H ATOM 1031 HG3 GLN A 69 41.769 45.316 11.270 1.00 0.00 H ATOM 1032 HE22 GLN A 69 44.310 42.874 11.986 1.00 0.00 H ATOM 1033 HE21 GLN A 69 43.194 41.730 12.817 1.00 0.00 H ATOM 1034 H GLN A 69 41.411 46.476 9.187 1.00 0.00 H ATOM 1035 N THR A 70 45.254 44.898 7.683 1.00 8.38 N ATOM 1036 CA THR A 70 46.077 44.852 6.490 1.00 7.93 C ATOM 1037 C THR A 70 46.459 43.416 6.132 1.00 7.64 C ATOM 1038 O THR A 70 47.538 43.168 5.594 1.00 8.40 O ATOM 1039 CB THR A 70 47.356 45.705 6.689 1.00 8.03 C ATOM 1040 OG1 THR A 70 47.976 45.336 7.929 1.00 8.10 O ATOM 1041 CG2 THR A 70 47.010 47.191 6.732 1.00 7.87 C ATOM 1042 HA THR A 70 45.494 45.263 5.666 1.00 0.00 H ATOM 1043 HB THR A 70 48.033 45.524 5.854 1.00 0.00 H ATOM 1044 HG1 THR A 70 48.215 44.376 7.904 1.00 0.00 H ATOM 1045 HG23 THR A 70 46.538 47.480 5.793 1.00 0.00 H ATOM 1046 HG21 THR A 70 46.324 47.379 7.558 1.00 0.00 H ATOM 1047 HG22 THR A 70 47.922 47.771 6.876 1.00 0.00 H ATOM 1048 H THR A 70 45.617 44.477 8.562 1.00 0.00 H ATOM 1049 N ASN A 71 45.569 42.473 6.430 1.00 6.76 N ATOM 1050 CA ASN A 71 45.814 41.079 6.090 1.00 6.51 C ATOM 1051 C ASN A 71 44.685 40.517 5.230 1.00 5.91 C ATOM 1052 O ASN A 71 44.439 39.320 5.253 1.00 5.92 O ATOM 1053 CB ASN A 71 46.033 40.231 7.353 1.00 6.70 C ATOM 1054 CG ASN A 71 44.801 40.165 8.245 1.00 7.04 C ATOM 1055 OD1 ASN A 71 44.017 41.119 8.323 1.00 8.97 O ATOM 1056 ND2 ASN A 71 44.621 39.028 8.925 1.00 8.25 N ATOM 1057 HA ASN A 71 46.730 41.034 5.501 1.00 0.00 H ATOM 1058 HB2 ASN A 71 46.298 39.218 7.050 1.00 0.00 H ATOM 1059 HB3 ASN A 71 46.854 40.664 7.925 1.00 0.00 H ATOM 1060 HD22 ASN A 71 45.306 38.251 8.829 1.00 0.00 H ATOM 1061 HD21 ASN A 71 43.796 38.921 9.549 1.00 0.00 H ATOM 1062 H ASN A 71 44.686 42.736 6.913 1.00 0.00 H ATOM 1063 N CYS A 72 44.014 41.389 4.469 1.00 5.55 N ATOM 1064 CA CYS A 72 42.957 40.942 3.564 1.00 5.56 C ATOM 1065 C CYS A 72 43.437 40.715 2.137 1.00 5.39 C ATOM 1066 O CYS A 72 44.450 41.282 1.693 1.00 4.99 O ATOM 1067 CB CYS A 72 41.733 41.859 3.586 1.00 5.67 C ATOM 1068 SG CYS A 72 40.723 41.684 5.065 1.00 6.48 S ATOM 1069 HA CYS A 72 42.651 39.971 3.954 1.00 0.00 H ATOM 1070 HB2 CYS A 72 41.115 41.629 2.718 1.00 0.00 H ATOM 1071 HB3 CYS A 72 42.076 42.892 3.523 1.00 0.00 H ATOM 1072 H CYS A 72 44.248 42.401 4.522 1.00 0.00 H ATOM 1073 N TYR A 73 42.691 39.864 1.440 1.00 4.90 N ATOM 1074 CA TYR A 73 43.044 39.383 0.110 1.00 5.57 C ATOM 1075 C TYR A 73 41.773 39.228 -0.683 1.00 5.16 C ATOM 1076 O TYR A 73 40.773 38.742 -0.160 1.00 5.55 O ATOM 1077 CB TYR A 73 43.726 38.022 0.202 1.00 5.67 C ATOM 1078 CG TYR A 73 45.122 38.091 0.742 1.00 7.37 C ATOM 1079 CD1 TYR A 73 45.361 38.073 2.119 1.00 7.54 C ATOM 1080 CD2 TYR A 73 46.209 38.190 -0.124 1.00 9.30 C ATOM 1081 CE1 TYR A 73 46.649 38.147 2.617 1.00 9.40 C ATOM 1082 CE2 TYR A 73 47.499 38.266 0.365 1.00 9.09 C ATOM 1083 CZ TYR A 73 47.708 38.237 1.734 1.00 8.76 C ATOM 1084 OH TYR A 73 48.986 38.323 2.222 1.00 9.70 O ATOM 1085 HA TYR A 73 43.724 40.091 -0.365 1.00 0.00 H ATOM 1086 HB3 TYR A 73 43.763 37.585 -0.796 1.00 0.00 H ATOM 1087 HB2 TYR A 73 43.134 37.382 0.856 1.00 0.00 H ATOM 1088 HD2 TYR A 73 46.040 38.208 -1.201 1.00 0.00 H ATOM 1089 HE2 TYR A 73 48.343 38.348 -0.319 1.00 0.00 H ATOM 1090 HE1 TYR A 73 46.827 38.134 3.692 1.00 0.00 H ATOM 1091 HD1 TYR A 73 44.521 38.000 2.810 1.00 0.00 H ATOM 1092 HH TYR A 73 49.522 37.566 1.876 1.00 0.00 H ATOM 1093 H TYR A 73 41.806 39.522 1.867 1.00 0.00 H ATOM 1094 N GLN A 74 41.824 39.634 -1.947 1.00 5.97 N ATOM 1095 CA GLN A 74 40.684 39.510 -2.846 1.00 6.50 C ATOM 1096 C GLN A 74 40.950 38.392 -3.844 1.00 6.27 C ATOM 1097 O GLN A 74 42.053 38.296 -4.396 1.00 6.15 O ATOM 1098 CB GLN A 74 40.439 40.840 -3.586 1.00 6.89 C ATOM 1099 CG GLN A 74 39.276 40.801 -4.572 1.00 9.30 C ATOM 1100 CD GLN A 74 39.318 41.931 -5.575 1.00 13.68 C ATOM 1101 OE1 GLN A 74 39.407 43.099 -5.206 1.00 17.11 O ATOM 1102 NE2 GLN A 74 39.247 41.588 -6.855 1.00 15.53 N ATOM 1103 HA GLN A 74 39.792 39.272 -2.266 1.00 0.00 H ATOM 1104 HB2 GLN A 74 40.233 41.612 -2.844 1.00 0.00 H ATOM 1105 HB3 GLN A 74 41.345 41.098 -4.135 1.00 0.00 H ATOM 1106 HG2 GLN A 74 39.309 39.855 -5.112 1.00 0.00 H ATOM 1107 HG3 GLN A 74 38.343 40.866 -4.013 1.00 0.00 H ATOM 1108 HE22 GLN A 74 39.173 40.585 -7.121 1.00 0.00 H ATOM 1109 HE21 GLN A 74 39.266 42.322 -7.592 1.00 0.00 H ATOM 1110 H GLN A 74 42.705 40.054 -2.306 1.00 0.00 H ATOM 1111 N SER A 75 39.940 37.554 -4.079 1.00 6.48 N ATOM 1112 CA SER A 75 40.073 36.468 -5.047 1.00 7.15 C ATOM 1113 C SER A 75 40.279 37.027 -6.448 1.00 7.45 C ATOM 1114 O SER A 75 39.643 38.011 -6.828 1.00 7.08 O ATOM 1115 CB SER A 75 38.858 35.524 -5.005 1.00 6.58 C ATOM 1116 OG SER A 75 37.642 36.158 -5.392 1.00 6.97 O ATOM 1117 HA SER A 75 40.951 35.882 -4.776 1.00 0.00 H ATOM 1118 HB2 SER A 75 38.745 35.149 -3.988 1.00 0.00 H ATOM 1119 HB3 SER A 75 39.044 34.689 -5.680 1.00 0.00 H ATOM 1120 HG SER A 75 37.728 36.496 -6.319 1.00 0.00 H ATOM 1121 H SER A 75 39.044 37.675 -3.565 1.00 0.00 H ATOM 1122 N LYS A 76 41.193 36.405 -7.195 1.00 8.27 N ATOM 1123 CA LYS A 76 41.486 36.808 -8.572 1.00 9.53 C ATOM 1124 C LYS A 76 40.269 36.632 -9.472 1.00 9.23 C ATOM 1125 O LYS A 76 39.999 37.464 -10.346 1.00 9.86 O ATOM 1126 CB LYS A 76 42.712 36.060 -9.126 1.00 9.83 C ATOM 1127 CG LYS A 76 42.631 34.535 -9.077 1.00 11.05 C ATOM 1128 CD LYS A 76 43.896 33.859 -9.603 1.00 11.80 C ATOM 1129 CE LYS A 76 43.666 32.363 -9.775 1.00 14.57 C ATOM 1130 NZ LYS A 76 44.772 31.702 -10.518 1.00 16.72 N ATOM 1131 HA LYS A 76 41.731 37.870 -8.560 1.00 0.00 H ATOM 1132 HB2 LYS A 76 42.844 36.356 -10.167 1.00 0.00 H ATOM 1133 HB3 LYS A 76 43.583 36.369 -8.548 1.00 0.00 H ATOM 1134 HG2 LYS A 76 42.475 34.227 -8.043 1.00 0.00 H ATOM 1135 HG3 LYS A 76 41.785 34.211 -9.683 1.00 0.00 H ATOM 1136 HD2 LYS A 76 44.163 34.295 -10.566 1.00 0.00 H ATOM 1137 HD3 LYS A 76 44.710 34.019 -8.896 1.00 0.00 H ATOM 1138 HE2 LYS A 76 42.736 32.212 -10.323 1.00 0.00 H ATOM 1139 HE3 LYS A 76 43.583 31.905 -8.789 1.00 0.00 H ATOM 1140 HZ1 LYS A 76 44.854 32.126 -11.464 1.00 0.00 H ATOM 1141 HZ2 LYS A 76 45.664 31.833 -9.999 1.00 0.00 H ATOM 1142 HZ3 LYS A 76 44.569 30.686 -10.609 1.00 0.00 H ATOM 1143 H LYS A 76 41.716 35.605 -6.785 1.00 0.00 H ATOM 1144 N SER A 77 39.530 35.553 -9.234 1.00 8.76 N ATOM 1145 CA SER A 77 38.339 35.238 -10.008 1.00 8.26 C ATOM 1146 C SER A 77 37.093 35.333 -9.144 1.00 7.97 C ATOM 1147 O SER A 77 37.176 35.349 -7.918 1.00 8.08 O ATOM 1148 CB SER A 77 38.450 33.835 -10.604 1.00 8.52 C ATOM 1149 OG SER A 77 39.657 33.684 -11.338 1.00 9.64 O ATOM 1150 HA SER A 77 38.258 35.965 -10.816 1.00 0.00 H ATOM 1151 HB2 SER A 77 37.604 33.663 -11.270 1.00 0.00 H ATOM 1152 HB3 SER A 77 38.430 33.103 -9.797 1.00 0.00 H ATOM 1153 HG SER A 77 39.702 32.768 -11.712 1.00 0.00 H ATOM 1154 H SER A 77 39.813 34.911 -8.467 1.00 0.00 H ATOM 1155 N THR A 78 35.937 35.397 -9.797 1.00 7.91 N ATOM 1156 CA THR A 78 34.665 35.346 -9.094 1.00 7.55 C ATOM 1157 C THR A 78 34.458 33.941 -8.530 1.00 7.48 C ATOM 1158 O THR A 78 35.021 32.961 -9.043 1.00 6.93 O ATOM 1159 CB THR A 78 33.477 35.713 -10.007 1.00 7.54 C ATOM 1160 OG1 THR A 78 33.459 34.844 -11.145 1.00 7.83 O ATOM 1161 CG2 THR A 78 33.588 37.158 -10.473 1.00 8.06 C ATOM 1162 HA THR A 78 34.700 36.082 -8.290 1.00 0.00 H ATOM 1163 HB THR A 78 32.553 35.597 -9.441 1.00 0.00 H ATOM 1164 HG1 THR A 78 32.696 35.082 -11.729 1.00 0.00 H ATOM 1165 HG23 THR A 78 33.602 37.818 -9.606 1.00 0.00 H ATOM 1166 HG21 THR A 78 34.509 37.285 -11.042 1.00 0.00 H ATOM 1167 HG22 THR A 78 32.733 37.402 -11.103 1.00 0.00 H ATOM 1168 H THR A 78 35.942 35.485 -10.833 1.00 0.00 H ATOM 1169 N MET A 79 33.660 33.866 -7.469 1.00 7.18 N ATOM 1170 CA MET A 79 33.284 32.607 -6.849 1.00 7.17 C ATOM 1171 C MET A 79 31.777 32.502 -6.668 1.00 6.92 C ATOM 1172 O MET A 79 31.084 33.510 -6.515 1.00 6.42 O ATOM 1173 CB MET A 79 33.967 32.466 -5.493 1.00 7.40 C ATOM 1174 CG MET A 79 35.463 32.415 -5.573 1.00 7.45 C ATOM 1175 SD MET A 79 36.146 31.901 -4.004 1.00 7.93 S ATOM 1176 CE MET A 79 37.865 31.698 -4.481 1.00 6.18 C ATOM 1177 HA MET A 79 33.607 31.804 -7.511 1.00 0.00 H ATOM 1178 HB2 MET A 79 33.684 33.318 -4.875 1.00 0.00 H ATOM 1179 HB3 MET A 79 33.616 31.547 -5.025 1.00 0.00 H ATOM 1180 HG2 MET A 79 35.845 33.404 -5.826 1.00 0.00 H ATOM 1181 HG3 MET A 79 35.759 31.705 -6.345 1.00 0.00 H ATOM 1182 HE1 MET A 79 37.936 30.947 -5.267 1.00 0.00 H ATOM 1183 HE2 MET A 79 38.253 32.648 -4.848 1.00 0.00 H ATOM 1184 HE3 MET A 79 38.445 31.377 -3.616 1.00 0.00 H ATOM 1185 H MET A 79 33.288 34.749 -7.064 1.00 0.00 H ATOM 1186 N ARG A 80 31.278 31.273 -6.669 1.00 6.20 N ATOM 1187 CA ARG A 80 29.876 31.017 -6.380 1.00 6.00 C ATOM 1188 C ARG A 80 29.663 31.136 -4.882 1.00 5.88 C ATOM 1189 O ARG A 80 30.250 30.396 -4.094 1.00 6.20 O ATOM 1190 CB ARG A 80 29.483 29.634 -6.871 1.00 6.21 C ATOM 1191 CG ARG A 80 29.535 29.506 -8.377 1.00 6.88 C ATOM 1192 CD ARG A 80 29.515 28.044 -8.780 1.00 10.12 C ATOM 1193 NE ARG A 80 30.809 27.418 -8.517 1.00 11.39 N ATOM 1194 CZ ARG A 80 31.051 26.113 -8.603 1.00 13.73 C ATOM 1195 NH1 ARG A 80 30.083 25.263 -8.936 1.00 14.18 N ATOM 1196 NH2 ARG A 80 32.268 25.657 -8.346 1.00 14.18 N ATOM 1197 HA ARG A 80 29.249 31.744 -6.896 1.00 0.00 H ATOM 1198 HB2 ARG A 80 30.165 28.904 -6.436 1.00 0.00 H ATOM 1199 HB3 ARG A 80 28.467 29.423 -6.539 1.00 0.00 H ATOM 1200 HG2 ARG A 80 28.672 30.011 -8.811 1.00 0.00 H ATOM 1201 HG3 ARG A 80 30.450 29.969 -8.747 1.00 0.00 H ATOM 1202 HD2 ARG A 80 29.290 27.969 -9.844 1.00 0.00 H ATOM 1203 HD3 ARG A 80 28.744 27.526 -8.210 1.00 0.00 H ATOM 1204 HE ARG A 80 31.598 28.038 -8.243 1.00 0.00 H ATOM 1205 HH12 ARG A 80 30.284 24.245 -9.000 1.00 0.00 H ATOM 1206 HH11 ARG A 80 29.125 25.617 -9.132 1.00 0.00 H ATOM 1207 HH22 ARG A 80 32.466 24.638 -8.411 1.00 0.00 H ATOM 1208 HH21 ARG A 80 33.025 26.318 -8.079 1.00 0.00 H ATOM 1209 H ARG A 80 31.906 30.472 -6.882 1.00 0.00 H ATOM 1210 N ILE A 81 28.843 32.099 -4.490 1.00 5.60 N ATOM 1211 CA ILE A 81 28.616 32.359 -3.068 1.00 5.36 C ATOM 1212 C ILE A 81 27.121 32.526 -2.828 1.00 4.90 C ATOM 1213 O ILE A 81 26.353 32.740 -3.770 1.00 4.76 O ATOM 1214 CB ILE A 81 29.387 33.633 -2.573 1.00 5.51 C ATOM 1215 CG1 ILE A 81 28.868 34.894 -3.271 1.00 5.71 C ATOM 1216 CG2 ILE A 81 30.906 33.489 -2.809 1.00 6.30 C ATOM 1217 CD1 ILE A 81 29.393 36.176 -2.684 1.00 5.20 C ATOM 1218 HA ILE A 81 28.998 31.511 -2.499 1.00 0.00 H ATOM 1219 HB ILE A 81 29.209 33.728 -1.502 1.00 0.00 H ATOM 1220 HG12 ILE A 81 29.161 34.851 -4.320 1.00 0.00 H ATOM 1221 HG13 ILE A 81 27.780 34.903 -3.199 1.00 0.00 H ATOM 1222 HD11 ILE A 81 29.098 36.242 -1.637 1.00 0.00 H ATOM 1223 HD12 ILE A 81 30.480 36.190 -2.759 1.00 0.00 H ATOM 1224 HD13 ILE A 81 28.979 37.022 -3.233 1.00 0.00 H ATOM 1225 HG21 ILE A 81 31.277 32.622 -2.263 1.00 0.00 H ATOM 1226 HG22 ILE A 81 31.096 33.357 -3.874 1.00 0.00 H ATOM 1227 HG23 ILE A 81 31.414 34.387 -2.456 1.00 0.00 H ATOM 1228 H ILE A 81 28.354 32.678 -5.202 1.00 0.00 H ATOM 1229 N THR A 82 26.717 32.417 -1.567 1.00 5.42 N ATOM 1230 CA THR A 82 25.346 32.694 -1.162 1.00 5.80 C ATOM 1231 C THR A 82 25.404 33.721 -0.052 1.00 5.95 C ATOM 1232 O THR A 82 26.109 33.534 0.946 1.00 6.15 O ATOM 1233 CB THR A 82 24.616 31.421 -0.668 1.00 5.82 C ATOM 1234 OG1 THR A 82 24.489 30.503 -1.757 1.00 6.18 O ATOM 1235 CG2 THR A 82 23.221 31.766 -0.125 1.00 7.21 C ATOM 1236 HA THR A 82 24.783 33.063 -2.019 1.00 0.00 H ATOM 1237 HB THR A 82 25.198 30.973 0.137 1.00 0.00 H ATOM 1238 HG1 THR A 82 25.389 30.263 -2.091 1.00 0.00 H ATOM 1239 HG23 THR A 82 23.318 32.466 0.705 1.00 0.00 H ATOM 1240 HG21 THR A 82 22.626 32.221 -0.917 1.00 0.00 H ATOM 1241 HG22 THR A 82 22.732 30.856 0.221 1.00 0.00 H ATOM 1242 H THR A 82 27.404 32.123 -0.844 1.00 0.00 H ATOM 1243 N ASP A 83 24.688 34.817 -0.263 1.00 6.39 N ATOM 1244 CA ASP A 83 24.543 35.869 0.724 1.00 6.30 C ATOM 1245 C ASP A 83 23.322 35.555 1.580 1.00 5.98 C ATOM 1246 O ASP A 83 22.238 35.288 1.052 1.00 5.60 O ATOM 1247 CB ASP A 83 24.337 37.205 0.010 1.00 6.75 C ATOM 1248 CG ASP A 83 24.201 38.361 0.960 1.00 9.39 C ATOM 1249 OD1 ASP A 83 23.087 38.918 1.030 1.00 11.12 O ATOM 1250 OD2 ASP A 83 25.199 38.723 1.622 1.00 13.00 O ATOM 1251 HA ASP A 83 25.434 35.931 1.349 1.00 0.00 H ATOM 1252 HB2 ASP A 83 25.193 37.388 -0.640 1.00 0.00 H ATOM 1253 HB3 ASP A 83 23.431 37.141 -0.593 1.00 0.00 H ATOM 1254 H ASP A 83 24.208 34.927 -1.179 1.00 0.00 H ATOM 1255 N CYS A 84 23.512 35.594 2.897 1.00 5.64 N ATOM 1256 CA CYS A 84 22.412 35.475 3.841 1.00 6.10 C ATOM 1257 C CYS A 84 22.297 36.789 4.594 1.00 6.47 C ATOM 1258 O CYS A 84 23.251 37.202 5.248 1.00 6.36 O ATOM 1259 CB CYS A 84 22.673 34.327 4.826 1.00 5.68 C ATOM 1260 SG CYS A 84 22.842 32.710 4.036 1.00 6.58 S ATOM 1261 HA CYS A 84 21.486 35.258 3.309 1.00 0.00 H ATOM 1262 HB2 CYS A 84 21.841 34.281 5.529 1.00 0.00 H ATOM 1263 HB3 CYS A 84 23.593 34.542 5.369 1.00 0.00 H ATOM 1264 H CYS A 84 24.478 35.713 3.263 1.00 0.00 H ATOM 1265 N ARG A 85 21.137 37.439 4.498 1.00 7.18 N ATOM 1266 CA ARG A 85 20.906 38.724 5.181 1.00 8.38 C ATOM 1267 C ARG A 85 19.583 38.707 5.868 1.00 8.51 C ATOM 1268 O ARG A 85 18.587 38.290 5.272 1.00 8.08 O ATOM 1269 CB ARG A 85 20.825 39.902 4.212 1.00 8.74 C ATOM 1270 CG ARG A 85 21.784 39.880 3.139 1.00 11.36 C ATOM 1271 CD ARG A 85 22.219 41.268 2.804 1.00 12.58 C ATOM 1272 NE ARG A 85 23.529 41.133 2.214 1.00 13.05 N ATOM 1273 CZ ARG A 85 24.506 42.019 2.303 1.00 11.85 C ATOM 1274 NH1 ARG A 85 24.323 43.164 2.951 1.00 11.47 N ATOM 1275 NH2 ARG A 85 25.663 41.739 1.725 1.00 12.62 N ATOM 1276 HA ARG A 85 21.747 38.844 5.864 1.00 0.00 H ATOM 1277 HB2 ARG A 85 19.827 39.910 3.773 1.00 0.00 H ATOM 1278 HB3 ARG A 85 20.977 40.819 4.782 1.00 0.00 H ATOM 1279 HG2 ARG A 85 22.652 39.295 3.444 1.00 0.00 H ATOM 1280 HG3 ARG A 85 21.330 39.423 2.260 1.00 0.00 H ATOM 1281 HD2 ARG A 85 22.268 41.879 3.705 1.00 0.00 H ATOM 1282 HD3 ARG A 85 21.527 41.723 2.095 1.00 0.00 H ATOM 1283 HE ARG A 85 23.721 40.266 1.673 1.00 0.00 H ATOM 1284 HH12 ARG A 85 25.098 43.855 3.015 1.00 0.00 H ATOM 1285 HH11 ARG A 85 23.405 43.370 3.394 1.00 0.00 H ATOM 1286 HH22 ARG A 85 26.449 42.418 1.779 1.00 0.00 H ATOM 1287 HH21 ARG A 85 25.786 40.840 1.217 1.00 0.00 H ATOM 1288 H ARG A 85 20.373 37.027 3.925 1.00 0.00 H ATOM 1289 N GLU A 86 19.553 39.222 7.095 1.00 9.32 N ATOM 1290 CA GLU A 86 18.309 39.359 7.819 1.00 11.08 C ATOM 1291 C GLU A 86 17.298 40.152 7.011 1.00 12.52 C ATOM 1292 O GLU A 86 17.635 41.169 6.388 1.00 12.04 O ATOM 1293 CB GLU A 86 18.538 40.066 9.145 1.00 10.84 C ATOM 1294 CG GLU A 86 18.891 39.156 10.272 1.00 11.16 C ATOM 1295 CD GLU A 86 18.825 39.876 11.597 1.00 10.60 C ATOM 1296 OE1 GLU A 86 19.667 40.767 11.820 1.00 12.67 O ATOM 1297 OE2 GLU A 86 17.931 39.555 12.402 1.00 12.67 O ATOM 1298 HA GLU A 86 17.922 38.356 8.000 1.00 0.00 H ATOM 1299 HB2 GLU A 86 19.351 40.781 9.015 1.00 0.00 H ATOM 1300 HB3 GLU A 86 17.625 40.600 9.410 1.00 0.00 H ATOM 1301 HG2 GLU A 86 18.192 38.320 10.286 1.00 0.00 H ATOM 1302 HG3 GLU A 86 19.903 38.780 10.122 1.00 0.00 H ATOM 1303 H GLU A 86 20.440 39.531 7.541 1.00 0.00 H ATOM 1304 N THR A 87 16.062 39.667 7.019 1.00 14.87 N ATOM 1305 CA THR A 87 14.952 40.403 6.426 1.00 16.71 C ATOM 1306 C THR A 87 14.500 41.480 7.408 1.00 17.88 C ATOM 1307 O THR A 87 14.858 41.447 8.593 1.00 18.52 O ATOM 1308 CB THR A 87 13.760 39.489 6.101 1.00 17.12 C ATOM 1309 OG1 THR A 87 13.204 38.982 7.319 1.00 17.81 O ATOM 1310 CG2 THR A 87 14.177 38.331 5.191 1.00 16.79 C ATOM 1311 HA THR A 87 15.298 40.842 5.490 1.00 0.00 H ATOM 1312 HB THR A 87 13.010 40.075 5.570 1.00 0.00 H ATOM 1313 HG1 THR A 87 12.436 38.393 7.110 1.00 0.00 H ATOM 1314 HG23 THR A 87 14.598 38.729 4.268 1.00 0.00 H ATOM 1315 HG21 THR A 87 14.924 37.722 5.700 1.00 0.00 H ATOM 1316 HG22 THR A 87 13.304 37.720 4.960 1.00 0.00 H ATOM 1317 H THR A 87 15.882 38.742 7.458 1.00 0.00 H ATOM 1318 N GLY A 88 13.695 42.422 6.918 1.00 18.57 N ATOM 1319 CA GLY A 88 13.146 43.488 7.755 1.00 19.46 C ATOM 1320 C GLY A 88 12.181 42.989 8.820 1.00 20.20 C ATOM 1321 O GLY A 88 11.792 43.745 9.711 1.00 20.53 O ATOM 1322 HA3 GLY A 88 12.617 44.193 7.113 1.00 0.00 H ATOM 1323 HA2 GLY A 88 13.972 43.998 8.250 1.00 0.00 H ATOM 1324 H GLY A 88 13.449 42.398 5.908 1.00 0.00 H ATOM 1325 N SER A 89 11.798 41.718 8.716 1.00 20.76 N ATOM 1326 CA SER A 89 10.865 41.080 9.646 1.00 21.39 C ATOM 1327 C SER A 89 11.583 40.289 10.737 1.00 21.54 C ATOM 1328 O SER A 89 11.009 40.018 11.800 1.00 21.86 O ATOM 1329 CB SER A 89 9.925 40.145 8.882 1.00 21.46 C ATOM 1330 OG SER A 89 9.230 40.843 7.865 1.00 21.95 O ATOM 1331 HA SER A 89 10.298 41.876 10.129 1.00 0.00 H ATOM 1332 HB2 SER A 89 9.203 39.718 9.578 1.00 0.00 H ATOM 1333 HB3 SER A 89 10.509 39.344 8.429 1.00 0.00 H ATOM 1334 HG SER A 89 8.630 40.217 7.387 1.00 0.00 H ATOM 1335 H SER A 89 12.181 41.150 7.934 1.00 0.00 H ATOM 1336 N SER A 90 12.833 39.920 10.462 1.00 21.64 N ATOM 1337 CA SER A 90 13.653 39.119 11.369 1.00 21.55 C ATOM 1338 C SER A 90 13.771 39.711 12.771 1.00 21.83 C ATOM 1339 O SER A 90 14.147 40.873 12.945 1.00 21.88 O ATOM 1340 CB SER A 90 15.049 38.899 10.773 1.00 21.55 C ATOM 1341 OG SER A 90 15.837 38.064 11.607 1.00 21.37 O ATOM 1342 HA SER A 90 13.139 38.164 11.478 1.00 0.00 H ATOM 1343 HB2 SER A 90 15.545 39.863 10.664 1.00 0.00 H ATOM 1344 HB3 SER A 90 14.948 38.431 9.794 1.00 0.00 H ATOM 1345 HG SER A 90 15.936 38.487 12.497 1.00 0.00 H ATOM 1346 H SER A 90 13.247 40.217 9.555 1.00 0.00 H ATOM 1347 N LYS A 91 13.438 38.898 13.769 1.00 21.90 N ATOM 1348 CA LYS A 91 13.596 39.293 15.160 1.00 22.04 C ATOM 1349 C LYS A 91 13.889 38.073 16.016 1.00 21.71 C ATOM 1350 O LYS A 91 13.048 37.178 16.138 1.00 21.61 O ATOM 1351 CB LYS A 91 12.349 40.011 15.671 1.00 22.22 C ATOM 1352 CG LYS A 91 12.570 40.767 16.975 1.00 22.55 C ATOM 1353 CD LYS A 91 11.275 41.337 17.514 1.00 23.47 C ATOM 1354 CE LYS A 91 10.495 40.313 18.331 1.00 23.96 C ATOM 1355 NZ LYS A 91 9.271 40.911 18.921 1.00 23.66 N ATOM 1356 HA LYS A 91 14.435 39.986 15.227 1.00 0.00 H ATOM 1357 HB2 LYS A 91 12.025 40.722 14.911 1.00 0.00 H ATOM 1358 HB3 LYS A 91 11.566 39.270 15.831 1.00 0.00 H ATOM 1359 HG2 LYS A 91 12.991 40.084 17.713 1.00 0.00 H ATOM 1360 HG3 LYS A 91 13.269 41.584 16.797 1.00 0.00 H ATOM 1361 HD2 LYS A 91 11.504 42.193 18.149 1.00 0.00 H ATOM 1362 HD3 LYS A 91 10.658 41.663 16.676 1.00 0.00 H ATOM 1363 HE2 LYS A 91 11.131 39.941 19.134 1.00 0.00 H ATOM 1364 HE3 LYS A 91 10.209 39.485 17.683 1.00 0.00 H ATOM 1365 HZ1 LYS A 91 9.538 41.699 19.545 1.00 0.00 H ATOM 1366 HZ2 LYS A 91 8.657 41.264 18.159 1.00 0.00 H ATOM 1367 HZ3 LYS A 91 8.764 40.188 19.470 1.00 0.00 H ATOM 1368 H LYS A 91 13.055 37.956 13.550 1.00 0.00 H ATOM 1369 N TYR A 92 15.085 38.044 16.599 1.00 21.43 N ATOM 1370 CA TYR A 92 15.480 36.983 17.526 1.00 21.40 C ATOM 1371 C TYR A 92 14.357 36.729 18.544 1.00 20.93 C ATOM 1372 O TYR A 92 13.727 37.681 19.005 1.00 21.16 O ATOM 1373 CB TYR A 92 16.788 37.353 18.242 1.00 21.66 C ATOM 1374 CG TYR A 92 17.295 36.258 19.149 1.00 22.14 C ATOM 1375 CD1 TYR A 92 18.087 35.225 18.647 1.00 22.85 C ATOM 1376 CD2 TYR A 92 16.960 36.236 20.507 1.00 22.47 C ATOM 1377 CE1 TYR A 92 18.535 34.201 19.473 1.00 23.18 C ATOM 1378 CE2 TYR A 92 17.403 35.216 21.339 1.00 22.92 C ATOM 1379 CZ TYR A 92 18.195 34.204 20.814 1.00 22.87 C ATOM 1380 OH TYR A 92 18.633 33.195 21.638 1.00 23.77 O ATOM 1381 HA TYR A 92 15.651 36.067 16.960 1.00 0.00 H ATOM 1382 HB3 TYR A 92 16.616 38.248 18.840 1.00 0.00 H ATOM 1383 HB2 TYR A 92 17.549 37.561 17.490 1.00 0.00 H ATOM 1384 HD2 TYR A 92 16.341 37.033 20.919 1.00 0.00 H ATOM 1385 HE2 TYR A 92 17.131 35.210 22.395 1.00 0.00 H ATOM 1386 HE1 TYR A 92 19.151 33.399 19.066 1.00 0.00 H ATOM 1387 HD1 TYR A 92 18.358 35.221 17.591 1.00 0.00 H ATOM 1388 HH TYR A 92 19.182 32.558 21.115 1.00 0.00 H ATOM 1389 H TYR A 92 15.764 38.803 16.388 1.00 0.00 H ATOM 1390 N PRO A 93 14.094 35.450 18.896 1.00 20.59 N ATOM 1391 CA PRO A 93 14.762 34.227 18.445 1.00 20.28 C ATOM 1392 C PRO A 93 14.240 33.664 17.127 1.00 19.73 C ATOM 1393 O PRO A 93 14.634 32.565 16.737 1.00 20.43 O ATOM 1394 CB PRO A 93 14.488 33.250 19.585 1.00 20.24 C ATOM 1395 CG PRO A 93 13.146 33.658 20.090 1.00 20.42 C ATOM 1396 CD PRO A 93 13.025 35.150 19.869 1.00 20.48 C ATOM 1397 HA PRO A 93 15.816 34.415 18.239 1.00 0.00 H ATOM 1398 HD3 PRO A 93 12.046 35.404 19.462 1.00 0.00 H ATOM 1399 HD2 PRO A 93 13.183 35.695 20.800 1.00 0.00 H ATOM 1400 HG3 PRO A 93 13.060 33.428 21.152 1.00 0.00 H ATOM 1401 HG2 PRO A 93 12.364 33.133 19.541 1.00 0.00 H ATOM 1402 HB2 PRO A 93 14.470 32.223 19.220 1.00 0.00 H ATOM 1403 HB3 PRO A 93 15.242 33.344 20.367 1.00 0.00 H ATOM 1404 N ASN A 94 13.381 34.417 16.444 1.00 18.89 N ATOM 1405 CA ASN A 94 12.897 34.031 15.126 1.00 17.59 C ATOM 1406 C ASN A 94 13.669 34.776 14.040 1.00 16.73 C ATOM 1407 O ASN A 94 13.166 35.728 13.424 1.00 17.34 O ATOM 1408 CB ASN A 94 11.389 34.262 15.014 1.00 18.19 C ATOM 1409 CG ASN A 94 10.616 33.584 16.134 1.00 18.64 C ATOM 1410 OD1 ASN A 94 10.148 34.238 17.069 1.00 20.20 O ATOM 1411 ND2 ASN A 94 10.491 32.265 16.051 1.00 19.81 N ATOM 1412 HA ASN A 94 13.071 32.964 14.984 1.00 0.00 H ATOM 1413 HB2 ASN A 94 11.195 35.334 15.053 1.00 0.00 H ATOM 1414 HB3 ASN A 94 11.043 33.865 14.059 1.00 0.00 H ATOM 1415 HD22 ASN A 94 10.902 31.753 15.244 1.00 0.00 H ATOM 1416 HD21 ASN A 94 9.982 31.743 16.793 1.00 0.00 H ATOM 1417 H ASN A 94 13.046 35.307 16.864 1.00 0.00 H ATOM 1418 N CYS A 95 14.911 34.349 13.836 1.00 14.45 N ATOM 1419 CA CYS A 95 15.758 34.921 12.802 1.00 12.53 C ATOM 1420 C CYS A 95 15.204 34.517 11.452 1.00 11.78 C ATOM 1421 O CYS A 95 14.702 33.400 11.285 1.00 12.42 O ATOM 1422 CB CYS A 95 17.197 34.434 12.956 1.00 11.69 C ATOM 1423 SG CYS A 95 17.905 34.787 14.576 1.00 9.09 S ATOM 1424 HA CYS A 95 15.765 36.007 12.890 1.00 0.00 H ATOM 1425 HB2 CYS A 95 17.810 34.921 12.198 1.00 0.00 H ATOM 1426 HB3 CYS A 95 17.216 33.356 12.798 1.00 0.00 H ATOM 1427 H CYS A 95 15.287 33.585 14.432 1.00 0.00 H ATOM 1428 N ALA A 96 15.269 35.442 10.503 1.00 10.52 N ATOM 1429 CA ALA A 96 14.787 35.210 9.151 1.00 9.60 C ATOM 1430 C ALA A 96 15.755 35.840 8.169 1.00 8.96 C ATOM 1431 O ALA A 96 16.155 37.001 8.333 1.00 8.94 O ATOM 1432 CB ALA A 96 13.397 35.791 8.972 1.00 9.18 C ATOM 1433 HA ALA A 96 14.727 34.137 8.967 1.00 0.00 H ATOM 1434 HB1 ALA A 96 12.713 35.318 9.677 1.00 0.00 H ATOM 1435 HB2 ALA A 96 13.427 36.865 9.157 1.00 0.00 H ATOM 1436 HB3 ALA A 96 13.056 35.606 7.953 1.00 0.00 H ATOM 1437 H ALA A 96 15.680 36.369 10.735 1.00 0.00 H ATOM 1438 N TYR A 97 16.122 35.066 7.151 1.00 7.87 N ATOM 1439 CA TYR A 97 17.110 35.479 6.167 1.00 7.44 C ATOM 1440 C TYR A 97 16.587 35.405 4.747 1.00 7.27 C ATOM 1441 O TYR A 97 15.819 34.498 4.389 1.00 7.41 O ATOM 1442 CB TYR A 97 18.365 34.605 6.278 1.00 6.96 C ATOM 1443 CG TYR A 97 19.093 34.797 7.584 1.00 6.81 C ATOM 1444 CD1 TYR A 97 20.061 35.790 7.715 1.00 6.65 C ATOM 1445 CD2 TYR A 97 18.781 34.022 8.702 1.00 5.53 C ATOM 1446 CE1 TYR A 97 20.704 36.000 8.924 1.00 5.69 C ATOM 1447 CE2 TYR A 97 19.427 34.219 9.919 1.00 5.15 C ATOM 1448 CZ TYR A 97 20.391 35.210 10.019 1.00 5.39 C ATOM 1449 OH TYR A 97 21.037 35.416 11.216 1.00 6.01 O ATOM 1450 HA TYR A 97 17.348 36.520 6.384 1.00 0.00 H ATOM 1451 HB3 TYR A 97 19.041 34.859 5.461 1.00 0.00 H ATOM 1452 HB2 TYR A 97 18.071 33.559 6.193 1.00 0.00 H ATOM 1453 HD2 TYR A 97 18.018 33.248 8.621 1.00 0.00 H ATOM 1454 HE2 TYR A 97 19.178 33.602 10.782 1.00 0.00 H ATOM 1455 HE1 TYR A 97 21.455 36.785 9.014 1.00 0.00 H ATOM 1456 HD1 TYR A 97 20.316 36.410 6.855 1.00 0.00 H ATOM 1457 HH TYR A 97 21.689 36.154 11.115 1.00 0.00 H ATOM 1458 H TYR A 97 15.685 34.127 7.055 1.00 0.00 H ATOM 1459 N LYS A 98 17.011 36.380 3.954 1.00 7.08 N ATOM 1460 CA LYS A 98 16.888 36.322 2.511 1.00 7.24 C ATOM 1461 C LYS A 98 18.134 35.642 1.970 1.00 6.59 C ATOM 1462 O LYS A 98 19.260 36.011 2.335 1.00 6.95 O ATOM 1463 CB LYS A 98 16.754 37.737 1.927 1.00 7.38 C ATOM 1464 CG LYS A 98 16.996 37.834 0.423 1.00 10.24 C ATOM 1465 CD LYS A 98 15.863 37.233 -0.386 1.00 13.35 C ATOM 1466 CE LYS A 98 16.223 37.189 -1.861 1.00 14.67 C ATOM 1467 NZ LYS A 98 15.124 36.583 -2.661 1.00 16.36 N ATOM 1468 HA LYS A 98 15.996 35.762 2.228 1.00 0.00 H ATOM 1469 HB2 LYS A 98 15.745 38.095 2.132 1.00 0.00 H ATOM 1470 HB3 LYS A 98 17.476 38.381 2.429 1.00 0.00 H ATOM 1471 HG2 LYS A 98 17.101 38.885 0.152 1.00 0.00 H ATOM 1472 HG3 LYS A 98 17.918 37.304 0.182 1.00 0.00 H ATOM 1473 HD2 LYS A 98 15.669 36.220 -0.034 1.00 0.00 H ATOM 1474 HD3 LYS A 98 14.967 37.840 -0.254 1.00 0.00 H ATOM 1475 HE2 LYS A 98 17.128 36.595 -1.990 1.00 0.00 H ATOM 1476 HE3 LYS A 98 16.404 38.204 -2.214 1.00 0.00 H ATOM 1477 HZ1 LYS A 98 14.951 35.612 -2.330 1.00 0.00 H ATOM 1478 HZ2 LYS A 98 14.259 37.149 -2.545 1.00 0.00 H ATOM 1479 HZ3 LYS A 98 15.396 36.565 -3.665 1.00 0.00 H ATOM 1480 H LYS A 98 17.449 37.219 4.385 1.00 0.00 H ATOM 1481 N THR A 99 17.908 34.652 1.107 1.00 5.85 N ATOM 1482 CA THR A 99 18.966 33.884 0.454 1.00 5.47 C ATOM 1483 C THR A 99 19.168 34.427 -0.950 1.00 5.57 C ATOM 1484 O THR A 99 18.223 34.482 -1.733 1.00 5.36 O ATOM 1485 CB THR A 99 18.557 32.399 0.346 1.00 4.96 C ATOM 1486 OG1 THR A 99 18.430 31.842 1.659 1.00 5.55 O ATOM 1487 CG2 THR A 99 19.560 31.596 -0.476 1.00 4.94 C ATOM 1488 HA THR A 99 19.881 33.968 1.040 1.00 0.00 H ATOM 1489 HB THR A 99 17.598 32.346 -0.169 1.00 0.00 H ATOM 1490 HG1 THR A 99 19.297 31.912 2.131 1.00 0.00 H ATOM 1491 HG23 THR A 99 19.645 32.033 -1.471 1.00 0.00 H ATOM 1492 HG21 THR A 99 20.532 31.619 0.016 1.00 0.00 H ATOM 1493 HG22 THR A 99 19.217 30.565 -0.558 1.00 0.00 H ATOM 1494 H THR A 99 16.921 34.412 0.885 1.00 0.00 H ATOM 1495 N THR A 100 20.395 34.839 -1.256 1.00 5.93 N ATOM 1496 CA THR A 100 20.720 35.346 -2.583 1.00 6.29 C ATOM 1497 C THR A 100 21.968 34.672 -3.126 1.00 6.16 C ATOM 1498 O THR A 100 23.049 34.803 -2.561 1.00 6.08 O ATOM 1499 CB THR A 100 20.930 36.872 -2.567 1.00 6.60 C ATOM 1500 OG1 THR A 100 19.824 37.498 -1.903 1.00 7.18 O ATOM 1501 CG2 THR A 100 21.045 37.417 -4.003 1.00 7.05 C ATOM 1502 HA THR A 100 19.874 35.117 -3.231 1.00 0.00 H ATOM 1503 HB THR A 100 21.855 37.094 -2.035 1.00 0.00 H ATOM 1504 HG1 THR A 100 19.765 37.162 -0.974 1.00 0.00 H ATOM 1505 HG23 THR A 100 21.886 36.939 -4.505 1.00 0.00 H ATOM 1506 HG21 THR A 100 20.125 37.201 -4.547 1.00 0.00 H ATOM 1507 HG22 THR A 100 21.204 38.495 -3.970 1.00 0.00 H ATOM 1508 H THR A 100 21.140 34.798 -0.531 1.00 0.00 H ATOM 1509 N GLN A 101 21.812 33.967 -4.237 1.00 6.10 N ATOM 1510 CA GLN A 101 22.926 33.285 -4.868 1.00 6.46 C ATOM 1511 C GLN A 101 23.520 34.208 -5.915 1.00 6.18 C ATOM 1512 O GLN A 101 22.809 34.680 -6.804 1.00 6.43 O ATOM 1513 CB GLN A 101 22.453 31.986 -5.517 1.00 6.80 C ATOM 1514 CG GLN A 101 21.820 31.014 -4.537 1.00 9.18 C ATOM 1515 CD GLN A 101 21.430 29.710 -5.191 1.00 10.84 C ATOM 1516 OE1 GLN A 101 22.274 28.998 -5.733 1.00 12.96 O ATOM 1517 NE2 GLN A 101 20.148 29.385 -5.139 1.00 11.77 N ATOM 1518 HA GLN A 101 23.679 33.035 -4.121 1.00 0.00 H ATOM 1519 HB2 GLN A 101 21.718 32.231 -6.284 1.00 0.00 H ATOM 1520 HB3 GLN A 101 23.311 31.499 -5.980 1.00 0.00 H ATOM 1521 HG2 GLN A 101 22.533 30.806 -3.739 1.00 0.00 H ATOM 1522 HG3 GLN A 101 20.927 31.475 -4.114 1.00 0.00 H ATOM 1523 HE22 GLN A 101 19.470 30.018 -4.670 1.00 0.00 H ATOM 1524 HE21 GLN A 101 19.819 28.496 -5.567 1.00 0.00 H ATOM 1525 H GLN A 101 20.867 33.901 -4.667 1.00 0.00 H ATOM 1526 N VAL A 102 24.818 34.473 -5.792 1.00 5.94 N ATOM 1527 CA VAL A 102 25.528 35.346 -6.731 1.00 6.49 C ATOM 1528 C VAL A 102 26.918 34.809 -7.035 1.00 6.74 C ATOM 1529 O VAL A 102 27.398 33.888 -6.372 1.00 7.12 O ATOM 1530 CB VAL A 102 25.648 36.809 -6.212 1.00 6.25 C ATOM 1531 CG1 VAL A 102 24.283 37.524 -6.250 1.00 6.70 C ATOM 1532 CG2 VAL A 102 26.283 36.847 -4.812 1.00 7.29 C ATOM 1533 HA VAL A 102 24.931 35.357 -7.643 1.00 0.00 H ATOM 1534 HB VAL A 102 26.313 37.355 -6.881 1.00 0.00 H ATOM 1535 HG11 VAL A 102 23.914 37.546 -7.275 1.00 0.00 H ATOM 1536 HG12 VAL A 102 23.575 36.986 -5.619 1.00 0.00 H ATOM 1537 HG13 VAL A 102 24.398 38.544 -5.882 1.00 0.00 H ATOM 1538 HG21 VAL A 102 25.664 36.279 -4.118 1.00 0.00 H ATOM 1539 HG22 VAL A 102 27.280 36.408 -4.854 1.00 0.00 H ATOM 1540 HG23 VAL A 102 26.354 37.881 -4.475 1.00 0.00 H ATOM 1541 H VAL A 102 25.346 34.047 -5.004 1.00 0.00 H ATOM 1542 N GLU A 103 27.558 35.398 -8.038 1.00 6.97 N ATOM 1543 CA GLU A 103 28.968 35.150 -8.329 1.00 7.17 C ATOM 1544 C GLU A 103 29.719 36.472 -8.220 1.00 6.75 C ATOM 1545 O GLU A 103 29.451 37.418 -8.957 1.00 6.67 O ATOM 1546 CB GLU A 103 29.140 34.513 -9.712 1.00 7.04 C ATOM 1547 CG GLU A 103 28.493 33.136 -9.813 1.00 7.62 C ATOM 1548 CD GLU A 103 28.781 32.407 -11.113 1.00 8.80 C ATOM 1549 OE1 GLU A 103 29.818 32.667 -11.756 1.00 11.17 O ATOM 1550 OE2 GLU A 103 27.962 31.544 -11.483 1.00 13.16 O ATOM 1551 HA GLU A 103 29.378 34.442 -7.609 1.00 0.00 H ATOM 1552 HB2 GLU A 103 28.685 35.167 -10.456 1.00 0.00 H ATOM 1553 HB3 GLU A 103 30.205 34.414 -9.920 1.00 0.00 H ATOM 1554 HG2 GLU A 103 28.860 32.524 -8.989 1.00 0.00 H ATOM 1555 HG3 GLU A 103 27.414 33.257 -9.721 1.00 0.00 H ATOM 1556 H GLU A 103 27.034 36.063 -8.641 1.00 0.00 H ATOM 1557 N LYS A 104 30.638 36.537 -7.262 1.00 6.46 N ATOM 1558 CA LYS A 104 31.393 37.749 -6.977 1.00 6.42 C ATOM 1559 C LYS A 104 32.792 37.374 -6.534 1.00 6.23 C ATOM 1560 O LYS A 104 33.032 36.235 -6.139 1.00 5.83 O ATOM 1561 CB LYS A 104 30.721 38.549 -5.855 1.00 6.47 C ATOM 1562 CG LYS A 104 29.313 39.031 -6.163 1.00 6.73 C ATOM 1563 CD LYS A 104 28.751 39.891 -5.043 1.00 6.53 C ATOM 1564 CE LYS A 104 29.402 41.268 -5.020 1.00 8.16 C ATOM 1565 NZ LYS A 104 28.905 42.093 -3.881 1.00 8.25 N ATOM 1566 HA LYS A 104 31.429 38.358 -7.881 1.00 0.00 H ATOM 1567 HB2 LYS A 104 30.676 37.916 -4.969 1.00 0.00 H ATOM 1568 HB3 LYS A 104 31.339 39.422 -5.645 1.00 0.00 H ATOM 1569 HG2 LYS A 104 29.334 39.618 -7.082 1.00 0.00 H ATOM 1570 HG3 LYS A 104 28.666 38.165 -6.301 1.00 0.00 H ATOM 1571 HD2 LYS A 104 27.677 40.008 -5.190 1.00 0.00 H ATOM 1572 HD3 LYS A 104 28.934 39.396 -4.089 1.00 0.00 H ATOM 1573 HE2 LYS A 104 29.176 41.782 -5.954 1.00 0.00 H ATOM 1574 HE3 LYS A 104 30.481 41.148 -4.925 1.00 0.00 H ATOM 1575 HZ1 LYS A 104 27.876 42.218 -3.968 1.00 0.00 H ATOM 1576 HZ2 LYS A 104 29.123 41.612 -2.985 1.00 0.00 H ATOM 1577 HZ3 LYS A 104 29.371 43.023 -3.899 1.00 0.00 H ATOM 1578 H LYS A 104 30.826 35.687 -6.693 1.00 0.00 H ATOM 1579 N HIS A 105 33.709 38.335 -6.601 1.00 5.89 N ATOM 1580 CA HIS A 105 35.014 38.177 -5.972 1.00 5.99 C ATOM 1581 C HIS A 105 34.816 38.211 -4.458 1.00 5.88 C ATOM 1582 O HIS A 105 33.946 38.930 -3.953 1.00 6.67 O ATOM 1583 CB HIS A 105 35.967 39.299 -6.383 1.00 5.91 C ATOM 1584 CG HIS A 105 36.214 39.378 -7.855 1.00 6.92 C ATOM 1585 ND1 HIS A 105 37.205 38.655 -8.483 1.00 7.97 N ATOM 1586 CD2 HIS A 105 35.591 40.086 -8.827 1.00 8.17 C ATOM 1587 CE1 HIS A 105 37.182 38.915 -9.778 1.00 9.17 C ATOM 1588 NE2 HIS A 105 36.214 39.782 -10.012 1.00 9.58 N ATOM 1589 HA HIS A 105 35.453 37.231 -6.290 1.00 0.00 H ATOM 1590 HB2 HIS A 105 35.542 40.248 -6.055 1.00 0.00 H ATOM 1591 HB3 HIS A 105 36.922 39.138 -5.883 1.00 0.00 H ATOM 1592 HD2 HIS A 105 34.752 40.769 -8.693 1.00 0.00 H ATOM 1593 HE1 HIS A 105 37.849 38.487 -10.526 1.00 0.00 H ATOM 1594 H HIS A 105 33.491 39.215 -7.111 1.00 0.00 H ATOM 1595 N ILE A 106 35.591 37.415 -3.731 1.00 5.52 N ATOM 1596 CA ILE A 106 35.520 37.463 -2.271 1.00 5.44 C ATOM 1597 C ILE A 106 36.737 38.157 -1.692 1.00 5.34 C ATOM 1598 O ILE A 106 37.813 38.142 -2.287 1.00 5.30 O ATOM 1599 CB ILE A 106 35.336 36.065 -1.613 1.00 5.35 C ATOM 1600 CG1 ILE A 106 36.581 35.173 -1.787 1.00 5.69 C ATOM 1601 CG2 ILE A 106 34.070 35.386 -2.135 1.00 5.86 C ATOM 1602 CD1 ILE A 106 36.547 33.874 -0.966 1.00 5.39 C ATOM 1603 HA ILE A 106 34.626 38.040 -2.035 1.00 0.00 H ATOM 1604 HB ILE A 106 35.217 36.217 -0.540 1.00 0.00 H ATOM 1605 HG12 ILE A 106 36.668 34.909 -2.841 1.00 0.00 H ATOM 1606 HG13 ILE A 106 37.457 35.746 -1.484 1.00 0.00 H ATOM 1607 HD11 ILE A 106 36.473 34.117 0.094 1.00 0.00 H ATOM 1608 HD12 ILE A 106 35.683 33.280 -1.264 1.00 0.00 H ATOM 1609 HD13 ILE A 106 37.460 33.307 -1.147 1.00 0.00 H ATOM 1610 HG21 ILE A 106 33.204 36.004 -1.899 1.00 0.00 H ATOM 1611 HG22 ILE A 106 34.145 35.261 -3.215 1.00 0.00 H ATOM 1612 HG23 ILE A 106 33.961 34.410 -1.662 1.00 0.00 H ATOM 1613 H ILE A 106 36.248 36.758 -4.199 1.00 0.00 H ATOM 1614 N ILE A 107 36.542 38.798 -0.542 1.00 5.04 N ATOM 1615 CA ILE A 107 37.646 39.356 0.215 1.00 4.77 C ATOM 1616 C ILE A 107 37.640 38.718 1.586 1.00 4.95 C ATOM 1617 O ILE A 107 36.632 38.768 2.295 1.00 4.53 O ATOM 1618 CB ILE A 107 37.563 40.899 0.323 1.00 4.79 C ATOM 1619 CG1 ILE A 107 37.624 41.521 -1.078 1.00 5.06 C ATOM 1620 CG2 ILE A 107 38.702 41.444 1.185 1.00 5.21 C ATOM 1621 CD1 ILE A 107 37.217 43.004 -1.126 1.00 5.21 C ATOM 1622 HA ILE A 107 38.580 39.140 -0.303 1.00 0.00 H ATOM 1623 HB ILE A 107 36.617 41.163 0.796 1.00 0.00 H ATOM 1624 HG12 ILE A 107 38.646 41.434 -1.447 1.00 0.00 H ATOM 1625 HG13 ILE A 107 36.955 40.961 -1.731 1.00 0.00 H ATOM 1626 HD11 ILE A 107 36.191 43.110 -0.772 1.00 0.00 H ATOM 1627 HD12 ILE A 107 37.884 43.583 -0.488 1.00 0.00 H ATOM 1628 HD13 ILE A 107 37.288 43.366 -2.152 1.00 0.00 H ATOM 1629 HG21 ILE A 107 38.635 41.017 2.186 1.00 0.00 H ATOM 1630 HG22 ILE A 107 39.658 41.173 0.736 1.00 0.00 H ATOM 1631 HG23 ILE A 107 38.622 42.529 1.246 1.00 0.00 H ATOM 1632 H ILE A 107 35.574 38.901 -0.177 1.00 0.00 H ATOM 1633 N VAL A 108 38.768 38.100 1.936 1.00 4.92 N ATOM 1634 CA VAL A 108 38.926 37.416 3.223 1.00 4.93 C ATOM 1635 C VAL A 108 40.178 37.922 3.928 1.00 4.91 C ATOM 1636 O VAL A 108 41.136 38.344 3.267 1.00 5.63 O ATOM 1637 CB VAL A 108 39.003 35.872 3.048 1.00 5.06 C ATOM 1638 CG1 VAL A 108 37.721 35.320 2.403 1.00 6.06 C ATOM 1639 CG2 VAL A 108 40.228 35.472 2.224 1.00 6.16 C ATOM 1640 HA VAL A 108 38.048 37.639 3.830 1.00 0.00 H ATOM 1641 HB VAL A 108 39.100 35.435 4.042 1.00 0.00 H ATOM 1642 HG11 VAL A 108 36.866 35.556 3.037 1.00 0.00 H ATOM 1643 HG12 VAL A 108 37.584 35.775 1.422 1.00 0.00 H ATOM 1644 HG13 VAL A 108 37.807 34.239 2.295 1.00 0.00 H ATOM 1645 HG21 VAL A 108 40.167 35.933 1.238 1.00 0.00 H ATOM 1646 HG22 VAL A 108 41.132 35.812 2.730 1.00 0.00 H ATOM 1647 HG23 VAL A 108 40.255 34.387 2.119 1.00 0.00 H ATOM 1648 H VAL A 108 39.567 38.103 1.270 1.00 0.00 H ATOM 1649 N ALA A 109 40.158 37.906 5.257 1.00 4.85 N ATOM 1650 CA ALA A 109 41.375 38.129 6.042 1.00 5.25 C ATOM 1651 C ALA A 109 42.070 36.789 6.194 1.00 5.38 C ATOM 1652 O ALA A 109 41.408 35.763 6.407 1.00 6.07 O ATOM 1653 CB ALA A 109 41.052 38.716 7.405 1.00 5.50 C ATOM 1654 HA ALA A 109 42.020 38.845 5.533 1.00 0.00 H ATOM 1655 HB1 ALA A 109 40.542 39.670 7.276 1.00 0.00 H ATOM 1656 HB2 ALA A 109 40.407 38.028 7.952 1.00 0.00 H ATOM 1657 HB3 ALA A 109 41.977 38.869 7.962 1.00 0.00 H ATOM 1658 H ALA A 109 39.259 37.731 5.750 1.00 0.00 H ATOM 1659 N CYS A 110 43.398 36.792 6.074 1.00 5.41 N ATOM 1660 CA CYS A 110 44.196 35.568 6.204 1.00 5.71 C ATOM 1661 C CYS A 110 45.139 35.655 7.387 1.00 5.64 C ATOM 1662 O CYS A 110 45.810 36.669 7.588 1.00 5.73 O ATOM 1663 CB CYS A 110 44.980 35.294 4.922 1.00 5.95 C ATOM 1664 SG CYS A 110 43.870 35.004 3.539 1.00 7.37 S ATOM 1665 HA CYS A 110 43.508 34.740 6.375 1.00 0.00 H ATOM 1666 HB2 CYS A 110 45.606 34.414 5.068 1.00 0.00 H ATOM 1667 HB3 CYS A 110 45.611 36.154 4.699 1.00 0.00 H ATOM 1668 H CYS A 110 43.884 37.691 5.882 1.00 0.00 H ATOM 1669 N GLY A 111 45.181 34.590 8.177 1.00 5.52 N ATOM 1670 CA GLY A 111 45.968 34.602 9.402 1.00 4.85 C ATOM 1671 C GLY A 111 46.457 33.217 9.741 1.00 4.43 C ATOM 1672 O GLY A 111 46.011 32.223 9.157 1.00 4.93 O ATOM 1673 HA3 GLY A 111 45.350 34.973 10.220 1.00 0.00 H ATOM 1674 HA2 GLY A 111 46.826 35.261 9.269 1.00 0.00 H ATOM 1675 H GLY A 111 44.646 33.737 7.918 1.00 0.00 H ATOM 1676 N GLY A 112 47.378 33.161 10.692 1.00 4.78 N ATOM 1677 CA GLY A 112 47.940 31.894 11.134 1.00 4.42 C ATOM 1678 C GLY A 112 49.069 31.395 10.257 1.00 4.72 C ATOM 1679 O GLY A 112 49.490 32.074 9.317 1.00 4.53 O ATOM 1680 HA3 GLY A 112 47.147 31.146 11.135 1.00 0.00 H ATOM 1681 HA2 GLY A 112 48.320 32.020 12.148 1.00 0.00 H ATOM 1682 H GLY A 112 47.707 34.044 11.133 1.00 0.00 H ATOM 1683 N LYS A 113 49.574 30.215 10.602 1.00 4.93 N ATOM 1684 CA LYS A 113 50.585 29.520 9.820 1.00 5.33 C ATOM 1685 C LYS A 113 50.174 28.049 9.733 1.00 5.29 C ATOM 1686 O LYS A 113 50.116 27.378 10.754 1.00 4.58 O ATOM 1687 CB LYS A 113 51.946 29.622 10.501 1.00 6.10 C ATOM 1688 CG LYS A 113 52.626 30.979 10.390 1.00 8.65 C ATOM 1689 CD LYS A 113 54.035 30.896 10.973 1.00 12.05 C ATOM 1690 CE LYS A 113 54.916 29.915 10.183 1.00 13.60 C ATOM 1691 NZ LYS A 113 55.781 29.076 11.071 1.00 16.97 N ATOM 1692 HA LYS A 113 50.661 29.966 8.828 1.00 0.00 H ATOM 1693 HB2 LYS A 113 51.812 29.397 11.559 1.00 0.00 H ATOM 1694 HB3 LYS A 113 52.604 28.877 10.053 1.00 0.00 H ATOM 1695 HG2 LYS A 113 52.684 31.271 9.342 1.00 0.00 H ATOM 1696 HG3 LYS A 113 52.048 31.721 10.941 1.00 0.00 H ATOM 1697 HD2 LYS A 113 54.490 31.886 10.941 1.00 0.00 H ATOM 1698 HD3 LYS A 113 53.971 30.560 12.008 1.00 0.00 H ATOM 1699 HE2 LYS A 113 55.556 30.485 9.509 1.00 0.00 H ATOM 1700 HE3 LYS A 113 54.271 29.257 9.601 1.00 0.00 H ATOM 1701 HZ1 LYS A 113 56.407 29.693 11.626 1.00 0.00 H ATOM 1702 HZ2 LYS A 113 55.181 28.521 11.714 1.00 0.00 H ATOM 1703 HZ3 LYS A 113 56.354 28.433 10.488 1.00 0.00 H ATOM 1704 H LYS A 113 49.229 29.766 11.474 1.00 0.00 H ATOM 1705 N PRO A 114 49.848 27.554 8.527 1.00 5.76 N ATOM 1706 CA PRO A 114 49.789 28.233 7.233 1.00 6.26 C ATOM 1707 C PRO A 114 48.805 29.394 7.252 1.00 6.48 C ATOM 1708 O PRO A 114 47.845 29.389 8.034 1.00 6.67 O ATOM 1709 CB PRO A 114 49.254 27.148 6.286 1.00 6.43 C ATOM 1710 CG PRO A 114 49.512 25.875 6.953 1.00 6.98 C ATOM 1711 CD PRO A 114 49.440 26.143 8.417 1.00 5.68 C ATOM 1712 HA PRO A 114 50.757 28.646 6.948 1.00 0.00 H ATOM 1713 HD3 PRO A 114 48.426 26.000 8.791 1.00 0.00 H ATOM 1714 HD2 PRO A 114 50.123 25.495 8.966 1.00 0.00 H ATOM 1715 HG3 PRO A 114 50.501 25.503 6.686 1.00 0.00 H ATOM 1716 HG2 PRO A 114 48.760 25.140 6.667 1.00 0.00 H ATOM 1717 HB2 PRO A 114 48.185 27.281 6.122 1.00 0.00 H ATOM 1718 HB3 PRO A 114 49.775 27.188 5.329 1.00 0.00 H ATOM 1719 N SER A 115 49.030 30.373 6.384 1.00 6.25 N ATOM 1720 CA SER A 115 48.124 31.515 6.302 1.00 6.55 C ATOM 1721 C SER A 115 46.854 31.092 5.580 1.00 6.79 C ATOM 1722 O SER A 115 46.893 30.742 4.399 1.00 7.43 O ATOM 1723 CB SER A 115 48.803 32.673 5.573 1.00 6.48 C ATOM 1724 OG SER A 115 47.951 33.799 5.513 1.00 7.31 O ATOM 1725 HA SER A 115 47.866 31.854 7.306 1.00 0.00 H ATOM 1726 HB2 SER A 115 49.053 32.360 4.559 1.00 0.00 H ATOM 1727 HB3 SER A 115 49.716 32.943 6.104 1.00 0.00 H ATOM 1728 HG SER A 115 48.412 34.535 5.037 1.00 0.00 H ATOM 1729 H SER A 115 49.859 30.326 5.757 1.00 0.00 H ATOM 1730 N VAL A 116 45.741 31.092 6.311 1.00 6.85 N ATOM 1731 CA VAL A 116 44.453 30.635 5.778 1.00 6.87 C ATOM 1732 C VAL A 116 43.362 31.659 6.104 1.00 6.60 C ATOM 1733 O VAL A 116 43.561 32.514 6.971 1.00 7.24 O ATOM 1734 CB VAL A 116 44.053 29.224 6.321 1.00 6.67 C ATOM 1735 CG1 VAL A 116 45.080 28.157 5.899 1.00 7.10 C ATOM 1736 CG2 VAL A 116 43.867 29.243 7.834 1.00 7.21 C ATOM 1737 HA VAL A 116 44.559 30.544 4.697 1.00 0.00 H ATOM 1738 HB VAL A 116 43.094 28.958 5.876 1.00 0.00 H ATOM 1739 HG11 VAL A 116 45.129 28.112 4.811 1.00 0.00 H ATOM 1740 HG12 VAL A 116 46.060 28.420 6.297 1.00 0.00 H ATOM 1741 HG13 VAL A 116 44.776 27.186 6.291 1.00 0.00 H ATOM 1742 HG21 VAL A 116 44.800 29.546 8.310 1.00 0.00 H ATOM 1743 HG22 VAL A 116 43.079 29.950 8.093 1.00 0.00 H ATOM 1744 HG23 VAL A 116 43.590 28.246 8.177 1.00 0.00 H ATOM 1745 H VAL A 116 45.786 31.428 7.294 1.00 0.00 H ATOM 1746 N PRO A 117 42.200 31.586 5.416 1.00 7.02 N ATOM 1747 CA PRO A 117 41.125 32.540 5.726 1.00 6.97 C ATOM 1748 C PRO A 117 40.641 32.421 7.169 1.00 7.32 C ATOM 1749 O PRO A 117 40.389 31.314 7.658 1.00 7.64 O ATOM 1750 CB PRO A 117 40.011 32.147 4.744 1.00 7.38 C ATOM 1751 CG PRO A 117 40.720 31.424 3.634 1.00 7.41 C ATOM 1752 CD PRO A 117 41.824 30.677 4.313 1.00 6.64 C ATOM 1753 HA PRO A 117 41.453 33.575 5.626 1.00 0.00 H ATOM 1754 HD3 PRO A 117 41.473 29.718 4.695 1.00 0.00 H ATOM 1755 HD2 PRO A 117 42.662 30.512 3.636 1.00 0.00 H ATOM 1756 HG3 PRO A 117 41.123 32.132 2.909 1.00 0.00 H ATOM 1757 HG2 PRO A 117 40.043 30.735 3.129 1.00 0.00 H ATOM 1758 HB2 PRO A 117 39.285 31.493 5.227 1.00 0.00 H ATOM 1759 HB3 PRO A 117 39.503 33.033 4.363 1.00 0.00 H ATOM 1760 N VAL A 118 40.550 33.563 7.844 1.00 6.81 N ATOM 1761 CA VAL A 118 40.069 33.593 9.225 1.00 7.03 C ATOM 1762 C VAL A 118 38.836 34.482 9.412 1.00 6.98 C ATOM 1763 O VAL A 118 38.141 34.368 10.408 1.00 7.51 O ATOM 1764 CB VAL A 118 41.204 33.988 10.200 1.00 6.84 C ATOM 1765 CG1 VAL A 118 42.294 32.914 10.193 1.00 7.17 C ATOM 1766 CG2 VAL A 118 41.792 35.344 9.827 1.00 7.96 C ATOM 1767 HA VAL A 118 39.749 32.579 9.464 1.00 0.00 H ATOM 1768 HB VAL A 118 40.788 34.065 11.204 1.00 0.00 H ATOM 1769 HG11 VAL A 118 41.866 31.962 10.506 1.00 0.00 H ATOM 1770 HG12 VAL A 118 42.701 32.818 9.186 1.00 0.00 H ATOM 1771 HG13 VAL A 118 43.089 33.200 10.882 1.00 0.00 H ATOM 1772 HG21 VAL A 118 42.197 35.297 8.816 1.00 0.00 H ATOM 1773 HG22 VAL A 118 41.010 36.102 9.872 1.00 0.00 H ATOM 1774 HG23 VAL A 118 42.588 35.599 10.527 1.00 0.00 H ATOM 1775 H VAL A 118 40.826 34.452 7.381 1.00 0.00 H ATOM 1776 N HIS A 119 38.556 35.333 8.429 1.00 7.23 N ATOM 1777 CA HIS A 119 37.434 36.278 8.486 1.00 7.77 C ATOM 1778 C HIS A 119 36.916 36.496 7.064 1.00 7.45 C ATOM 1779 O HIS A 119 37.708 36.581 6.128 1.00 7.83 O ATOM 1780 CB HIS A 119 37.944 37.575 9.143 1.00 8.83 C ATOM 1781 CG HIS A 119 37.132 38.801 8.865 1.00 10.34 C ATOM 1782 ND1 HIS A 119 36.001 39.126 9.584 1.00 12.78 N ATOM 1783 CD2 HIS A 119 37.337 39.827 8.004 1.00 11.56 C ATOM 1784 CE1 HIS A 119 35.519 40.275 9.146 1.00 12.14 C ATOM 1785 NE2 HIS A 119 36.315 40.723 8.191 1.00 12.55 N ATOM 1786 HA HIS A 119 36.602 35.903 9.082 1.00 0.00 H ATOM 1787 HB2 HIS A 119 37.961 37.421 10.222 1.00 0.00 H ATOM 1788 HB3 HIS A 119 38.958 37.756 8.787 1.00 0.00 H ATOM 1789 HD2 HIS A 119 38.160 39.923 7.295 1.00 0.00 H ATOM 1790 HE1 HIS A 119 34.618 40.769 9.510 1.00 0.00 H ATOM 1791 H HIS A 119 39.159 35.329 7.582 1.00 0.00 H ATOM 1792 N PHE A 120 35.598 36.543 6.890 1.00 6.56 N ATOM 1793 CA PHE A 120 35.056 36.925 5.588 1.00 6.64 C ATOM 1794 C PHE A 120 34.756 38.412 5.655 1.00 6.38 C ATOM 1795 O PHE A 120 33.947 38.849 6.477 1.00 7.58 O ATOM 1796 CB PHE A 120 33.789 36.141 5.229 1.00 6.35 C ATOM 1797 CG PHE A 120 33.384 36.287 3.789 1.00 6.55 C ATOM 1798 CD1 PHE A 120 32.760 37.450 3.338 1.00 6.62 C ATOM 1799 CD2 PHE A 120 33.652 35.272 2.878 1.00 8.00 C ATOM 1800 CE1 PHE A 120 32.392 37.598 1.992 1.00 6.98 C ATOM 1801 CE2 PHE A 120 33.303 35.404 1.527 1.00 6.80 C ATOM 1802 CZ PHE A 120 32.666 36.571 1.084 1.00 7.06 C ATOM 1803 HA PHE A 120 35.783 36.696 4.808 1.00 0.00 H ATOM 1804 HB2 PHE A 120 33.966 35.085 5.433 1.00 0.00 H ATOM 1805 HB3 PHE A 120 32.972 36.498 5.856 1.00 0.00 H ATOM 1806 HD2 PHE A 120 34.141 34.360 3.219 1.00 0.00 H ATOM 1807 HE2 PHE A 120 33.526 34.602 0.823 1.00 0.00 H ATOM 1808 HZ PHE A 120 32.385 36.677 0.036 1.00 0.00 H ATOM 1809 HE1 PHE A 120 31.895 38.508 1.656 1.00 0.00 H ATOM 1810 HD1 PHE A 120 32.555 38.256 4.042 1.00 0.00 H ATOM 1811 H PHE A 120 34.958 36.309 7.675 1.00 0.00 H ATOM 1812 N ASP A 121 35.417 39.187 4.797 1.00 6.42 N ATOM 1813 CA ASP A 121 35.326 40.634 4.873 1.00 6.17 C ATOM 1814 C ASP A 121 34.262 41.273 3.993 1.00 6.45 C ATOM 1815 O ASP A 121 33.517 42.134 4.454 1.00 6.26 O ATOM 1816 CB ASP A 121 36.687 41.273 4.590 1.00 6.22 C ATOM 1817 CG ASP A 121 36.793 42.673 5.149 1.00 7.07 C ATOM 1818 OD1 ASP A 121 36.564 42.840 6.369 1.00 8.84 O ATOM 1819 OD2 ASP A 121 37.111 43.609 4.390 1.00 6.83 O ATOM 1820 HA ASP A 121 35.009 40.834 5.897 1.00 0.00 H ATOM 1821 HB2 ASP A 121 37.464 40.656 5.041 1.00 0.00 H ATOM 1822 HB3 ASP A 121 36.837 41.314 3.511 1.00 0.00 H ATOM 1823 H ASP A 121 36.007 38.749 4.061 1.00 0.00 H ATOM 1824 N ALA A 122 34.208 40.867 2.731 1.00 6.19 N ATOM 1825 CA ALA A 122 33.400 41.550 1.734 1.00 6.12 C ATOM 1826 C ALA A 122 33.303 40.712 0.469 1.00 6.18 C ATOM 1827 O ALA A 122 34.057 39.760 0.285 1.00 6.33 O ATOM 1828 CB ALA A 122 34.034 42.899 1.401 1.00 6.34 C ATOM 1829 HA ALA A 122 32.398 41.702 2.136 1.00 0.00 H ATOM 1830 HB1 ALA A 122 34.088 43.507 2.304 1.00 0.00 H ATOM 1831 HB2 ALA A 122 35.038 42.740 1.008 1.00 0.00 H ATOM 1832 HB3 ALA A 122 33.427 43.410 0.653 1.00 0.00 H ATOM 1833 H ALA A 122 34.761 40.034 2.446 1.00 0.00 H ATOM 1834 N SER A 123 32.370 41.085 -0.401 1.00 7.07 N ATOM 1835 CA SER A 123 32.342 40.568 -1.759 1.00 7.77 C ATOM 1836 C SER A 123 32.301 41.762 -2.694 1.00 8.42 C ATOM 1837 O SER A 123 31.772 42.817 -2.337 1.00 8.30 O ATOM 1838 CB SER A 123 31.148 39.641 -1.984 1.00 7.63 C ATOM 1839 OG SER A 123 29.918 40.341 -1.873 1.00 7.69 O ATOM 1840 HA SER A 123 33.229 39.965 -1.951 1.00 0.00 H ATOM 1841 HB2 SER A 123 31.172 38.845 -1.239 1.00 0.00 H ATOM 1842 HB3 SER A 123 31.220 39.206 -2.981 1.00 0.00 H ATOM 1843 HG SER A 123 29.844 40.734 -0.967 1.00 0.00 H ATOM 1844 H SER A 123 31.641 41.764 -0.102 1.00 0.00 H ATOM 1845 N VAL A 124 32.874 41.609 -3.880 1.00 9.01 N ATOM 1846 CA VAL A 124 32.942 42.721 -4.821 1.00 9.85 C ATOM 1847 C VAL A 124 32.689 42.255 -6.251 1.00 10.06 C ATOM 1848 O VAL A 124 32.893 41.088 -6.581 1.00 9.89 O ATOM 1849 CB VAL A 124 34.276 43.531 -4.671 1.00 9.83 C ATOM 1850 CG1 VAL A 124 35.495 42.658 -4.949 1.00 10.34 C ATOM 1851 CG2 VAL A 124 34.273 44.778 -5.555 1.00 11.19 C ATOM 1852 HA VAL A 124 32.139 43.415 -4.574 1.00 0.00 H ATOM 1853 OXT VAL A 124 32.254 43.034 -7.105 1.00 10.68 O ATOM 1854 HB VAL A 124 34.341 43.862 -3.634 1.00 0.00 H ATOM 1855 HG11 VAL A 124 35.514 41.827 -4.243 1.00 0.00 H ATOM 1856 HG12 VAL A 124 35.439 42.271 -5.966 1.00 0.00 H ATOM 1857 HG13 VAL A 124 36.401 43.254 -4.835 1.00 0.00 H ATOM 1858 HG21 VAL A 124 34.162 44.482 -6.598 1.00 0.00 H ATOM 1859 HG22 VAL A 124 33.442 45.423 -5.269 1.00 0.00 H ATOM 1860 HG23 VAL A 124 35.212 45.315 -5.426 1.00 0.00 H ATOM 1861 H VAL A 124 33.279 40.687 -4.142 1.00 0.00 H TER 1862 VAL A 124 ATOM 1863 N LYS B 1 39.552 26.302 22.585 1.00 14.46 N ATOM 1864 CA LYS B 1 38.739 27.238 21.762 1.00 14.02 C ATOM 1865 C LYS B 1 38.818 26.866 20.283 1.00 13.38 C ATOM 1866 O LYS B 1 39.893 26.528 19.777 1.00 13.40 O ATOM 1867 CB LYS B 1 39.214 28.682 21.978 1.00 14.31 C ATOM 1868 CG LYS B 1 38.443 29.740 21.191 1.00 14.77 C ATOM 1869 CD LYS B 1 39.097 31.104 21.316 1.00 14.95 C ATOM 1870 CE LYS B 1 38.456 32.105 20.376 1.00 16.83 C ATOM 1871 NZ LYS B 1 39.139 33.418 20.435 1.00 17.78 N ATOM 1872 HA LYS B 1 37.698 27.160 22.077 1.00 0.00 H ATOM 1873 HB2 LYS B 1 39.120 28.914 23.039 1.00 0.00 H ATOM 1874 HB3 LYS B 1 40.263 28.741 21.686 1.00 0.00 H ATOM 1875 HG2 LYS B 1 38.417 29.453 20.140 1.00 0.00 H ATOM 1876 HG3 LYS B 1 37.425 29.797 21.575 1.00 0.00 H ATOM 1877 HD2 LYS B 1 38.989 31.458 22.341 1.00 0.00 H ATOM 1878 HD3 LYS B 1 40.156 31.015 21.073 1.00 0.00 H ATOM 1879 HE2 LYS B 1 37.411 32.236 20.656 1.00 0.00 H ATOM 1880 HE3 LYS B 1 38.512 31.721 19.357 1.00 0.00 H ATOM 1881 HZ1 LYS B 1 39.084 33.793 21.404 1.00 0.00 H ATOM 1882 HZ2 LYS B 1 40.136 33.301 20.163 1.00 0.00 H ATOM 1883 HZ3 LYS B 1 38.675 34.079 19.780 1.00 0.00 H ATOM 1884 HN3 LYS B 1 40.545 26.347 22.279 1.00 0.00 H ATOM 1885 HN2 LYS B 1 39.194 25.333 22.462 1.00 0.00 H ATOM 1886 HN1 LYS B 1 39.484 26.574 23.586 1.00 0.00 H ATOM 1887 N GLU B 2 37.670 26.929 19.607 1.00 12.11 N ATOM 1888 CA GLU B 2 37.576 26.747 18.156 1.00 10.79 C ATOM 1889 C GLU B 2 38.625 27.620 17.466 1.00 9.90 C ATOM 1890 O GLU B 2 38.772 28.798 17.798 1.00 9.53 O ATOM 1891 CB GLU B 2 36.169 27.136 17.679 1.00 11.11 C ATOM 1892 CG GLU B 2 35.917 26.951 16.186 1.00 10.48 C ATOM 1893 CD GLU B 2 34.578 27.514 15.727 1.00 10.85 C ATOM 1894 OE1 GLU B 2 34.099 28.517 16.311 1.00 11.64 O ATOM 1895 OE2 GLU B 2 34.001 26.945 14.772 1.00 10.17 O ATOM 1896 HA GLU B 2 37.759 25.702 17.904 1.00 0.00 H ATOM 1897 HB2 GLU B 2 35.447 26.525 18.222 1.00 0.00 H ATOM 1898 HB3 GLU B 2 36.009 28.187 17.921 1.00 0.00 H ATOM 1899 HG2 GLU B 2 36.712 27.455 15.636 1.00 0.00 H ATOM 1900 HG3 GLU B 2 35.940 25.885 15.960 1.00 0.00 H ATOM 1901 H GLU B 2 36.796 27.117 20.138 1.00 0.00 H ATOM 1902 N SER B 3 39.361 27.045 16.518 1.00 8.95 N ATOM 1903 CA SER B 3 40.392 27.821 15.826 1.00 8.69 C ATOM 1904 C SER B 3 39.726 28.821 14.887 1.00 8.41 C ATOM 1905 O SER B 3 38.594 28.616 14.452 1.00 8.18 O ATOM 1906 CB SER B 3 41.370 26.920 15.062 1.00 9.00 C ATOM 1907 OG SER B 3 40.784 26.449 13.861 1.00 9.20 O ATOM 1908 HA SER B 3 40.977 28.358 16.572 1.00 0.00 H ATOM 1909 HB2 SER B 3 41.636 26.069 15.688 1.00 0.00 H ATOM 1910 HB3 SER B 3 42.269 27.489 14.823 1.00 0.00 H ATOM 1911 HG SER B 3 41.431 25.871 13.384 1.00 0.00 H ATOM 1912 H SER B 3 39.204 26.047 16.269 1.00 0.00 H ATOM 1913 N ALA B 4 40.427 29.912 14.594 1.00 8.01 N ATOM 1914 CA ALA B 4 39.928 30.911 13.653 1.00 7.97 C ATOM 1915 C ALA B 4 39.697 30.294 12.273 1.00 7.77 C ATOM 1916 O ALA B 4 38.717 30.607 11.600 1.00 7.55 O ATOM 1917 CB ALA B 4 40.890 32.088 13.568 1.00 7.93 C ATOM 1918 HA ALA B 4 38.969 31.278 14.019 1.00 0.00 H ATOM 1919 HB1 ALA B 4 40.990 32.546 14.552 1.00 0.00 H ATOM 1920 HB2 ALA B 4 41.864 31.736 13.229 1.00 0.00 H ATOM 1921 HB3 ALA B 4 40.502 32.822 12.862 1.00 0.00 H ATOM 1922 H ALA B 4 41.352 30.057 15.046 1.00 0.00 H ATOM 1923 N ALA B 5 40.602 29.411 11.862 1.00 7.97 N ATOM 1924 CA ALA B 5 40.448 28.672 10.606 1.00 7.89 C ATOM 1925 C ALA B 5 39.170 27.836 10.585 1.00 8.17 C ATOM 1926 O ALA B 5 38.420 27.872 9.618 1.00 7.78 O ATOM 1927 CB ALA B 5 41.662 27.790 10.362 1.00 7.76 C ATOM 1928 HA ALA B 5 40.369 29.405 9.803 1.00 0.00 H ATOM 1929 HB1 ALA B 5 42.555 28.412 10.303 1.00 0.00 H ATOM 1930 HB2 ALA B 5 41.765 27.081 11.183 1.00 0.00 H ATOM 1931 HB3 ALA B 5 41.533 27.247 9.425 1.00 0.00 H ATOM 1932 H ALA B 5 41.443 29.240 12.449 1.00 0.00 H ATOM 1933 N ALA B 6 38.940 27.079 11.660 1.00 7.82 N ATOM 1934 CA ALA B 6 37.742 26.249 11.800 1.00 7.98 C ATOM 1935 C ALA B 6 36.485 27.113 11.858 1.00 8.00 C ATOM 1936 O ALA B 6 35.450 26.750 11.299 1.00 8.47 O ATOM 1937 CB ALA B 6 37.842 25.372 13.044 1.00 7.85 C ATOM 1938 HA ALA B 6 37.672 25.604 10.924 1.00 0.00 H ATOM 1939 HB1 ALA B 6 38.715 24.724 12.961 1.00 0.00 H ATOM 1940 HB2 ALA B 6 37.940 26.005 13.926 1.00 0.00 H ATOM 1941 HB3 ALA B 6 36.942 24.763 13.131 1.00 0.00 H ATOM 1942 H ALA B 6 39.640 27.079 12.429 1.00 0.00 H ATOM 1943 N LYS B 7 36.586 28.263 12.523 1.00 8.04 N ATOM 1944 CA LYS B 7 35.453 29.182 12.624 1.00 8.21 C ATOM 1945 C LYS B 7 35.078 29.718 11.247 1.00 7.94 C ATOM 1946 O LYS B 7 33.889 29.825 10.920 1.00 7.71 O ATOM 1947 CB LYS B 7 35.750 30.340 13.584 1.00 8.42 C ATOM 1948 CG LYS B 7 34.595 31.327 13.689 1.00 9.62 C ATOM 1949 CD LYS B 7 34.857 32.416 14.709 1.00 10.62 C ATOM 1950 CE LYS B 7 33.705 33.411 14.730 1.00 11.89 C ATOM 1951 NZ LYS B 7 33.895 34.413 15.816 1.00 12.98 N ATOM 1952 HA LYS B 7 34.609 28.623 13.028 1.00 0.00 H ATOM 1953 HB2 LYS B 7 35.950 29.930 14.574 1.00 0.00 H ATOM 1954 HB3 LYS B 7 36.632 30.872 13.227 1.00 0.00 H ATOM 1955 HG2 LYS B 7 34.440 31.790 12.714 1.00 0.00 H ATOM 1956 HG3 LYS B 7 33.695 30.784 13.979 1.00 0.00 H ATOM 1957 HD2 LYS B 7 34.962 31.966 15.696 1.00 0.00 H ATOM 1958 HD3 LYS B 7 35.778 32.938 14.449 1.00 0.00 H ATOM 1959 HE2 LYS B 7 32.771 32.874 14.897 1.00 0.00 H ATOM 1960 HE3 LYS B 7 33.660 33.927 13.771 1.00 0.00 H ATOM 1961 HZ1 LYS B 7 33.935 33.925 16.733 1.00 0.00 H ATOM 1962 HZ2 LYS B 7 34.784 34.930 15.658 1.00 0.00 H ATOM 1963 HZ3 LYS B 7 33.098 35.082 15.812 1.00 0.00 H ATOM 1964 H LYS B 7 37.487 28.512 12.979 1.00 0.00 H ATOM 1965 N PHE B 8 36.090 30.049 10.440 1.00 7.48 N ATOM 1966 CA PHE B 8 35.845 30.476 9.067 1.00 7.50 C ATOM 1967 C PHE B 8 35.142 29.376 8.275 1.00 7.59 C ATOM 1968 O PHE B 8 34.169 29.644 7.567 1.00 8.73 O ATOM 1969 CB PHE B 8 37.136 30.863 8.351 1.00 6.90 C ATOM 1970 CG PHE B 8 36.917 31.317 6.931 1.00 6.29 C ATOM 1971 CD1 PHE B 8 36.882 30.396 5.885 1.00 6.89 C ATOM 1972 CD2 PHE B 8 36.726 32.668 6.643 1.00 5.21 C ATOM 1973 CE1 PHE B 8 36.657 30.814 4.564 1.00 7.18 C ATOM 1974 CE2 PHE B 8 36.514 33.102 5.327 1.00 6.51 C ATOM 1975 CZ PHE B 8 36.480 32.173 4.286 1.00 6.88 C ATOM 1976 HA PHE B 8 35.204 31.356 9.121 1.00 0.00 H ATOM 1977 HB2 PHE B 8 37.609 31.674 8.905 1.00 0.00 H ATOM 1978 HB3 PHE B 8 37.798 29.997 8.340 1.00 0.00 H ATOM 1979 HD2 PHE B 8 36.742 33.397 7.453 1.00 0.00 H ATOM 1980 HE2 PHE B 8 36.376 34.163 5.117 1.00 0.00 H ATOM 1981 HZ PHE B 8 36.316 32.505 3.261 1.00 0.00 H ATOM 1982 HE1 PHE B 8 36.620 30.082 3.758 1.00 0.00 H ATOM 1983 HD1 PHE B 8 37.031 29.337 6.096 1.00 0.00 H ATOM 1984 H PHE B 8 37.066 30.002 10.796 1.00 0.00 H ATOM 1985 N GLU B 9 35.629 28.140 8.401 1.00 7.87 N ATOM 1986 CA GLU B 9 35.035 27.039 7.659 1.00 7.97 C ATOM 1987 C GLU B 9 33.584 26.849 8.087 1.00 8.01 C ATOM 1988 O GLU B 9 32.707 26.634 7.245 1.00 8.35 O ATOM 1989 CB GLU B 9 35.842 25.757 7.840 1.00 8.05 C ATOM 1990 CG GLU B 9 37.215 25.814 7.176 1.00 9.34 C ATOM 1991 CD GLU B 9 37.920 24.477 7.196 1.00 10.93 C ATOM 1992 OE1 GLU B 9 37.234 23.445 7.031 1.00 13.46 O ATOM 1993 OE2 GLU B 9 39.158 24.452 7.376 1.00 11.39 O ATOM 1994 HA GLU B 9 35.052 27.282 6.597 1.00 0.00 H ATOM 1995 HB2 GLU B 9 35.980 25.581 8.907 1.00 0.00 H ATOM 1996 HB3 GLU B 9 35.281 24.929 7.406 1.00 0.00 H ATOM 1997 HG2 GLU B 9 37.090 26.129 6.140 1.00 0.00 H ATOM 1998 HG3 GLU B 9 37.830 26.542 7.705 1.00 0.00 H ATOM 1999 H GLU B 9 36.436 27.963 9.032 1.00 0.00 H ATOM 2000 N ARG B 10 33.335 26.951 9.393 1.00 7.99 N ATOM 2001 CA ARG B 10 31.979 26.802 9.935 1.00 7.90 C ATOM 2002 C ARG B 10 31.044 27.893 9.433 1.00 8.03 C ATOM 2003 O ARG B 10 29.922 27.628 9.007 1.00 8.60 O ATOM 2004 CB ARG B 10 32.001 26.848 11.464 1.00 7.66 C ATOM 2005 CG ARG B 10 30.602 26.826 12.086 1.00 7.95 C ATOM 2006 CD ARG B 10 30.631 26.711 13.612 1.00 8.32 C ATOM 2007 NE ARG B 10 31.414 27.771 14.253 1.00 8.95 N ATOM 2008 CZ ARG B 10 30.964 28.995 14.524 1.00 9.40 C ATOM 2009 NH1 ARG B 10 29.725 29.359 14.202 1.00 8.98 N ATOM 2010 NH2 ARG B 10 31.765 29.867 15.127 1.00 9.46 N ATOM 2011 HA ARG B 10 31.610 25.835 9.593 1.00 0.00 H ATOM 2012 HB2 ARG B 10 32.557 25.985 11.829 1.00 0.00 H ATOM 2013 HB3 ARG B 10 32.506 27.762 11.777 1.00 0.00 H ATOM 2014 HG2 ARG B 10 30.086 27.748 11.816 1.00 0.00 H ATOM 2015 HG3 ARG B 10 30.055 25.974 11.683 1.00 0.00 H ATOM 2016 HD2 ARG B 10 31.066 25.748 13.880 1.00 0.00 H ATOM 2017 HD3 ARG B 10 29.608 26.762 13.984 1.00 0.00 H ATOM 2018 HE ARG B 10 32.396 27.551 14.516 1.00 0.00 H ATOM 2019 HH12 ARG B 10 29.391 30.319 14.422 1.00 0.00 H ATOM 2020 HH11 ARG B 10 29.090 28.683 13.731 1.00 0.00 H ATOM 2021 HH22 ARG B 10 31.422 30.825 15.343 1.00 0.00 H ATOM 2022 HH21 ARG B 10 32.735 29.592 15.383 1.00 0.00 H ATOM 2023 H ARG B 10 34.123 27.141 10.045 1.00 0.00 H ATOM 2024 N GLN B 11 31.515 29.129 9.494 1.00 8.31 N ATOM 2025 CA GLN B 11 30.653 30.249 9.171 1.00 8.18 C ATOM 2026 C GLN B 11 30.496 30.464 7.678 1.00 8.65 C ATOM 2027 O GLN B 11 29.472 30.989 7.239 1.00 8.28 O ATOM 2028 CB GLN B 11 31.211 31.531 9.772 1.00 8.07 C ATOM 2029 CG GLN B 11 31.109 31.607 11.263 1.00 7.96 C ATOM 2030 CD GLN B 11 31.397 33.006 11.755 1.00 9.94 C ATOM 2031 OE1 GLN B 11 32.414 33.597 11.405 1.00 12.95 O ATOM 2032 NE2 GLN B 11 30.491 33.553 12.547 1.00 11.64 N ATOM 2033 HA GLN B 11 29.676 30.008 9.589 1.00 0.00 H ATOM 2034 HB2 GLN B 11 32.263 31.608 9.497 1.00 0.00 H ATOM 2035 HB3 GLN B 11 30.664 32.373 9.349 1.00 0.00 H ATOM 2036 HG2 GLN B 11 30.102 31.322 11.567 1.00 0.00 H ATOM 2037 HG3 GLN B 11 31.829 30.918 11.705 1.00 0.00 H ATOM 2038 HE22 GLN B 11 29.644 33.014 12.818 1.00 0.00 H ATOM 2039 HE21 GLN B 11 30.625 34.522 12.899 1.00 0.00 H ATOM 2040 H GLN B 11 32.503 29.296 9.773 1.00 0.00 H ATOM 2041 N HIS B 12 31.521 30.105 6.906 1.00 8.05 N ATOM 2042 CA HIS B 12 31.604 30.568 5.515 1.00 8.14 C ATOM 2043 C HIS B 12 31.777 29.530 4.417 1.00 8.81 C ATOM 2044 O HIS B 12 31.674 29.878 3.247 1.00 9.55 O ATOM 2045 CB HIS B 12 32.693 31.632 5.373 1.00 7.38 C ATOM 2046 CG HIS B 12 32.517 32.793 6.303 1.00 6.64 C ATOM 2047 ND1 HIS B 12 31.433 33.644 6.234 1.00 6.17 N ATOM 2048 CD2 HIS B 12 33.285 33.240 7.328 1.00 6.43 C ATOM 2049 CE1 HIS B 12 31.549 34.573 7.168 1.00 5.95 C ATOM 2050 NE2 HIS B 12 32.656 34.345 7.848 1.00 5.55 N ATOM 2051 HA HIS B 12 30.602 30.961 5.343 1.00 0.00 H ATOM 2052 HB2 HIS B 12 33.658 31.168 5.578 1.00 0.00 H ATOM 2053 HB3 HIS B 12 32.681 32.005 4.349 1.00 0.00 H ATOM 2054 HD2 HIS B 12 34.223 32.805 7.673 1.00 0.00 H ATOM 2055 HE1 HIS B 12 30.848 35.389 7.346 1.00 0.00 H ATOM 2056 H HIS B 12 32.268 29.492 7.291 1.00 0.00 H ATOM 2057 N MET B 13 32.032 28.273 4.773 1.00 9.04 N ATOM 2058 CA MET B 13 32.275 27.248 3.752 1.00 9.24 C ATOM 2059 C MET B 13 31.102 26.284 3.581 1.00 9.18 C ATOM 2060 O MET B 13 30.614 25.699 4.547 1.00 10.21 O ATOM 2061 CB MET B 13 33.560 26.458 4.046 1.00 9.48 C ATOM 2062 CG MET B 13 34.863 27.239 3.844 1.00 9.16 C ATOM 2063 SD MET B 13 35.086 27.949 2.190 1.00 9.77 S ATOM 2064 CE MET B 13 34.938 26.490 1.164 1.00 10.48 C ATOM 2065 HA MET B 13 32.393 27.789 2.813 1.00 0.00 H ATOM 2066 HB2 MET B 13 33.523 26.125 5.083 1.00 0.00 H ATOM 2067 HB3 MET B 13 33.581 25.589 3.388 1.00 0.00 H ATOM 2068 HG2 MET B 13 35.696 26.563 4.036 1.00 0.00 H ATOM 2069 HG3 MET B 13 34.884 28.054 4.567 1.00 0.00 H ATOM 2070 HE1 MET B 13 35.714 25.775 1.438 1.00 0.00 H ATOM 2071 HE2 MET B 13 33.957 26.039 1.315 1.00 0.00 H ATOM 2072 HE3 MET B 13 35.054 26.770 0.117 1.00 0.00 H ATOM 2073 H MET B 13 32.059 28.016 5.780 1.00 0.00 H ATOM 2074 N ASP B 14 30.649 26.130 2.341 1.00 8.82 N ATOM 2075 CA ASP B 14 29.704 25.075 1.992 1.00 8.93 C ATOM 2076 C ASP B 14 30.028 24.542 0.598 1.00 9.20 C ATOM 2077 O ASP B 14 29.249 24.700 -0.349 1.00 8.57 O ATOM 2078 CB ASP B 14 28.243 25.546 2.090 1.00 8.74 C ATOM 2079 CG ASP B 14 27.249 24.390 1.997 1.00 9.02 C ATOM 2080 OD1 ASP B 14 27.685 23.225 2.160 1.00 9.19 O ATOM 2081 OD2 ASP B 14 26.034 24.640 1.779 1.00 9.22 O ATOM 2082 HA ASP B 14 29.811 24.267 2.716 1.00 0.00 H ATOM 2083 HB2 ASP B 14 28.102 26.053 3.045 1.00 0.00 H ATOM 2084 HB3 ASP B 14 28.045 26.244 1.277 1.00 0.00 H ATOM 2085 H ASP B 14 30.978 26.780 1.599 1.00 0.00 H ATOM 2086 N SER B 15 31.195 23.911 0.498 1.00 10.62 N ATOM 2087 CA SER B 15 31.699 23.352 -0.761 1.00 12.20 C ATOM 2088 C SER B 15 30.853 22.208 -1.306 1.00 12.49 C ATOM 2089 O SER B 15 30.774 22.011 -2.519 1.00 13.02 O ATOM 2090 CB SER B 15 33.133 22.838 -0.572 1.00 11.80 C ATOM 2091 OG SER B 15 33.932 23.811 0.081 1.00 15.50 O ATOM 2092 HA SER B 15 31.658 24.168 -1.483 1.00 0.00 H ATOM 2093 HB2 SER B 15 33.565 22.616 -1.548 1.00 0.00 H ATOM 2094 HB3 SER B 15 33.111 21.930 0.030 1.00 0.00 H ATOM 2095 HG SER B 15 33.957 24.637 -0.465 1.00 0.00 H ATOM 2096 H SER B 15 31.778 23.809 1.353 1.00 0.00 H ATOM 2097 N GLY B 16 30.221 21.459 -0.407 1.00 13.14 N ATOM 2098 CA GLY B 16 29.595 20.204 -0.782 1.00 13.39 C ATOM 2099 C GLY B 16 28.113 20.263 -1.083 1.00 13.93 C ATOM 2100 O GLY B 16 27.517 19.240 -1.415 1.00 13.50 O ATOM 2101 HA3 GLY B 16 29.741 19.501 0.038 1.00 0.00 H ATOM 2102 HA2 GLY B 16 30.101 19.832 -1.673 1.00 0.00 H ATOM 2103 H GLY B 16 30.174 21.778 0.582 1.00 0.00 H ATOM 2104 N ASN B 17 27.514 21.445 -0.968 1.00 13.93 N ATOM 2105 CA ASN B 17 26.058 21.602 -1.145 1.00 15.38 C ATOM 2106 C ASN B 17 25.745 22.934 -1.814 1.00 16.07 C ATOM 2107 O ASN B 17 26.628 23.772 -1.979 1.00 16.24 O ATOM 2108 CB ASN B 17 25.328 21.557 0.209 1.00 15.30 C ATOM 2109 CG ASN B 17 25.679 20.332 1.039 1.00 16.33 C ATOM 2110 OD1 ASN B 17 25.122 19.244 0.852 1.00 16.92 O ATOM 2111 ND2 ASN B 17 26.588 20.515 1.993 1.00 18.96 N ATOM 2112 HA ASN B 17 25.715 20.778 -1.770 1.00 0.00 H ATOM 2113 HB2 ASN B 17 25.595 22.448 0.777 1.00 0.00 H ATOM 2114 HB3 ASN B 17 24.254 21.554 0.024 1.00 0.00 H ATOM 2115 HD22 ASN B 17 27.032 21.447 2.116 1.00 0.00 H ATOM 2116 HD21 ASN B 17 26.854 19.726 2.616 1.00 0.00 H ATOM 2117 H ASN B 17 28.089 22.283 -0.747 1.00 0.00 H ATOM 2118 N SER B 18 24.484 23.134 -2.189 1.00 16.77 N ATOM 2119 CA SER B 18 24.025 24.450 -2.642 1.00 17.09 C ATOM 2120 C SER B 18 22.572 24.660 -2.222 1.00 16.86 C ATOM 2121 O SER B 18 21.882 23.678 -1.912 1.00 16.50 O ATOM 2122 CB SER B 18 24.168 24.589 -4.160 1.00 17.40 C ATOM 2123 OG SER B 18 23.014 24.099 -4.826 1.00 18.39 O ATOM 2124 HA SER B 18 24.647 25.215 -2.177 1.00 0.00 H ATOM 2125 HB2 SER B 18 25.038 24.022 -4.490 1.00 0.00 H ATOM 2126 HB3 SER B 18 24.305 25.641 -4.411 1.00 0.00 H ATOM 2127 HG SER B 18 23.131 24.200 -5.804 1.00 0.00 H ATOM 2128 H SER B 18 23.811 22.341 -2.160 1.00 0.00 H ATOM 2129 N PRO B 19 22.107 25.931 -2.191 1.00 16.88 N ATOM 2130 CA PRO B 19 20.709 26.244 -1.859 1.00 17.19 C ATOM 2131 C PRO B 19 19.676 25.523 -2.705 1.00 17.43 C ATOM 2132 O PRO B 19 18.607 25.178 -2.196 1.00 17.58 O ATOM 2133 CB PRO B 19 20.613 27.746 -2.142 1.00 17.27 C ATOM 2134 CG PRO B 19 21.980 28.243 -1.930 1.00 17.30 C ATOM 2135 CD PRO B 19 22.885 27.165 -2.439 1.00 16.79 C ATOM 2136 HA PRO B 19 20.490 25.935 -0.837 1.00 0.00 H ATOM 2137 HD3 PRO B 19 23.088 27.293 -3.502 1.00 0.00 H ATOM 2138 HD2 PRO B 19 23.826 27.152 -1.890 1.00 0.00 H ATOM 2139 HG3 PRO B 19 22.160 28.422 -0.870 1.00 0.00 H ATOM 2140 HG2 PRO B 19 22.139 29.167 -2.485 1.00 0.00 H ATOM 2141 HB2 PRO B 19 20.291 27.926 -3.168 1.00 0.00 H ATOM 2142 HB3 PRO B 19 19.916 28.225 -1.454 1.00 0.00 H ATOM 2143 N SER B 20 19.986 25.303 -3.982 1.00 17.88 N ATOM 2144 CA SER B 20 19.004 24.788 -4.939 1.00 18.57 C ATOM 2145 C SER B 20 18.552 23.372 -4.623 1.00 19.02 C ATOM 2146 O SER B 20 17.531 22.916 -5.139 1.00 19.26 O ATOM 2147 CB SER B 20 19.552 24.855 -6.364 1.00 18.44 C ATOM 2148 OG SER B 20 20.677 24.009 -6.510 1.00 18.54 O ATOM 2149 HA SER B 20 18.128 25.431 -4.854 1.00 0.00 H ATOM 2150 HB2 SER B 20 19.845 25.881 -6.587 1.00 0.00 H ATOM 2151 HB3 SER B 20 18.775 24.541 -7.061 1.00 0.00 H ATOM 2152 HG SER B 20 21.386 24.294 -5.881 1.00 0.00 H ATOM 2153 H SER B 20 20.953 25.503 -4.309 1.00 0.00 H ATOM 2154 N SER B 21 19.312 22.680 -3.779 1.00 19.80 N ATOM 2155 CA SER B 21 18.932 21.341 -3.357 1.00 20.40 C ATOM 2156 C SER B 21 17.669 21.331 -2.508 1.00 20.21 C ATOM 2157 O SER B 21 17.363 22.298 -1.799 1.00 20.89 O ATOM 2158 CB SER B 21 20.052 20.676 -2.573 1.00 20.34 C ATOM 2159 OG SER B 21 19.571 19.474 -1.989 1.00 22.17 O ATOM 2160 HA SER B 21 18.736 20.784 -4.273 1.00 0.00 H ATOM 2161 HB2 SER B 21 20.396 21.349 -1.788 1.00 0.00 H ATOM 2162 HB3 SER B 21 20.880 20.448 -3.244 1.00 0.00 H ATOM 2163 HG SER B 21 18.819 19.682 -1.380 1.00 0.00 H ATOM 2164 H SER B 21 20.190 23.102 -3.416 1.00 0.00 H ATOM 2165 N SER B 22 16.954 20.219 -2.585 1.00 19.77 N ATOM 2166 CA SER B 22 15.815 19.951 -1.722 1.00 19.11 C ATOM 2167 C SER B 22 16.180 18.789 -0.803 1.00 18.06 C ATOM 2168 O SER B 22 15.601 18.627 0.274 1.00 18.41 O ATOM 2169 CB SER B 22 14.589 19.590 -2.558 1.00 19.68 C ATOM 2170 OG SER B 22 14.243 20.645 -3.439 1.00 21.49 O ATOM 2171 HA SER B 22 15.575 20.838 -1.135 1.00 0.00 H ATOM 2172 HB2 SER B 22 13.749 19.392 -1.892 1.00 0.00 H ATOM 2173 HB3 SER B 22 14.807 18.695 -3.142 1.00 0.00 H ATOM 2174 HG SER B 22 13.447 20.385 -3.967 1.00 0.00 H ATOM 2175 H SER B 22 17.219 19.506 -3.294 1.00 0.00 H ATOM 2176 N SER B 23 17.155 17.995 -1.245 1.00 16.56 N ATOM 2177 CA SER B 23 17.547 16.757 -0.579 1.00 15.05 C ATOM 2178 C SER B 23 18.419 16.973 0.659 1.00 14.04 C ATOM 2179 O SER B 23 18.624 16.056 1.451 1.00 13.72 O ATOM 2180 CB SER B 23 18.263 15.831 -1.577 1.00 15.24 C ATOM 2181 OG SER B 23 19.484 16.394 -2.035 1.00 15.87 O ATOM 2182 HA SER B 23 16.627 16.292 -0.224 1.00 0.00 H ATOM 2183 HB2 SER B 23 17.609 15.661 -2.433 1.00 0.00 H ATOM 2184 HB3 SER B 23 18.474 14.880 -1.088 1.00 0.00 H ATOM 2185 HG SER B 23 20.086 16.546 -1.264 1.00 0.00 H ATOM 2186 H SER B 23 17.663 18.272 -2.109 1.00 0.00 H ATOM 2187 N ASN B 24 18.935 18.189 0.815 1.00 12.29 N ATOM 2188 CA ASN B 24 19.824 18.522 1.922 1.00 11.11 C ATOM 2189 C ASN B 24 19.047 18.986 3.161 1.00 10.22 C ATOM 2190 O ASN B 24 19.636 19.213 4.216 1.00 10.17 O ATOM 2191 CB ASN B 24 20.807 19.604 1.464 1.00 10.95 C ATOM 2192 CG ASN B 24 22.023 19.739 2.369 1.00 11.92 C ATOM 2193 OD1 ASN B 24 22.523 18.764 2.932 1.00 12.65 O ATOM 2194 ND2 ASN B 24 22.529 20.961 2.480 1.00 12.34 N ATOM 2195 HA ASN B 24 20.370 17.624 2.210 1.00 0.00 H ATOM 2196 HB2 ASN B 24 21.150 19.357 0.459 1.00 0.00 H ATOM 2197 HB3 ASN B 24 20.284 20.560 1.443 1.00 0.00 H ATOM 2198 HD22 ASN B 24 22.076 21.758 1.988 1.00 0.00 H ATOM 2199 HD21 ASN B 24 23.378 21.122 3.059 1.00 0.00 H ATOM 2200 H ASN B 24 18.696 18.928 0.123 1.00 0.00 H ATOM 2201 N TYR B 25 17.726 19.104 3.033 1.00 9.49 N ATOM 2202 CA TYR B 25 16.870 19.598 4.134 1.00 8.93 C ATOM 2203 C TYR B 25 17.129 18.920 5.471 1.00 9.24 C ATOM 2204 O TYR B 25 17.392 19.584 6.475 1.00 9.02 O ATOM 2205 CB TYR B 25 15.386 19.441 3.781 1.00 8.20 C ATOM 2206 CG TYR B 25 14.449 19.807 4.918 1.00 7.57 C ATOM 2207 CD1 TYR B 25 14.043 21.125 5.124 1.00 7.15 C ATOM 2208 CD2 TYR B 25 13.980 18.836 5.788 1.00 7.01 C ATOM 2209 CE1 TYR B 25 13.183 21.460 6.166 1.00 6.47 C ATOM 2210 CE2 TYR B 25 13.139 19.160 6.819 1.00 7.19 C ATOM 2211 CZ TYR B 25 12.736 20.464 7.009 1.00 7.20 C ATOM 2212 OH TYR B 25 11.882 20.735 8.054 1.00 8.88 O ATOM 2213 HA TYR B 25 17.131 20.650 4.248 1.00 0.00 H ATOM 2214 HB3 TYR B 25 15.205 18.402 3.506 1.00 0.00 H ATOM 2215 HB2 TYR B 25 15.164 20.085 2.930 1.00 0.00 H ATOM 2216 HD2 TYR B 25 14.285 17.799 5.650 1.00 0.00 H ATOM 2217 HE2 TYR B 25 12.786 18.381 7.494 1.00 0.00 H ATOM 2218 HE1 TYR B 25 12.868 22.493 6.313 1.00 0.00 H ATOM 2219 HD1 TYR B 25 14.406 21.907 4.457 1.00 0.00 H ATOM 2220 HH TYR B 25 11.679 21.704 8.070 1.00 0.00 H ATOM 2221 H TYR B 25 17.282 18.840 2.130 1.00 0.00 H ATOM 2222 N CYS B 26 17.030 17.597 5.490 1.00 9.33 N ATOM 2223 CA CYS B 26 17.242 16.870 6.734 1.00 9.54 C ATOM 2224 C CYS B 26 18.644 17.066 7.300 1.00 9.42 C ATOM 2225 O CYS B 26 18.802 17.252 8.496 1.00 9.84 O ATOM 2226 CB CYS B 26 16.948 15.388 6.538 1.00 9.73 C ATOM 2227 SG CYS B 26 15.197 15.054 6.378 1.00 9.97 S ATOM 2228 HA CYS B 26 16.547 17.283 7.465 1.00 0.00 H ATOM 2229 HB2 CYS B 26 17.332 14.838 7.397 1.00 0.00 H ATOM 2230 HB3 CYS B 26 17.453 15.047 5.634 1.00 0.00 H ATOM 2231 H CYS B 26 16.801 17.080 4.617 1.00 0.00 H ATOM 2232 N ASN B 27 19.668 17.043 6.454 1.00 9.33 N ATOM 2233 CA ASN B 27 21.018 17.290 6.951 1.00 9.60 C ATOM 2234 C ASN B 27 21.109 18.598 7.726 1.00 9.58 C ATOM 2235 O ASN B 27 21.694 18.657 8.808 1.00 10.48 O ATOM 2236 CB ASN B 27 22.017 17.316 5.800 1.00 9.38 C ATOM 2237 CG ASN B 27 22.231 15.953 5.185 1.00 10.36 C ATOM 2238 OD1 ASN B 27 22.051 14.923 5.835 1.00 11.62 O ATOM 2239 ND2 ASN B 27 22.614 15.941 3.918 1.00 10.27 N ATOM 2240 HA ASN B 27 21.261 16.472 7.630 1.00 0.00 H ATOM 2241 HB2 ASN B 27 21.645 17.992 5.030 1.00 0.00 H ATOM 2242 HB3 ASN B 27 22.972 17.684 6.175 1.00 0.00 H ATOM 2243 HD22 ASN B 27 22.754 16.837 3.408 1.00 0.00 H ATOM 2244 HD21 ASN B 27 22.775 15.036 3.432 1.00 0.00 H ATOM 2245 H ASN B 27 19.509 16.850 5.444 1.00 0.00 H ATOM 2246 N LEU B 28 20.515 19.643 7.164 1.00 9.31 N ATOM 2247 CA LEU B 28 20.580 20.965 7.761 1.00 9.30 C ATOM 2248 C LEU B 28 19.670 21.100 8.977 1.00 9.27 C ATOM 2249 O LEU B 28 20.070 21.666 9.995 1.00 8.63 O ATOM 2250 CB LEU B 28 20.249 22.022 6.711 1.00 9.46 C ATOM 2251 CG LEU B 28 21.235 22.046 5.539 1.00 9.58 C ATOM 2252 CD1 LEU B 28 20.893 23.187 4.605 1.00 11.50 C ATOM 2253 CD2 LEU B 28 22.675 22.169 6.039 1.00 11.04 C ATOM 2254 HA LEU B 28 21.598 21.118 8.119 1.00 0.00 H ATOM 2255 HB2 LEU B 28 19.252 21.820 6.320 1.00 0.00 H ATOM 2256 HB3 LEU B 28 20.258 23.001 7.191 1.00 0.00 H ATOM 2257 HG LEU B 28 21.152 21.106 4.993 1.00 0.00 H ATOM 2258 HD21 LEU B 28 22.783 23.093 6.607 1.00 0.00 H ATOM 2259 HD22 LEU B 28 22.910 21.318 6.678 1.00 0.00 H ATOM 2260 HD23 LEU B 28 23.354 22.184 5.187 1.00 0.00 H ATOM 2261 HD11 LEU B 28 19.881 23.051 4.223 1.00 0.00 H ATOM 2262 HD12 LEU B 28 20.954 24.130 5.148 1.00 0.00 H ATOM 2263 HD13 LEU B 28 21.598 23.198 3.774 1.00 0.00 H ATOM 2264 H LEU B 28 19.991 19.512 6.275 1.00 0.00 H ATOM 2265 N MET B 29 18.455 20.568 8.870 1.00 9.05 N ATOM 2266 CA MET B 29 17.479 20.672 9.952 1.00 10.15 C ATOM 2267 C MET B 29 17.837 19.835 11.177 1.00 9.19 C ATOM 2268 O MET B 29 17.645 20.277 12.317 1.00 9.38 O ATOM 2269 CB MET B 29 16.073 20.335 9.455 1.00 10.93 C ATOM 2270 CG MET B 29 15.291 21.568 9.047 1.00 14.20 C ATOM 2271 SD MET B 29 15.074 22.762 10.391 1.00 16.35 S ATOM 2272 CE MET B 29 13.508 22.221 11.069 1.00 18.09 C ATOM 2273 HA MET B 29 17.500 21.712 10.278 1.00 0.00 H ATOM 2274 HB2 MET B 29 16.156 19.672 8.594 1.00 0.00 H ATOM 2275 HB3 MET B 29 15.532 19.826 10.253 1.00 0.00 H ATOM 2276 HG2 MET B 29 14.306 21.254 8.702 1.00 0.00 H ATOM 2277 HG3 MET B 29 15.821 22.059 8.231 1.00 0.00 H ATOM 2278 HE1 MET B 29 12.739 22.284 10.299 1.00 0.00 H ATOM 2279 HE2 MET B 29 13.598 21.190 11.410 1.00 0.00 H ATOM 2280 HE3 MET B 29 13.237 22.861 11.909 1.00 0.00 H ATOM 2281 H MET B 29 18.194 20.067 7.997 1.00 0.00 H ATOM 2282 N MET B 30 18.351 18.629 10.951 1.00 9.09 N ATOM 2283 CA MET B 30 18.798 17.796 12.067 1.00 9.34 C ATOM 2284 C MET B 30 19.938 18.472 12.803 1.00 9.23 C ATOM 2285 O MET B 30 20.025 18.405 14.023 1.00 9.69 O ATOM 2286 CB MET B 30 19.196 16.390 11.603 1.00 9.41 C ATOM 2287 CG MET B 30 18.026 15.594 11.047 1.00 9.06 C ATOM 2288 SD MET B 30 16.768 15.203 12.275 1.00 8.65 S ATOM 2289 CE MET B 30 17.563 13.811 13.101 1.00 6.10 C ATOM 2290 HA MET B 30 17.961 17.679 12.755 1.00 0.00 H ATOM 2291 HB2 MET B 30 19.954 16.482 10.826 1.00 0.00 H ATOM 2292 HB3 MET B 30 19.612 15.849 12.452 1.00 0.00 H ATOM 2293 HG2 MET B 30 18.409 14.660 10.637 1.00 0.00 H ATOM 2294 HG3 MET B 30 17.561 16.175 10.251 1.00 0.00 H ATOM 2295 HE1 MET B 30 17.741 13.015 12.378 1.00 0.00 H ATOM 2296 HE2 MET B 30 18.513 14.136 13.526 1.00 0.00 H ATOM 2297 HE3 MET B 30 16.914 13.443 13.896 1.00 0.00 H ATOM 2298 H MET B 30 18.435 18.277 9.976 1.00 0.00 H ATOM 2299 N CYS B 31 20.802 19.146 12.044 1.00 9.45 N ATOM 2300 CA CYS B 31 21.872 19.937 12.627 1.00 9.18 C ATOM 2301 C CYS B 31 21.312 21.152 13.386 1.00 9.27 C ATOM 2302 O CYS B 31 21.609 21.354 14.575 1.00 9.56 O ATOM 2303 CB CYS B 31 22.842 20.362 11.529 1.00 8.82 C ATOM 2304 SG CYS B 31 24.009 21.616 12.031 1.00 9.11 S ATOM 2305 HA CYS B 31 22.411 19.330 13.354 1.00 0.00 H ATOM 2306 HB2 CYS B 31 22.262 20.749 10.691 1.00 0.00 H ATOM 2307 HB3 CYS B 31 23.401 19.483 11.207 1.00 0.00 H ATOM 2308 H CYS B 31 20.708 19.105 11.009 1.00 0.00 H ATOM 2309 N CYS B 32 20.477 21.932 12.699 1.00 9.06 N ATOM 2310 CA CYS B 32 19.874 23.131 13.268 1.00 8.83 C ATOM 2311 C CYS B 32 19.178 22.849 14.594 1.00 9.02 C ATOM 2312 O CYS B 32 19.362 23.585 15.563 1.00 9.15 O ATOM 2313 CB CYS B 32 18.878 23.731 12.269 1.00 8.81 C ATOM 2314 SG CYS B 32 17.798 24.985 12.959 1.00 9.23 S ATOM 2315 HA CYS B 32 20.675 23.843 13.467 1.00 0.00 H ATOM 2316 HB2 CYS B 32 18.258 22.924 11.880 1.00 0.00 H ATOM 2317 HB3 CYS B 32 19.443 24.180 11.452 1.00 0.00 H ATOM 2318 H CYS B 32 20.247 21.675 11.718 1.00 0.00 H ATOM 2319 N ARG B 33 18.397 21.770 14.620 1.00 8.82 N ATOM 2320 CA ARG B 33 17.553 21.422 15.768 1.00 9.05 C ATOM 2321 C ARG B 33 18.248 20.510 16.779 1.00 9.47 C ATOM 2322 O ARG B 33 17.603 19.935 17.657 1.00 9.51 O ATOM 2323 CB ARG B 33 16.235 20.816 15.277 1.00 8.67 C ATOM 2324 CG ARG B 33 15.430 21.757 14.381 1.00 9.19 C ATOM 2325 CD ARG B 33 15.023 23.041 15.113 1.00 8.12 C ATOM 2326 NE ARG B 33 14.120 23.885 14.325 1.00 9.74 N ATOM 2327 CZ ARG B 33 12.808 23.686 14.178 1.00 9.56 C ATOM 2328 NH1 ARG B 33 12.216 22.652 14.762 1.00 9.50 N ATOM 2329 NH2 ARG B 33 12.082 24.523 13.433 1.00 10.03 N ATOM 2330 HA ARG B 33 17.346 22.346 16.309 1.00 0.00 H ATOM 2331 HB2 ARG B 33 16.460 19.910 14.714 1.00 0.00 H ATOM 2332 HB3 ARG B 33 15.627 20.561 16.145 1.00 0.00 H ATOM 2333 HG2 ARG B 33 16.036 22.023 13.515 1.00 0.00 H ATOM 2334 HG3 ARG B 33 14.529 21.241 14.048 1.00 0.00 H ATOM 2335 HD2 ARG B 33 15.923 23.612 15.341 1.00 0.00 H ATOM 2336 HD3 ARG B 33 14.522 22.768 16.042 1.00 0.00 H ATOM 2337 HE ARG B 33 14.535 24.706 13.841 1.00 0.00 H ATOM 2338 HH12 ARG B 33 11.194 22.503 14.643 1.00 0.00 H ATOM 2339 HH11 ARG B 33 12.774 21.991 15.338 1.00 0.00 H ATOM 2340 HH22 ARG B 33 11.060 24.366 13.320 1.00 0.00 H ATOM 2341 HH21 ARG B 33 12.538 25.332 12.966 1.00 0.00 H ATOM 2342 H ARG B 33 18.385 21.146 13.788 1.00 0.00 H ATOM 2343 N LYS B 34 19.569 20.393 16.644 1.00 9.68 N ATOM 2344 CA LYS B 34 20.438 19.793 17.668 1.00 10.87 C ATOM 2345 C LYS B 34 20.151 18.309 17.929 1.00 10.76 C ATOM 2346 O LYS B 34 20.110 17.855 19.083 1.00 11.78 O ATOM 2347 CB LYS B 34 20.384 20.609 18.965 1.00 10.58 C ATOM 2348 CG LYS B 34 20.661 22.098 18.765 1.00 11.82 C ATOM 2349 CD LYS B 34 20.622 22.856 20.077 1.00 11.97 C ATOM 2350 CE LYS B 34 20.835 24.346 19.844 1.00 14.72 C ATOM 2351 NZ LYS B 34 21.003 25.095 21.121 1.00 16.03 N ATOM 2352 HA LYS B 34 21.452 19.827 17.269 1.00 0.00 H ATOM 2353 HB2 LYS B 34 19.391 20.499 19.400 1.00 0.00 H ATOM 2354 HB3 LYS B 34 21.128 20.210 19.654 1.00 0.00 H ATOM 2355 HG2 LYS B 34 21.647 22.217 18.317 1.00 0.00 H ATOM 2356 HG3 LYS B 34 19.907 22.511 18.095 1.00 0.00 H ATOM 2357 HD2 LYS B 34 19.652 22.703 20.551 1.00 0.00 H ATOM 2358 HD3 LYS B 34 21.408 22.480 20.732 1.00 0.00 H ATOM 2359 HE2 LYS B 34 19.971 24.746 19.313 1.00 0.00 H ATOM 2360 HE3 LYS B 34 21.729 24.483 19.236 1.00 0.00 H ATOM 2361 HZ1 LYS B 34 20.151 24.977 21.706 1.00 0.00 H ATOM 2362 HZ2 LYS B 34 21.830 24.725 21.632 1.00 0.00 H ATOM 2363 HZ3 LYS B 34 21.145 26.104 20.913 1.00 0.00 H ATOM 2364 H LYS B 34 20.008 20.744 15.769 1.00 0.00 H ATOM 2365 N MET B 35 19.978 17.557 16.846 1.00 11.21 N ATOM 2366 CA MET B 35 19.785 16.114 16.928 1.00 11.61 C ATOM 2367 C MET B 35 20.967 15.345 16.333 1.00 12.68 C ATOM 2368 O MET B 35 20.858 14.148 16.057 1.00 12.80 O ATOM 2369 CB MET B 35 18.471 15.711 16.263 1.00 11.23 C ATOM 2370 CG MET B 35 17.261 15.939 17.154 1.00 10.46 C ATOM 2371 SD MET B 35 15.676 15.822 16.295 1.00 10.31 S ATOM 2372 CE MET B 35 15.653 17.383 15.412 1.00 8.57 C ATOM 2373 HA MET B 35 19.732 15.846 17.983 1.00 0.00 H ATOM 2374 HB2 MET B 35 18.348 16.297 15.352 1.00 0.00 H ATOM 2375 HB3 MET B 35 18.521 14.652 16.008 1.00 0.00 H ATOM 2376 HG2 MET B 35 17.341 16.934 17.591 1.00 0.00 H ATOM 2377 HG3 MET B 35 17.276 15.193 17.948 1.00 0.00 H ATOM 2378 HE1 MET B 35 15.702 18.204 16.127 1.00 0.00 H ATOM 2379 HE2 MET B 35 16.510 17.432 14.741 1.00 0.00 H ATOM 2380 HE3 MET B 35 14.732 17.458 14.833 1.00 0.00 H ATOM 2381 H MET B 35 19.980 18.012 15.911 1.00 0.00 H ATOM 2382 N THR B 36 22.090 16.038 16.157 1.00 14.39 N ATOM 2383 CA THR B 36 23.307 15.436 15.605 1.00 15.89 C ATOM 2384 C THR B 36 24.512 15.578 16.539 1.00 16.84 C ATOM 2385 O THR B 36 25.662 15.391 16.121 1.00 17.30 O ATOM 2386 CB THR B 36 23.672 16.035 14.227 1.00 15.96 C ATOM 2387 OG1 THR B 36 23.842 17.453 14.344 1.00 15.90 O ATOM 2388 CG2 THR B 36 22.596 15.741 13.190 1.00 17.09 C ATOM 2389 HA THR B 36 23.078 14.376 15.492 1.00 0.00 H ATOM 2390 HB THR B 36 24.603 15.573 13.897 1.00 0.00 H ATOM 2391 HG1 THR B 36 24.075 17.830 13.459 1.00 0.00 H ATOM 2392 HG23 THR B 36 22.465 14.663 13.100 1.00 0.00 H ATOM 2393 HG21 THR B 36 21.657 16.197 13.503 1.00 0.00 H ATOM 2394 HG22 THR B 36 22.898 16.154 12.227 1.00 0.00 H ATOM 2395 H THR B 36 22.104 17.044 16.421 1.00 0.00 H ATOM 2396 N GLN B 37 24.247 15.905 17.800 1.00 17.80 N ATOM 2397 CA GLN B 37 25.309 16.069 18.791 1.00 18.71 C ATOM 2398 C GLN B 37 25.442 14.814 19.655 1.00 18.77 C ATOM 2399 O GLN B 37 24.451 14.314 20.191 1.00 18.92 O ATOM 2400 CB GLN B 37 25.054 17.312 19.651 1.00 18.79 C ATOM 2401 CG GLN B 37 24.982 18.615 18.842 1.00 19.61 C ATOM 2402 CD GLN B 37 24.704 19.846 19.692 1.00 19.35 C ATOM 2403 OE1 GLN B 37 25.296 20.907 19.475 1.00 20.87 O ATOM 2404 NE2 GLN B 37 23.805 19.714 20.665 1.00 20.14 N ATOM 2405 HA GLN B 37 26.253 16.212 18.266 1.00 0.00 H ATOM 2406 HB2 GLN B 37 24.108 17.180 20.177 1.00 0.00 H ATOM 2407 HB3 GLN B 37 25.862 17.401 20.377 1.00 0.00 H ATOM 2408 HG2 GLN B 37 25.934 18.757 18.331 1.00 0.00 H ATOM 2409 HG3 GLN B 37 24.186 18.519 18.104 1.00 0.00 H ATOM 2410 HE22 GLN B 37 23.329 18.801 20.813 1.00 0.00 H ATOM 2411 HE21 GLN B 37 23.578 20.524 21.277 1.00 0.00 H ATOM 2412 H GLN B 37 23.258 16.048 18.089 1.00 0.00 H ATOM 2413 N GLY B 38 26.667 14.305 19.766 1.00 18.92 N ATOM 2414 CA GLY B 38 26.943 13.063 20.495 1.00 19.03 C ATOM 2415 C GLY B 38 26.814 11.837 19.606 1.00 19.05 C ATOM 2416 O GLY B 38 27.703 10.981 19.576 1.00 18.95 O ATOM 2417 HA3 GLY B 38 26.236 12.975 21.320 1.00 0.00 H ATOM 2418 HA2 GLY B 38 27.958 13.105 20.890 1.00 0.00 H ATOM 2419 H GLY B 38 27.459 14.808 19.318 1.00 0.00 H ATOM 2420 N LYS B 39 25.689 11.759 18.896 1.00 19.08 N ATOM 2421 CA LYS B 39 25.421 10.722 17.899 1.00 19.14 C ATOM 2422 C LYS B 39 24.360 11.235 16.923 1.00 18.66 C ATOM 2423 O LYS B 39 23.695 12.243 17.187 1.00 18.57 O ATOM 2424 CB LYS B 39 24.943 9.421 18.558 1.00 19.38 C ATOM 2425 CG LYS B 39 23.621 9.546 19.292 1.00 20.89 C ATOM 2426 CD LYS B 39 22.906 8.213 19.423 1.00 23.49 C ATOM 2427 CE LYS B 39 21.432 8.438 19.718 1.00 24.68 C ATOM 2428 NZ LYS B 39 20.728 7.179 20.086 1.00 26.49 N ATOM 2429 HA LYS B 39 26.346 10.501 17.367 1.00 0.00 H ATOM 2430 HB2 LYS B 39 24.833 8.664 17.781 1.00 0.00 H ATOM 2431 HB3 LYS B 39 25.702 9.100 19.272 1.00 0.00 H ATOM 2432 HG2 LYS B 39 23.810 9.942 20.290 1.00 0.00 H ATOM 2433 HG3 LYS B 39 22.979 10.236 18.744 1.00 0.00 H ATOM 2434 HD2 LYS B 39 23.007 7.656 18.491 1.00 0.00 H ATOM 2435 HD3 LYS B 39 23.354 7.642 20.236 1.00 0.00 H ATOM 2436 HE2 LYS B 39 20.957 8.858 18.831 1.00 0.00 H ATOM 2437 HE3 LYS B 39 21.344 9.143 20.545 1.00 0.00 H ATOM 2438 HZ1 LYS B 39 20.799 6.501 19.300 1.00 0.00 H ATOM 2439 HZ2 LYS B 39 21.168 6.773 20.936 1.00 0.00 H ATOM 2440 HZ3 LYS B 39 19.727 7.386 20.277 1.00 0.00 H ATOM 2441 H LYS B 39 24.957 12.479 19.061 1.00 0.00 H ATOM 2442 N CYS B 40 24.197 10.546 15.798 1.00 18.26 N ATOM 2443 CA CYS B 40 23.154 10.913 14.851 1.00 17.68 C ATOM 2444 C CYS B 40 21.845 10.269 15.276 1.00 17.06 C ATOM 2445 O CYS B 40 21.742 9.041 15.354 1.00 17.01 O ATOM 2446 CB CYS B 40 23.504 10.481 13.427 1.00 17.67 C ATOM 2447 SG CYS B 40 25.179 10.864 12.890 1.00 18.52 S ATOM 2448 HA CYS B 40 23.059 11.999 14.852 1.00 0.00 H ATOM 2449 HB2 CYS B 40 22.811 10.976 12.746 1.00 0.00 H ATOM 2450 HB3 CYS B 40 23.368 9.402 13.360 1.00 0.00 H ATOM 2451 H CYS B 40 24.819 9.738 15.593 1.00 0.00 H ATOM 2452 N LYS B 41 20.844 11.091 15.573 1.00 16.05 N ATOM 2453 CA LYS B 41 19.522 10.549 15.832 1.00 15.11 C ATOM 2454 C LYS B 41 19.116 9.803 14.562 1.00 14.51 C ATOM 2455 O LYS B 41 19.121 10.394 13.477 1.00 15.07 O ATOM 2456 CB LYS B 41 18.527 11.665 16.154 1.00 15.58 C ATOM 2457 CG LYS B 41 17.127 11.161 16.443 1.00 15.76 C ATOM 2458 CD LYS B 41 16.242 12.252 16.981 1.00 15.06 C ATOM 2459 CE LYS B 41 14.865 11.707 17.337 1.00 14.03 C ATOM 2460 NZ LYS B 41 13.955 12.783 17.783 1.00 13.67 N ATOM 2461 HA LYS B 41 19.528 9.884 16.696 1.00 0.00 H ATOM 2462 HB2 LYS B 41 18.887 12.207 17.029 1.00 0.00 H ATOM 2463 HB3 LYS B 41 18.481 12.343 15.302 1.00 0.00 H ATOM 2464 HG2 LYS B 41 16.692 10.776 15.520 1.00 0.00 H ATOM 2465 HG3 LYS B 41 17.185 10.358 17.178 1.00 0.00 H ATOM 2466 HD2 LYS B 41 16.700 12.676 17.874 1.00 0.00 H ATOM 2467 HD3 LYS B 41 16.134 13.030 16.225 1.00 0.00 H ATOM 2468 HE2 LYS B 41 14.970 10.976 18.139 1.00 0.00 H ATOM 2469 HE3 LYS B 41 14.438 11.223 16.459 1.00 0.00 H ATOM 2470 HZ1 LYS B 41 14.354 13.246 18.624 1.00 0.00 H ATOM 2471 HZ2 LYS B 41 13.846 13.482 17.020 1.00 0.00 H ATOM 2472 HZ3 LYS B 41 13.027 12.376 18.017 1.00 0.00 H ATOM 2473 H LYS B 41 21.007 12.117 15.620 1.00 0.00 H ATOM 2474 N PRO B 42 18.799 8.500 14.681 1.00 12.92 N ATOM 2475 CA PRO B 42 18.583 7.660 13.496 1.00 12.12 C ATOM 2476 C PRO B 42 17.373 8.046 12.651 1.00 11.19 C ATOM 2477 O PRO B 42 17.431 7.958 11.426 1.00 10.96 O ATOM 2478 CB PRO B 42 18.381 6.254 14.085 1.00 12.17 C ATOM 2479 CG PRO B 42 18.884 6.334 15.487 1.00 12.61 C ATOM 2480 CD PRO B 42 18.651 7.731 15.930 1.00 12.76 C ATOM 2481 HA PRO B 42 19.423 7.757 12.809 1.00 0.00 H ATOM 2482 HD3 PRO B 42 17.651 7.849 16.348 1.00 0.00 H ATOM 2483 HD2 PRO B 42 19.391 8.037 16.670 1.00 0.00 H ATOM 2484 HG3 PRO B 42 19.948 6.099 15.521 1.00 0.00 H ATOM 2485 HG2 PRO B 42 18.338 5.639 16.125 1.00 0.00 H ATOM 2486 HB2 PRO B 42 17.325 5.984 14.073 1.00 0.00 H ATOM 2487 HB3 PRO B 42 18.949 5.517 13.517 1.00 0.00 H ATOM 2488 N VAL B 43 16.281 8.440 13.303 1.00 10.13 N ATOM 2489 CA VAL B 43 15.035 8.706 12.601 1.00 9.32 C ATOM 2490 C VAL B 43 14.360 9.882 13.275 1.00 8.91 C ATOM 2491 O VAL B 43 14.230 9.907 14.495 1.00 8.29 O ATOM 2492 CB VAL B 43 14.074 7.485 12.637 1.00 9.69 C ATOM 2493 CG1 VAL B 43 12.818 7.759 11.812 1.00 10.71 C ATOM 2494 CG2 VAL B 43 14.767 6.234 12.124 1.00 10.02 C ATOM 2495 HA VAL B 43 15.263 8.917 11.556 1.00 0.00 H ATOM 2496 HB VAL B 43 13.784 7.322 13.675 1.00 0.00 H ATOM 2497 HG11 VAL B 43 12.300 8.627 12.219 1.00 0.00 H ATOM 2498 HG12 VAL B 43 13.100 7.955 10.777 1.00 0.00 H ATOM 2499 HG13 VAL B 43 12.161 6.890 11.853 1.00 0.00 H ATOM 2500 HG21 VAL B 43 15.091 6.395 11.096 1.00 0.00 H ATOM 2501 HG22 VAL B 43 15.633 6.018 12.749 1.00 0.00 H ATOM 2502 HG23 VAL B 43 14.072 5.395 12.160 1.00 0.00 H ATOM 2503 H VAL B 43 16.320 8.560 14.335 1.00 0.00 H ATOM 2504 N ASN B 44 13.931 10.853 12.477 1.00 8.19 N ATOM 2505 CA ASN B 44 13.191 11.980 13.016 1.00 7.87 C ATOM 2506 C ASN B 44 12.280 12.599 11.979 1.00 8.02 C ATOM 2507 O ASN B 44 12.664 12.753 10.825 1.00 8.20 O ATOM 2508 CB ASN B 44 14.138 13.049 13.557 1.00 8.09 C ATOM 2509 CG ASN B 44 13.408 14.134 14.311 1.00 9.47 C ATOM 2510 OD1 ASN B 44 12.953 13.923 15.438 1.00 9.55 O ATOM 2511 ND2 ASN B 44 13.289 15.303 13.697 1.00 7.93 N ATOM 2512 HA ASN B 44 12.579 11.594 13.831 1.00 0.00 H ATOM 2513 HB2 ASN B 44 14.854 12.576 14.229 1.00 0.00 H ATOM 2514 HB3 ASN B 44 14.671 13.501 12.721 1.00 0.00 H ATOM 2515 HD22 ASN B 44 13.689 15.434 12.746 1.00 0.00 H ATOM 2516 HD21 ASN B 44 12.795 16.089 14.166 1.00 0.00 H ATOM 2517 H ASN B 44 14.127 10.806 11.457 1.00 0.00 H ATOM 2518 N THR B 45 11.076 12.948 12.409 1.00 7.65 N ATOM 2519 CA THR B 45 10.077 13.530 11.528 1.00 7.20 C ATOM 2520 C THR B 45 9.832 14.998 11.861 1.00 7.42 C ATOM 2521 O THR B 45 9.677 15.370 13.037 1.00 7.41 O ATOM 2522 CB THR B 45 8.748 12.734 11.595 1.00 6.96 C ATOM 2523 OG1 THR B 45 9.010 11.366 11.259 1.00 7.24 O ATOM 2524 CG2 THR B 45 7.722 13.281 10.616 1.00 7.76 C ATOM 2525 HA THR B 45 10.464 13.473 10.511 1.00 0.00 H ATOM 2526 HB THR B 45 8.348 12.823 12.605 1.00 0.00 H ATOM 2527 HG1 THR B 45 9.384 11.318 10.344 1.00 0.00 H ATOM 2528 HG23 THR B 45 7.511 14.323 10.857 1.00 0.00 H ATOM 2529 HG21 THR B 45 8.117 13.215 9.602 1.00 0.00 H ATOM 2530 HG22 THR B 45 6.805 12.697 10.689 1.00 0.00 H ATOM 2531 H THR B 45 10.838 12.800 13.411 1.00 0.00 H ATOM 2532 N PHE B 46 9.817 15.822 10.814 1.00 7.06 N ATOM 2533 CA PHE B 46 9.384 17.210 10.937 1.00 7.18 C ATOM 2534 C PHE B 46 7.984 17.382 10.363 1.00 6.90 C ATOM 2535 O PHE B 46 7.659 16.829 9.319 1.00 7.47 O ATOM 2536 CB PHE B 46 10.368 18.156 10.250 1.00 7.30 C ATOM 2537 CG PHE B 46 11.714 18.192 10.907 1.00 7.13 C ATOM 2538 CD1 PHE B 46 11.925 18.957 12.062 1.00 6.28 C ATOM 2539 CD2 PHE B 46 12.777 17.454 10.389 1.00 6.06 C ATOM 2540 CE1 PHE B 46 13.174 18.981 12.677 1.00 6.24 C ATOM 2541 CE2 PHE B 46 14.020 17.460 11.009 1.00 7.24 C ATOM 2542 CZ PHE B 46 14.219 18.227 12.151 1.00 7.05 C ATOM 2543 HA PHE B 46 9.359 17.465 11.996 1.00 0.00 H ATOM 2544 HB2 PHE B 46 10.496 17.832 9.217 1.00 0.00 H ATOM 2545 HB3 PHE B 46 9.949 19.162 10.265 1.00 0.00 H ATOM 2546 HD2 PHE B 46 12.631 16.864 9.484 1.00 0.00 H ATOM 2547 HE2 PHE B 46 14.837 16.865 10.601 1.00 0.00 H ATOM 2548 HZ PHE B 46 15.195 18.238 12.636 1.00 0.00 H ATOM 2549 HE1 PHE B 46 13.333 19.589 13.568 1.00 0.00 H ATOM 2550 HD1 PHE B 46 11.104 19.538 12.483 1.00 0.00 H ATOM 2551 H PHE B 46 10.122 15.467 9.885 1.00 0.00 H ATOM 2552 N VAL B 47 7.164 18.152 11.060 1.00 6.66 N ATOM 2553 CA VAL B 47 5.790 18.392 10.643 1.00 6.52 C ATOM 2554 C VAL B 47 5.639 19.828 10.179 1.00 6.59 C ATOM 2555 O VAL B 47 6.088 20.760 10.856 1.00 6.79 O ATOM 2556 CB VAL B 47 4.792 18.120 11.807 1.00 6.24 C ATOM 2557 CG1 VAL B 47 3.362 18.334 11.338 1.00 6.60 C ATOM 2558 CG2 VAL B 47 4.948 16.689 12.342 1.00 7.74 C ATOM 2559 HA VAL B 47 5.561 17.709 9.825 1.00 0.00 H ATOM 2560 HB VAL B 47 5.017 18.820 12.611 1.00 0.00 H ATOM 2561 HG11 VAL B 47 3.242 19.363 10.999 1.00 0.00 H ATOM 2562 HG12 VAL B 47 3.145 17.652 10.516 1.00 0.00 H ATOM 2563 HG13 VAL B 47 2.677 18.140 12.164 1.00 0.00 H ATOM 2564 HG21 VAL B 47 4.751 15.979 11.539 1.00 0.00 H ATOM 2565 HG22 VAL B 47 5.964 16.549 12.712 1.00 0.00 H ATOM 2566 HG23 VAL B 47 4.239 16.527 13.154 1.00 0.00 H ATOM 2567 H VAL B 47 7.512 18.599 11.932 1.00 0.00 H ATOM 2568 N HIS B 48 4.990 20.002 9.031 1.00 6.75 N ATOM 2569 CA HIS B 48 4.889 21.313 8.388 1.00 6.72 C ATOM 2570 C HIS B 48 3.520 21.992 8.523 1.00 6.99 C ATOM 2571 O HIS B 48 3.317 23.137 8.068 1.00 6.96 O ATOM 2572 CB HIS B 48 5.332 21.191 6.932 1.00 6.72 C ATOM 2573 CG HIS B 48 6.657 20.514 6.787 1.00 6.84 C ATOM 2574 ND1 HIS B 48 7.798 20.986 7.401 1.00 7.37 N ATOM 2575 CD2 HIS B 48 7.014 19.371 6.157 1.00 6.75 C ATOM 2576 CE1 HIS B 48 8.807 20.177 7.131 1.00 8.93 C ATOM 2577 NE2 HIS B 48 8.356 19.186 6.386 1.00 8.05 N ATOM 2578 HA HIS B 48 5.560 21.984 8.925 1.00 0.00 H ATOM 2579 HB2 HIS B 48 4.584 20.615 6.387 1.00 0.00 H ATOM 2580 HB3 HIS B 48 5.402 22.191 6.504 1.00 0.00 H ATOM 2581 HD2 HIS B 48 6.360 18.720 5.577 1.00 0.00 H ATOM 2582 HE1 HIS B 48 9.836 20.306 7.466 1.00 0.00 H ATOM 2583 H HIS B 48 4.541 19.182 8.576 1.00 0.00 H ATOM 2584 N GLU B 49 2.591 21.287 9.170 1.00 7.06 N ATOM 2585 CA GLU B 49 1.302 21.863 9.528 1.00 7.26 C ATOM 2586 C GLU B 49 1.499 22.851 10.673 1.00 6.85 C ATOM 2587 O GLU B 49 2.588 22.924 11.266 1.00 6.76 O ATOM 2588 CB GLU B 49 0.312 20.753 9.907 1.00 7.51 C ATOM 2589 CG GLU B 49 0.171 19.660 8.833 1.00 7.96 C ATOM 2590 CD GLU B 49 -0.457 20.152 7.529 1.00 8.13 C ATOM 2591 OE1 GLU B 49 -1.116 21.218 7.515 1.00 9.76 O ATOM 2592 OE2 GLU B 49 -0.296 19.467 6.500 1.00 8.78 O ATOM 2593 HA GLU B 49 0.883 22.397 8.675 1.00 0.00 H ATOM 2594 HB2 GLU B 49 0.654 20.287 10.831 1.00 0.00 H ATOM 2595 HB3 GLU B 49 -0.667 21.205 10.070 1.00 0.00 H ATOM 2596 HG2 GLU B 49 1.163 19.267 8.610 1.00 0.00 H ATOM 2597 HG3 GLU B 49 -0.453 18.862 9.235 1.00 0.00 H ATOM 2598 H GLU B 49 2.792 20.299 9.426 1.00 0.00 H ATOM 2599 N SER B 50 0.456 23.620 10.979 1.00 6.92 N ATOM 2600 CA SER B 50 0.519 24.553 12.100 1.00 7.07 C ATOM 2601 C SER B 50 0.708 23.827 13.429 1.00 6.84 C ATOM 2602 O SER B 50 0.275 22.676 13.597 1.00 6.32 O ATOM 2603 CB SER B 50 -0.760 25.377 12.172 1.00 7.47 C ATOM 2604 OG SER B 50 -1.872 24.541 12.449 1.00 7.73 O ATOM 2605 HA SER B 50 1.378 25.202 11.930 1.00 0.00 H ATOM 2606 HB2 SER B 50 -0.917 25.880 11.218 1.00 0.00 H ATOM 2607 HB3 SER B 50 -0.664 26.121 12.963 1.00 0.00 H ATOM 2608 HG SER B 50 -2.694 25.091 12.492 1.00 0.00 H ATOM 2609 H SER B 50 -0.414 23.555 10.413 1.00 0.00 H ATOM 2610 N LEU B 51 1.324 24.520 14.383 1.00 6.49 N ATOM 2611 CA LEU B 51 1.435 24.001 15.739 1.00 6.50 C ATOM 2612 C LEU B 51 0.045 23.716 16.313 1.00 6.50 C ATOM 2613 O LEU B 51 -0.153 22.717 16.980 1.00 6.65 O ATOM 2614 CB LEU B 51 2.211 24.971 16.631 1.00 6.62 C ATOM 2615 CG LEU B 51 2.451 24.538 18.081 1.00 7.60 C ATOM 2616 CD1 LEU B 51 3.278 23.249 18.151 1.00 7.11 C ATOM 2617 CD2 LEU B 51 3.121 25.670 18.845 1.00 7.88 C ATOM 2618 HA LEU B 51 1.991 23.064 15.707 1.00 0.00 H ATOM 2619 HB2 LEU B 51 3.185 25.135 16.170 1.00 0.00 H ATOM 2620 HB3 LEU B 51 1.659 25.911 16.655 1.00 0.00 H ATOM 2621 HG LEU B 51 1.490 24.321 18.546 1.00 0.00 H ATOM 2622 HD21 LEU B 51 4.075 25.910 18.375 1.00 0.00 H ATOM 2623 HD22 LEU B 51 2.476 26.549 18.830 1.00 0.00 H ATOM 2624 HD23 LEU B 51 3.291 25.360 19.876 1.00 0.00 H ATOM 2625 HD11 LEU B 51 2.747 22.450 17.634 1.00 0.00 H ATOM 2626 HD12 LEU B 51 4.244 23.412 17.674 1.00 0.00 H ATOM 2627 HD13 LEU B 51 3.429 22.972 19.194 1.00 0.00 H ATOM 2628 H LEU B 51 1.733 25.449 14.156 1.00 0.00 H ATOM 2629 N ALA B 52 -0.920 24.589 16.027 1.00 6.35 N ATOM 2630 CA ALA B 52 -2.299 24.385 16.474 1.00 7.10 C ATOM 2631 C ALA B 52 -2.873 23.047 15.997 1.00 6.80 C ATOM 2632 O ALA B 52 -3.480 22.310 16.782 1.00 7.01 O ATOM 2633 CB ALA B 52 -3.175 25.529 16.015 1.00 6.36 C ATOM 2634 HA ALA B 52 -2.285 24.358 17.564 1.00 0.00 H ATOM 2635 HB1 ALA B 52 -2.800 26.463 16.433 1.00 0.00 H ATOM 2636 HB2 ALA B 52 -3.158 25.584 14.927 1.00 0.00 H ATOM 2637 HB3 ALA B 52 -4.197 25.362 16.356 1.00 0.00 H ATOM 2638 H ALA B 52 -0.688 25.437 15.472 1.00 0.00 H ATOM 2639 N ASP B 53 -2.665 22.730 14.716 1.00 6.99 N ATOM 2640 CA ASP B 53 -3.149 21.471 14.138 1.00 7.30 C ATOM 2641 C ASP B 53 -2.488 20.255 14.774 1.00 7.25 C ATOM 2642 O ASP B 53 -3.138 19.242 15.009 1.00 7.68 O ATOM 2643 CB ASP B 53 -2.938 21.443 12.621 1.00 7.67 C ATOM 2644 CG ASP B 53 -4.005 22.226 11.855 1.00 8.60 C ATOM 2645 OD1 ASP B 53 -4.912 22.816 12.489 1.00 10.13 O ATOM 2646 OD2 ASP B 53 -3.937 22.244 10.607 1.00 10.20 O ATOM 2647 HA ASP B 53 -4.217 21.422 14.350 1.00 0.00 H ATOM 2648 HB2 ASP B 53 -1.962 21.875 12.398 1.00 0.00 H ATOM 2649 HB3 ASP B 53 -2.960 20.406 12.286 1.00 0.00 H ATOM 2650 H ASP B 53 -2.144 23.396 14.110 1.00 0.00 H ATOM 2651 N VAL B 54 -1.191 20.359 15.041 1.00 6.48 N ATOM 2652 CA VAL B 54 -0.467 19.243 15.637 1.00 6.39 C ATOM 2653 C VAL B 54 -0.921 19.057 17.088 1.00 6.43 C ATOM 2654 O VAL B 54 -1.175 17.933 17.517 1.00 6.50 O ATOM 2655 CB VAL B 54 1.060 19.437 15.513 1.00 6.42 C ATOM 2656 CG1 VAL B 54 1.815 18.299 16.196 1.00 6.11 C ATOM 2657 CG2 VAL B 54 1.446 19.508 14.034 1.00 7.59 C ATOM 2658 HA VAL B 54 -0.700 18.328 15.092 1.00 0.00 H ATOM 2659 HB VAL B 54 1.333 20.368 16.009 1.00 0.00 H ATOM 2660 HG11 VAL B 54 1.551 18.272 17.253 1.00 0.00 H ATOM 2661 HG12 VAL B 54 1.544 17.353 15.728 1.00 0.00 H ATOM 2662 HG13 VAL B 54 2.888 18.463 16.092 1.00 0.00 H ATOM 2663 HG21 VAL B 54 1.155 18.581 13.539 1.00 0.00 H ATOM 2664 HG22 VAL B 54 0.933 20.348 13.566 1.00 0.00 H ATOM 2665 HG23 VAL B 54 2.524 19.645 13.947 1.00 0.00 H ATOM 2666 H VAL B 54 -0.688 21.243 14.823 1.00 0.00 H ATOM 2667 N LYS B 55 -1.038 20.159 17.829 1.00 6.67 N ATOM 2668 CA LYS B 55 -1.555 20.101 19.205 1.00 7.21 C ATOM 2669 C LYS B 55 -2.932 19.450 19.253 1.00 7.51 C ATOM 2670 O LYS B 55 -3.244 18.706 20.191 1.00 8.42 O ATOM 2671 CB LYS B 55 -1.615 21.497 19.830 1.00 7.33 C ATOM 2672 CG LYS B 55 -0.259 22.016 20.306 1.00 7.79 C ATOM 2673 CD LYS B 55 -0.377 23.447 20.806 1.00 9.01 C ATOM 2674 CE LYS B 55 0.911 23.932 21.430 1.00 11.87 C ATOM 2675 NZ LYS B 55 0.774 25.327 21.955 1.00 12.07 N ATOM 2676 HA LYS B 55 -0.864 19.488 19.784 1.00 0.00 H ATOM 2677 HB2 LYS B 55 -2.007 22.191 19.086 1.00 0.00 H ATOM 2678 HB3 LYS B 55 -2.290 21.463 20.685 1.00 0.00 H ATOM 2679 HG2 LYS B 55 0.103 21.382 21.116 1.00 0.00 H ATOM 2680 HG3 LYS B 55 0.448 21.983 19.477 1.00 0.00 H ATOM 2681 HD2 LYS B 55 -0.628 24.095 19.966 1.00 0.00 H ATOM 2682 HD3 LYS B 55 -1.171 23.496 21.551 1.00 0.00 H ATOM 2683 HE2 LYS B 55 1.699 23.912 20.677 1.00 0.00 H ATOM 2684 HE3 LYS B 55 1.179 23.268 22.252 1.00 0.00 H ATOM 2685 HZ1 LYS B 55 0.524 25.967 21.174 1.00 0.00 H ATOM 2686 HZ2 LYS B 55 0.027 25.352 22.678 1.00 0.00 H ATOM 2687 HZ3 LYS B 55 1.676 25.628 22.376 1.00 0.00 H ATOM 2688 H LYS B 55 -0.759 21.077 17.427 1.00 0.00 H ATOM 2689 N ALA B 56 -3.750 19.730 18.237 1.00 7.54 N ATOM 2690 CA ALA B 56 -5.118 19.219 18.174 1.00 7.43 C ATOM 2691 C ALA B 56 -5.193 17.689 18.094 1.00 7.21 C ATOM 2692 O ALA B 56 -6.215 17.100 18.449 1.00 7.47 O ATOM 2693 CB ALA B 56 -5.861 19.842 17.015 1.00 7.40 C ATOM 2694 HA ALA B 56 -5.596 19.504 19.112 1.00 0.00 H ATOM 2695 HB1 ALA B 56 -5.891 20.924 17.144 1.00 0.00 H ATOM 2696 HB2 ALA B 56 -5.348 19.600 16.084 1.00 0.00 H ATOM 2697 HB3 ALA B 56 -6.878 19.450 16.984 1.00 0.00 H ATOM 2698 H ALA B 56 -3.403 20.332 17.464 1.00 0.00 H ATOM 2699 N VAL B 57 -4.115 17.057 17.629 1.00 7.14 N ATOM 2700 CA VAL B 57 -4.076 15.598 17.500 1.00 7.08 C ATOM 2701 C VAL B 57 -4.300 14.935 18.858 1.00 7.26 C ATOM 2702 O VAL B 57 -4.872 13.857 18.917 1.00 7.13 O ATOM 2703 CB VAL B 57 -2.758 15.104 16.838 1.00 7.25 C ATOM 2704 CG1 VAL B 57 -2.733 13.570 16.717 1.00 7.10 C ATOM 2705 CG2 VAL B 57 -2.596 15.747 15.462 1.00 8.20 C ATOM 2706 HA VAL B 57 -4.888 15.304 16.836 1.00 0.00 H ATOM 2707 HB VAL B 57 -1.925 15.401 17.475 1.00 0.00 H ATOM 2708 HG11 VAL B 57 -2.810 13.127 17.710 1.00 0.00 H ATOM 2709 HG12 VAL B 57 -3.573 13.241 16.105 1.00 0.00 H ATOM 2710 HG13 VAL B 57 -1.798 13.259 16.250 1.00 0.00 H ATOM 2711 HG21 VAL B 57 -3.441 15.471 14.832 1.00 0.00 H ATOM 2712 HG22 VAL B 57 -2.561 16.831 15.571 1.00 0.00 H ATOM 2713 HG23 VAL B 57 -1.671 15.396 15.005 1.00 0.00 H ATOM 2714 H VAL B 57 -3.281 17.613 17.351 1.00 0.00 H ATOM 2715 N CYS B 58 -3.876 15.596 19.939 1.00 7.20 N ATOM 2716 CA CYS B 58 -4.034 15.039 21.291 1.00 7.66 C ATOM 2717 C CYS B 58 -5.496 14.888 21.712 1.00 7.95 C ATOM 2718 O CYS B 58 -5.792 14.232 22.715 1.00 8.01 O ATOM 2719 CB CYS B 58 -3.297 15.900 22.311 1.00 7.75 C ATOM 2720 SG CYS B 58 -1.526 15.905 22.070 1.00 9.41 S ATOM 2721 HA CYS B 58 -3.601 14.039 21.261 1.00 0.00 H ATOM 2722 HB2 CYS B 58 -3.511 15.517 23.309 1.00 0.00 H ATOM 2723 HB3 CYS B 58 -3.662 16.924 22.230 1.00 0.00 H ATOM 2724 H CYS B 58 -3.424 16.525 19.822 1.00 0.00 H ATOM 2725 N SER B 59 -6.401 15.504 20.952 1.00 8.16 N ATOM 2726 CA SER B 59 -7.835 15.391 21.219 1.00 9.21 C ATOM 2727 C SER B 59 -8.532 14.529 20.159 1.00 9.52 C ATOM 2728 O SER B 59 -9.770 14.449 20.114 1.00 10.09 O ATOM 2729 CB SER B 59 -8.478 16.777 21.300 1.00 9.27 C ATOM 2730 OG SER B 59 -8.433 17.427 20.047 1.00 10.87 O ATOM 2731 HA SER B 59 -7.959 14.897 22.183 1.00 0.00 H ATOM 2732 HB2 SER B 59 -7.941 17.378 22.034 1.00 0.00 H ATOM 2733 HB3 SER B 59 -9.517 16.671 21.610 1.00 0.00 H ATOM 2734 HG SER B 59 -7.490 17.529 19.763 1.00 0.00 H ATOM 2735 H SER B 59 -6.079 16.080 20.148 1.00 0.00 H ATOM 2736 N GLN B 60 -7.734 13.886 19.311 1.00 9.97 N ATOM 2737 CA GLN B 60 -8.275 13.075 18.221 1.00 10.49 C ATOM 2738 C GLN B 60 -8.284 11.578 18.587 1.00 10.96 C ATOM 2739 O GLN B 60 -8.510 11.246 19.753 1.00 10.93 O ATOM 2740 CB GLN B 60 -7.601 13.445 16.885 1.00 10.17 C ATOM 2741 CG GLN B 60 -7.966 14.894 16.489 1.00 10.89 C ATOM 2742 CD GLN B 60 -7.135 15.524 15.370 1.00 11.05 C ATOM 2743 OE1 GLN B 60 -6.460 14.844 14.597 1.00 11.44 O ATOM 2744 NE2 GLN B 60 -7.213 16.850 15.271 1.00 12.32 N ATOM 2745 HA GLN B 60 -9.329 13.307 18.068 1.00 0.00 H ATOM 2746 HB2 GLN B 60 -6.519 13.362 16.991 1.00 0.00 H ATOM 2747 HB3 GLN B 60 -7.942 12.762 16.107 1.00 0.00 H ATOM 2748 HG2 GLN B 60 -9.008 14.898 16.171 1.00 0.00 H ATOM 2749 HG3 GLN B 60 -7.856 15.518 17.376 1.00 0.00 H ATOM 2750 HE22 GLN B 60 -7.795 17.388 15.944 1.00 0.00 H ATOM 2751 HE21 GLN B 60 -6.692 17.347 14.520 1.00 0.00 H ATOM 2752 H GLN B 60 -6.703 13.962 19.426 1.00 0.00 H ATOM 2753 N LYS B 61 -8.062 10.685 17.625 1.00 11.32 N ATOM 2754 CA LYS B 61 -8.269 9.243 17.848 1.00 12.30 C ATOM 2755 C LYS B 61 -7.188 8.578 18.708 1.00 12.28 C ATOM 2756 O LYS B 61 -6.023 8.585 18.343 1.00 12.11 O ATOM 2757 CB LYS B 61 -8.367 8.516 16.503 1.00 12.49 C ATOM 2758 CG LYS B 61 -8.784 7.056 16.584 1.00 14.51 C ATOM 2759 CD LYS B 61 -8.565 6.373 15.243 1.00 17.20 C ATOM 2760 CE LYS B 61 -8.673 4.860 15.370 1.00 19.00 C ATOM 2761 NZ LYS B 61 -8.208 4.186 14.124 1.00 21.24 N ATOM 2762 HA LYS B 61 -9.201 9.159 18.407 1.00 0.00 H ATOM 2763 HB2 LYS B 61 -9.097 9.042 15.888 1.00 0.00 H ATOM 2764 HB3 LYS B 61 -7.389 8.561 16.023 1.00 0.00 H ATOM 2765 HG2 LYS B 61 -8.189 6.553 17.346 1.00 0.00 H ATOM 2766 HG3 LYS B 61 -9.839 6.997 16.851 1.00 0.00 H ATOM 2767 HD2 LYS B 61 -9.318 6.725 14.537 1.00 0.00 H ATOM 2768 HD3 LYS B 61 -7.573 6.629 14.872 1.00 0.00 H ATOM 2769 HE2 LYS B 61 -9.713 4.591 15.555 1.00 0.00 H ATOM 2770 HE3 LYS B 61 -8.059 4.527 16.207 1.00 0.00 H ATOM 2771 HZ1 LYS B 61 -8.794 4.497 13.323 1.00 0.00 H ATOM 2772 HZ2 LYS B 61 -7.215 4.437 13.946 1.00 0.00 H ATOM 2773 HZ3 LYS B 61 -8.292 3.156 14.237 1.00 0.00 H ATOM 2774 H LYS B 61 -7.735 11.013 16.694 1.00 0.00 H ATOM 2775 N LYS B 62 -7.589 7.997 19.839 1.00 12.93 N ATOM 2776 CA LYS B 62 -6.701 7.155 20.647 1.00 13.48 C ATOM 2777 C LYS B 62 -6.275 5.897 19.900 1.00 13.72 C ATOM 2778 O LYS B 62 -7.123 5.148 19.396 1.00 13.95 O ATOM 2779 CB LYS B 62 -7.393 6.728 21.944 1.00 13.83 C ATOM 2780 CG LYS B 62 -6.920 7.437 23.190 1.00 15.40 C ATOM 2781 CD LYS B 62 -5.672 6.802 23.767 1.00 17.21 C ATOM 2782 CE LYS B 62 -5.400 7.337 25.158 1.00 17.84 C ATOM 2783 NZ LYS B 62 -6.133 6.597 26.220 1.00 18.90 N ATOM 2784 HA LYS B 62 -5.819 7.756 20.867 1.00 0.00 H ATOM 2785 HB2 LYS B 62 -8.461 6.916 21.834 1.00 0.00 H ATOM 2786 HB3 LYS B 62 -7.225 5.660 22.080 1.00 0.00 H ATOM 2787 HG2 LYS B 62 -6.704 8.476 22.943 1.00 0.00 H ATOM 2788 HG3 LYS B 62 -7.712 7.400 23.938 1.00 0.00 H ATOM 2789 HD2 LYS B 62 -5.809 5.722 23.818 1.00 0.00 H ATOM 2790 HD3 LYS B 62 -4.823 7.029 23.123 1.00 0.00 H ATOM 2791 HE2 LYS B 62 -5.701 8.384 25.193 1.00 0.00 H ATOM 2792 HE3 LYS B 62 -4.331 7.261 25.356 1.00 0.00 H ATOM 2793 HZ1 LYS B 62 -7.156 6.669 26.048 1.00 0.00 H ATOM 2794 HZ2 LYS B 62 -5.847 5.597 26.204 1.00 0.00 H ATOM 2795 HZ3 LYS B 62 -5.906 7.009 27.148 1.00 0.00 H ATOM 2796 H LYS B 62 -8.567 8.146 20.160 1.00 0.00 H ATOM 2797 N VAL B 63 -4.964 5.671 19.839 1.00 13.87 N ATOM 2798 CA VAL B 63 -4.393 4.500 19.175 1.00 14.02 C ATOM 2799 C VAL B 63 -3.259 3.935 20.016 1.00 14.79 C ATOM 2800 O VAL B 63 -2.756 4.603 20.924 1.00 14.92 O ATOM 2801 CB VAL B 63 -3.864 4.818 17.741 1.00 13.78 C ATOM 2802 CG1 VAL B 63 -4.992 5.256 16.810 1.00 13.29 C ATOM 2803 CG2 VAL B 63 -2.754 5.865 17.784 1.00 13.55 C ATOM 2804 HA VAL B 63 -5.195 3.769 19.073 1.00 0.00 H ATOM 2805 HB VAL B 63 -3.444 3.897 17.337 1.00 0.00 H ATOM 2806 HG11 VAL B 63 -5.731 4.458 16.736 1.00 0.00 H ATOM 2807 HG12 VAL B 63 -5.464 6.153 17.210 1.00 0.00 H ATOM 2808 HG13 VAL B 63 -4.584 5.468 15.822 1.00 0.00 H ATOM 2809 HG21 VAL B 63 -3.140 6.784 18.225 1.00 0.00 H ATOM 2810 HG22 VAL B 63 -1.926 5.491 18.386 1.00 0.00 H ATOM 2811 HG23 VAL B 63 -2.406 6.066 16.771 1.00 0.00 H ATOM 2812 H VAL B 63 -4.319 6.356 20.282 1.00 0.00 H ATOM 2813 N THR B 64 -2.848 2.711 19.705 1.00 15.35 N ATOM 2814 CA THR B 64 -1.756 2.067 20.431 1.00 15.86 C ATOM 2815 C THR B 64 -0.423 2.791 20.177 1.00 15.76 C ATOM 2816 O THR B 64 -0.152 3.213 19.048 1.00 16.81 O ATOM 2817 CB THR B 64 -1.633 0.574 20.048 1.00 15.95 C ATOM 2818 OG1 THR B 64 -1.366 0.460 18.645 1.00 16.66 O ATOM 2819 CG2 THR B 64 -2.927 -0.182 20.378 1.00 15.73 C ATOM 2820 HA THR B 64 -1.988 2.130 21.494 1.00 0.00 H ATOM 2821 HB THR B 64 -0.815 0.137 20.621 1.00 0.00 H ATOM 2822 HG1 THR B 64 -2.108 0.872 18.135 1.00 0.00 H ATOM 2823 HG23 THR B 64 -3.134 -0.098 21.445 1.00 0.00 H ATOM 2824 HG21 THR B 64 -3.753 0.249 19.812 1.00 0.00 H ATOM 2825 HG22 THR B 64 -2.811 -1.232 20.111 1.00 0.00 H ATOM 2826 H THR B 64 -3.314 2.200 18.928 1.00 0.00 H ATOM 2827 N CYS B 65 0.379 2.966 21.229 1.00 15.89 N ATOM 2828 CA CYS B 65 1.747 3.491 21.086 1.00 15.39 C ATOM 2829 C CYS B 65 2.662 2.351 20.733 1.00 15.03 C ATOM 2830 O CYS B 65 2.498 1.239 21.246 1.00 14.94 O ATOM 2831 CB CYS B 65 2.285 4.080 22.392 1.00 15.55 C ATOM 2832 SG CYS B 65 1.460 5.504 23.044 1.00 16.80 S ATOM 2833 HA CYS B 65 1.714 4.269 20.323 1.00 0.00 H ATOM 2834 HB2 CYS B 65 3.326 4.354 22.223 1.00 0.00 H ATOM 2835 HB3 CYS B 65 2.235 3.297 23.149 1.00 0.00 H ATOM 2836 H CYS B 65 0.027 2.725 22.178 1.00 0.00 H ATOM 2837 N LYS B 66 3.668 2.632 19.914 1.00 14.37 N ATOM 2838 CA LYS B 66 4.647 1.608 19.568 1.00 14.32 C ATOM 2839 C LYS B 66 5.348 1.034 20.802 1.00 13.68 C ATOM 2840 O LYS B 66 5.752 -0.133 20.795 1.00 13.97 O ATOM 2841 CB LYS B 66 5.657 2.114 18.536 1.00 14.33 C ATOM 2842 CG LYS B 66 5.078 2.197 17.126 1.00 15.72 C ATOM 2843 CD LYS B 66 6.137 1.959 16.066 1.00 18.37 C ATOM 2844 CE LYS B 66 5.496 1.605 14.725 1.00 19.22 C ATOM 2845 NZ LYS B 66 6.482 1.513 13.610 1.00 20.01 N ATOM 2846 HA LYS B 66 4.092 0.790 19.109 1.00 0.00 H ATOM 2847 HB2 LYS B 66 5.990 3.108 18.834 1.00 0.00 H ATOM 2848 HB3 LYS B 66 6.510 1.435 18.522 1.00 0.00 H ATOM 2849 HG2 LYS B 66 4.297 1.444 17.020 1.00 0.00 H ATOM 2850 HG3 LYS B 66 4.648 3.188 16.979 1.00 0.00 H ATOM 2851 HD2 LYS B 66 6.735 2.863 15.949 1.00 0.00 H ATOM 2852 HD3 LYS B 66 6.781 1.138 16.382 1.00 0.00 H ATOM 2853 HE2 LYS B 66 4.763 2.373 14.477 1.00 0.00 H ATOM 2854 HE3 LYS B 66 4.993 0.643 14.824 1.00 0.00 H ATOM 2855 HZ1 LYS B 66 6.963 2.428 13.498 1.00 0.00 H ATOM 2856 HZ2 LYS B 66 7.183 0.776 13.829 1.00 0.00 H ATOM 2857 HZ3 LYS B 66 5.986 1.270 12.729 1.00 0.00 H ATOM 2858 H LYS B 66 3.759 3.589 19.516 1.00 0.00 H ATOM 2859 N ASN B 67 5.471 1.839 21.861 1.00 12.96 N ATOM 2860 CA ASN B 67 6.111 1.382 23.104 1.00 12.47 C ATOM 2861 C ASN B 67 5.121 0.868 24.160 1.00 11.95 C ATOM 2862 O ASN B 67 5.479 0.651 25.320 1.00 12.52 O ATOM 2863 CB ASN B 67 7.018 2.478 23.693 1.00 12.30 C ATOM 2864 CG ASN B 67 6.240 3.605 24.349 1.00 13.10 C ATOM 2865 OD1 ASN B 67 5.004 3.624 24.348 1.00 12.74 O ATOM 2866 ND2 ASN B 67 6.967 4.560 24.918 1.00 12.63 N ATOM 2867 HA ASN B 67 6.723 0.524 22.824 1.00 0.00 H ATOM 2868 HB2 ASN B 67 7.670 2.025 24.440 1.00 0.00 H ATOM 2869 HB3 ASN B 67 7.624 2.896 22.889 1.00 0.00 H ATOM 2870 HD22 ASN B 67 8.005 4.506 24.896 1.00 0.00 H ATOM 2871 HD21 ASN B 67 6.498 5.362 25.385 1.00 0.00 H ATOM 2872 H ASN B 67 5.106 2.811 21.805 1.00 0.00 H ATOM 2873 N GLY B 68 3.867 0.691 23.761 1.00 11.63 N ATOM 2874 CA GLY B 68 2.875 0.089 24.642 1.00 11.08 C ATOM 2875 C GLY B 68 2.279 1.003 25.697 1.00 11.11 C ATOM 2876 O GLY B 68 1.454 0.566 26.491 1.00 10.70 O ATOM 2877 HA3 GLY B 68 3.349 -0.748 25.155 1.00 0.00 H ATOM 2878 HA2 GLY B 68 2.059 -0.281 24.022 1.00 0.00 H ATOM 2879 H GLY B 68 3.588 0.987 22.804 1.00 0.00 H ATOM 2880 N GLN B 69 2.692 2.271 25.716 1.00 10.91 N ATOM 2881 CA GLN B 69 2.023 3.261 26.559 1.00 10.91 C ATOM 2882 C GLN B 69 0.661 3.551 25.962 1.00 11.52 C ATOM 2883 O GLN B 69 0.384 3.177 24.822 1.00 11.48 O ATOM 2884 CB GLN B 69 2.847 4.544 26.691 1.00 10.90 C ATOM 2885 CG GLN B 69 4.122 4.370 27.503 1.00 11.02 C ATOM 2886 CD GLN B 69 4.740 5.698 27.901 1.00 12.52 C ATOM 2887 OE1 GLN B 69 4.207 6.412 28.751 1.00 14.77 O ATOM 2888 NE2 GLN B 69 5.874 6.028 27.302 1.00 10.42 N ATOM 2889 HA GLN B 69 1.913 2.859 27.566 1.00 0.00 H ATOM 2890 HB2 GLN B 69 3.119 4.883 25.691 1.00 0.00 H ATOM 2891 HB3 GLN B 69 2.231 5.301 27.175 1.00 0.00 H ATOM 2892 HG2 GLN B 69 3.888 3.808 28.407 1.00 0.00 H ATOM 2893 HG3 GLN B 69 4.844 3.812 26.906 1.00 0.00 H ATOM 2894 HE22 GLN B 69 6.289 5.394 26.589 1.00 0.00 H ATOM 2895 HE21 GLN B 69 6.349 6.921 27.544 1.00 0.00 H ATOM 2896 H GLN B 69 3.498 2.559 25.125 1.00 0.00 H ATOM 2897 N THR B 70 -0.197 4.201 26.734 1.00 11.62 N ATOM 2898 CA THR B 70 -1.570 4.407 26.308 1.00 11.92 C ATOM 2899 C THR B 70 -1.898 5.886 26.161 1.00 12.19 C ATOM 2900 O THR B 70 -3.016 6.313 26.428 1.00 13.28 O ATOM 2901 CB THR B 70 -2.552 3.692 27.261 1.00 11.74 C ATOM 2902 OG1 THR B 70 -2.278 4.089 28.612 1.00 11.94 O ATOM 2903 CG2 THR B 70 -2.386 2.189 27.145 1.00 12.15 C ATOM 2904 HA THR B 70 -1.684 3.962 25.320 1.00 0.00 H ATOM 2905 HB THR B 70 -3.572 3.966 26.991 1.00 0.00 H ATOM 2906 HG1 THR B 70 -2.389 5.069 28.696 1.00 0.00 H ATOM 2907 HG23 THR B 70 -2.593 1.880 26.120 1.00 0.00 H ATOM 2908 HG21 THR B 70 -1.364 1.916 27.409 1.00 0.00 H ATOM 2909 HG22 THR B 70 -3.082 1.694 27.823 1.00 0.00 H ATOM 2910 H THR B 70 0.116 4.568 27.655 1.00 0.00 H ATOM 2911 N ASN B 71 -0.912 6.666 25.727 1.00 12.31 N ATOM 2912 CA ASN B 71 -1.080 8.105 25.574 1.00 12.20 C ATOM 2913 C ASN B 71 -0.858 8.586 24.135 1.00 12.06 C ATOM 2914 O ASN B 71 -0.482 9.734 23.912 1.00 11.95 O ATOM 2915 CB ASN B 71 -0.162 8.851 26.547 1.00 12.59 C ATOM 2916 CG ASN B 71 1.312 8.635 26.243 1.00 13.00 C ATOM 2917 OD1 ASN B 71 1.702 7.606 25.690 1.00 14.59 O ATOM 2918 ND2 ASN B 71 2.137 9.617 26.594 1.00 15.27 N ATOM 2919 HA ASN B 71 -2.119 8.331 25.814 1.00 0.00 H ATOM 2920 HB2 ASN B 71 -0.379 9.917 26.484 1.00 0.00 H ATOM 2921 HB3 ASN B 71 -0.365 8.499 27.558 1.00 0.00 H ATOM 2922 HD22 ASN B 71 1.763 10.469 27.059 1.00 0.00 H ATOM 2923 HD21 ASN B 71 3.156 9.533 26.403 1.00 0.00 H ATOM 2924 H ASN B 71 0.005 6.236 25.490 1.00 0.00 H ATOM 2925 N CYS B 72 -1.097 7.707 23.165 1.00 12.47 N ATOM 2926 CA CYS B 72 -0.885 8.066 21.759 1.00 12.28 C ATOM 2927 C CYS B 72 -2.175 8.372 21.028 1.00 12.54 C ATOM 2928 O CYS B 72 -3.223 7.791 21.325 1.00 12.31 O ATOM 2929 CB CYS B 72 -0.114 6.984 21.012 1.00 12.92 C ATOM 2930 SG CYS B 72 1.576 6.863 21.550 1.00 14.35 S ATOM 2931 HA CYS B 72 -0.290 8.979 21.776 1.00 0.00 H ATOM 2932 HB2 CYS B 72 -0.127 7.216 19.947 1.00 0.00 H ATOM 2933 HB3 CYS B 72 -0.605 6.025 21.179 1.00 0.00 H ATOM 2934 H CYS B 72 -1.438 6.755 23.407 1.00 0.00 H ATOM 2935 N TYR B 73 -2.072 9.287 20.065 1.00 11.98 N ATOM 2936 CA TYR B 73 -3.227 9.782 19.333 1.00 11.98 C ATOM 2937 C TYR B 73 -2.860 9.951 17.882 1.00 11.66 C ATOM 2938 O TYR B 73 -1.761 10.404 17.567 1.00 12.09 O ATOM 2939 CB TYR B 73 -3.690 11.121 19.908 1.00 12.19 C ATOM 2940 CG TYR B 73 -4.191 11.004 21.325 1.00 12.17 C ATOM 2941 CD1 TYR B 73 -3.308 11.080 22.400 1.00 11.90 C ATOM 2942 CD2 TYR B 73 -5.544 10.802 21.596 1.00 12.88 C ATOM 2943 CE1 TYR B 73 -3.749 10.960 23.706 1.00 12.55 C ATOM 2944 CE2 TYR B 73 -5.997 10.686 22.908 1.00 12.37 C ATOM 2945 CZ TYR B 73 -5.090 10.760 23.956 1.00 12.77 C ATOM 2946 OH TYR B 73 -5.519 10.643 25.255 1.00 13.39 O ATOM 2947 HA TYR B 73 -4.042 9.064 19.426 1.00 0.00 H ATOM 2948 HB3 TYR B 73 -4.495 11.509 19.284 1.00 0.00 H ATOM 2949 HB2 TYR B 73 -2.851 11.817 19.891 1.00 0.00 H ATOM 2950 HD2 TYR B 73 -6.255 10.734 20.772 1.00 0.00 H ATOM 2951 HE2 TYR B 73 -7.058 10.538 23.111 1.00 0.00 H ATOM 2952 HE1 TYR B 73 -3.041 11.023 24.532 1.00 0.00 H ATOM 2953 HD1 TYR B 73 -2.247 11.237 22.208 1.00 0.00 H ATOM 2954 HH TYR B 73 -4.743 10.719 25.866 1.00 0.00 H ATOM 2955 H TYR B 73 -1.131 9.661 19.828 1.00 0.00 H ATOM 2956 N GLN B 74 -3.794 9.587 17.009 1.00 11.45 N ATOM 2957 CA GLN B 74 -3.592 9.632 15.569 1.00 11.44 C ATOM 2958 C GLN B 74 -4.366 10.800 14.970 1.00 11.07 C ATOM 2959 O GLN B 74 -5.526 11.033 15.326 1.00 11.36 O ATOM 2960 CB GLN B 74 -4.073 8.320 14.947 1.00 11.36 C ATOM 2961 CG GLN B 74 -3.783 8.181 13.456 1.00 11.92 C ATOM 2962 CD GLN B 74 -4.188 6.820 12.903 1.00 12.50 C ATOM 2963 OE1 GLN B 74 -4.997 6.728 11.980 1.00 16.99 O ATOM 2964 NE2 GLN B 74 -3.614 5.762 13.457 1.00 13.68 N ATOM 2965 HA GLN B 74 -2.531 9.767 15.359 1.00 0.00 H ATOM 2966 HB2 GLN B 74 -3.583 7.497 15.467 1.00 0.00 H ATOM 2967 HB3 GLN B 74 -5.151 8.250 15.092 1.00 0.00 H ATOM 2968 HG2 GLN B 74 -4.334 8.954 12.920 1.00 0.00 H ATOM 2969 HG3 GLN B 74 -2.714 8.320 13.294 1.00 0.00 H ATOM 2970 HE22 GLN B 74 -2.936 5.886 14.235 1.00 0.00 H ATOM 2971 HE21 GLN B 74 -3.842 4.807 13.113 1.00 0.00 H ATOM 2972 H GLN B 74 -4.710 9.255 17.372 1.00 0.00 H ATOM 2973 N SER B 75 -3.734 11.529 14.050 1.00 10.96 N ATOM 2974 CA SER B 75 -4.395 12.666 13.422 1.00 10.87 C ATOM 2975 C SER B 75 -5.586 12.205 12.586 1.00 11.35 C ATOM 2976 O SER B 75 -5.550 11.131 11.991 1.00 11.34 O ATOM 2977 CB SER B 75 -3.410 13.477 12.575 1.00 10.93 C ATOM 2978 OG SER B 75 -2.876 12.717 11.504 1.00 10.75 O ATOM 2979 HA SER B 75 -4.768 13.318 14.212 1.00 0.00 H ATOM 2980 HB2 SER B 75 -2.591 13.811 13.212 1.00 0.00 H ATOM 2981 HB3 SER B 75 -3.929 14.344 12.167 1.00 0.00 H ATOM 2982 HG SER B 75 -3.613 12.414 10.916 1.00 0.00 H ATOM 2983 H SER B 75 -2.761 11.284 13.778 1.00 0.00 H ATOM 2984 N LYS B 76 -6.634 13.023 12.555 1.00 11.80 N ATOM 2985 CA LYS B 76 -7.851 12.691 11.816 1.00 12.46 C ATOM 2986 C LYS B 76 -7.640 12.767 10.310 1.00 12.18 C ATOM 2987 O LYS B 76 -8.363 12.143 9.537 1.00 12.58 O ATOM 2988 CB LYS B 76 -9.044 13.550 12.268 1.00 12.59 C ATOM 2989 CG LYS B 76 -8.859 15.066 12.185 1.00 13.72 C ATOM 2990 CD LYS B 76 -10.033 15.775 12.868 1.00 13.61 C ATOM 2991 CE LYS B 76 -9.934 17.291 12.767 1.00 15.68 C ATOM 2992 NZ LYS B 76 -10.241 17.793 11.401 1.00 17.18 N ATOM 2993 HA LYS B 76 -8.093 11.655 12.051 1.00 0.00 H ATOM 2994 HB2 LYS B 76 -9.899 13.285 11.646 1.00 0.00 H ATOM 2995 HB3 LYS B 76 -9.260 13.298 13.306 1.00 0.00 H ATOM 2996 HG2 LYS B 76 -7.930 15.344 12.682 1.00 0.00 H ATOM 2997 HG3 LYS B 76 -8.814 15.368 11.139 1.00 0.00 H ATOM 2998 HD2 LYS B 76 -10.960 15.452 12.395 1.00 0.00 H ATOM 2999 HD3 LYS B 76 -10.047 15.494 13.921 1.00 0.00 H ATOM 3000 HE2 LYS B 76 -8.921 17.594 13.031 1.00 0.00 H ATOM 3001 HE3 LYS B 76 -10.639 17.735 13.469 1.00 0.00 H ATOM 3002 HZ1 LYS B 76 -9.568 17.382 10.723 1.00 0.00 H ATOM 3003 HZ2 LYS B 76 -11.209 17.517 11.141 1.00 0.00 H ATOM 3004 HZ3 LYS B 76 -10.159 18.830 11.387 1.00 0.00 H ATOM 3005 H LYS B 76 -6.587 13.925 13.071 1.00 0.00 H ATOM 3006 N SER B 77 -6.634 13.530 9.906 1.00 11.70 N ATOM 3007 CA SER B 77 -6.322 13.694 8.499 1.00 11.59 C ATOM 3008 C SER B 77 -4.830 13.539 8.273 1.00 10.82 C ATOM 3009 O SER B 77 -4.045 13.558 9.219 1.00 10.75 O ATOM 3010 CB SER B 77 -6.799 15.057 8.026 1.00 12.01 C ATOM 3011 OG SER B 77 -8.213 15.086 7.991 1.00 13.64 O ATOM 3012 HA SER B 77 -6.835 12.924 7.923 1.00 0.00 H ATOM 3013 HB2 SER B 77 -6.408 15.251 7.027 1.00 0.00 H ATOM 3014 HB3 SER B 77 -6.438 15.824 8.711 1.00 0.00 H ATOM 3015 HG SER B 77 -8.516 15.976 7.682 1.00 0.00 H ATOM 3016 H SER B 77 -6.054 14.023 10.615 1.00 0.00 H ATOM 3017 N THR B 78 -4.438 13.362 7.016 1.00 9.89 N ATOM 3018 CA THR B 78 -3.021 13.305 6.693 1.00 9.12 C ATOM 3019 C THR B 78 -2.421 14.688 6.913 1.00 8.69 C ATOM 3020 O THR B 78 -3.131 15.698 6.847 1.00 8.55 O ATOM 3021 CB THR B 78 -2.761 12.846 5.246 1.00 9.18 C ATOM 3022 OG1 THR B 78 -3.343 13.782 4.332 1.00 10.19 O ATOM 3023 CG2 THR B 78 -3.341 11.456 5.003 1.00 9.26 C ATOM 3024 HA THR B 78 -2.553 12.567 7.345 1.00 0.00 H ATOM 3025 HB THR B 78 -1.684 12.800 5.086 1.00 0.00 H ATOM 3026 HG1 THR B 78 -2.937 14.674 4.472 1.00 0.00 H ATOM 3027 HG23 THR B 78 -2.893 10.750 5.702 1.00 0.00 H ATOM 3028 HG21 THR B 78 -4.420 11.483 5.153 1.00 0.00 H ATOM 3029 HG22 THR B 78 -3.122 11.146 3.981 1.00 0.00 H ATOM 3030 H THR B 78 -5.146 13.264 6.261 1.00 0.00 H ATOM 3031 N MET B 79 -1.118 14.710 7.185 1.00 7.98 N ATOM 3032 CA MET B 79 -0.360 15.933 7.382 1.00 7.69 C ATOM 3033 C MET B 79 0.876 15.937 6.508 1.00 7.64 C ATOM 3034 O MET B 79 1.426 14.877 6.189 1.00 7.72 O ATOM 3035 CB MET B 79 0.065 16.050 8.844 1.00 7.41 C ATOM 3036 CG MET B 79 -1.098 16.291 9.776 1.00 6.51 C ATOM 3037 SD MET B 79 -0.510 16.822 11.384 1.00 8.37 S ATOM 3038 CE MET B 79 -2.055 17.280 12.144 1.00 7.15 C ATOM 3039 HA MET B 79 -0.994 16.777 7.111 1.00 0.00 H ATOM 3040 HB2 MET B 79 0.561 15.125 9.138 1.00 0.00 H ATOM 3041 HB3 MET B 79 0.764 16.881 8.938 1.00 0.00 H ATOM 3042 HG2 MET B 79 -1.666 15.368 9.888 1.00 0.00 H ATOM 3043 HG3 MET B 79 -1.742 17.064 9.355 1.00 0.00 H ATOM 3044 HE1 MET B 79 -2.525 18.072 11.560 1.00 0.00 H ATOM 3045 HE2 MET B 79 -2.713 16.412 12.177 1.00 0.00 H ATOM 3046 HE3 MET B 79 -1.869 17.636 13.157 1.00 0.00 H ATOM 3047 H MET B 79 -0.616 13.802 7.260 1.00 0.00 H ATOM 3048 N ARG B 80 1.311 17.136 6.121 1.00 7.65 N ATOM 3049 CA ARG B 80 2.562 17.302 5.394 1.00 7.28 C ATOM 3050 C ARG B 80 3.692 17.195 6.399 1.00 7.49 C ATOM 3051 O ARG B 80 3.800 18.013 7.320 1.00 7.14 O ATOM 3052 CB ARG B 80 2.602 18.650 4.679 1.00 7.62 C ATOM 3053 CG ARG B 80 1.576 18.769 3.563 1.00 7.79 C ATOM 3054 CD ARG B 80 1.600 20.145 2.922 1.00 11.00 C ATOM 3055 NE ARG B 80 1.380 21.221 3.886 1.00 14.30 N ATOM 3056 CZ ARG B 80 2.343 22.010 4.365 1.00 15.26 C ATOM 3057 NH1 ARG B 80 2.044 22.968 5.235 1.00 16.52 N ATOM 3058 NH2 ARG B 80 3.604 21.849 3.971 1.00 16.19 N ATOM 3059 HA ARG B 80 2.658 16.532 4.629 1.00 0.00 H ATOM 3060 HB2 ARG B 80 2.411 19.436 5.410 1.00 0.00 H ATOM 3061 HB3 ARG B 80 3.596 18.786 4.252 1.00 0.00 H ATOM 3062 HG2 ARG B 80 1.794 18.020 2.801 1.00 0.00 H ATOM 3063 HG3 ARG B 80 0.583 18.588 3.975 1.00 0.00 H ATOM 3064 HD2 ARG B 80 0.818 20.190 2.164 1.00 0.00 H ATOM 3065 HD3 ARG B 80 2.571 20.293 2.450 1.00 0.00 H ATOM 3066 HE ARG B 80 0.409 21.382 4.221 1.00 0.00 H ATOM 3067 HH12 ARG B 80 2.794 23.584 5.609 1.00 0.00 H ATOM 3068 HH11 ARG B 80 1.060 23.103 5.542 1.00 0.00 H ATOM 3069 HH22 ARG B 80 4.350 22.468 4.349 1.00 0.00 H ATOM 3070 HH21 ARG B 80 3.844 21.104 3.286 1.00 0.00 H ATOM 3071 H ARG B 80 0.741 17.977 6.344 1.00 0.00 H ATOM 3072 N ILE B 81 4.498 16.155 6.233 1.00 7.61 N ATOM 3073 CA ILE B 81 5.635 15.897 7.107 1.00 7.36 C ATOM 3074 C ILE B 81 6.861 15.548 6.269 1.00 7.39 C ATOM 3075 O ILE B 81 6.743 15.243 5.077 1.00 7.15 O ATOM 3076 CB ILE B 81 5.325 14.764 8.133 1.00 7.53 C ATOM 3077 CG1 ILE B 81 5.211 13.408 7.425 1.00 6.80 C ATOM 3078 CG2 ILE B 81 4.068 15.095 8.926 1.00 7.41 C ATOM 3079 CD1 ILE B 81 4.841 12.240 8.334 1.00 7.77 C ATOM 3080 HA ILE B 81 5.839 16.802 7.679 1.00 0.00 H ATOM 3081 HB ILE B 81 6.152 14.693 8.839 1.00 0.00 H ATOM 3082 HG12 ILE B 81 4.447 13.492 6.652 1.00 0.00 H ATOM 3083 HG13 ILE B 81 6.172 13.186 6.961 1.00 0.00 H ATOM 3084 HD11 ILE B 81 5.601 12.128 9.107 1.00 0.00 H ATOM 3085 HD12 ILE B 81 3.874 12.435 8.798 1.00 0.00 H ATOM 3086 HD13 ILE B 81 4.784 11.326 7.744 1.00 0.00 H ATOM 3087 HG21 ILE B 81 4.215 16.031 9.464 1.00 0.00 H ATOM 3088 HG22 ILE B 81 3.225 15.196 8.243 1.00 0.00 H ATOM 3089 HG23 ILE B 81 3.867 14.294 9.637 1.00 0.00 H ATOM 3090 H ILE B 81 4.311 15.498 5.449 1.00 0.00 H ATOM 3091 N THR B 82 8.037 15.630 6.885 1.00 7.55 N ATOM 3092 CA THR B 82 9.272 15.191 6.252 1.00 7.86 C ATOM 3093 C THR B 82 9.947 14.179 7.150 1.00 8.96 C ATOM 3094 O THR B 82 10.221 14.453 8.319 1.00 8.64 O ATOM 3095 CB THR B 82 10.219 16.366 5.982 1.00 7.90 C ATOM 3096 OG1 THR B 82 9.588 17.247 5.057 1.00 6.27 O ATOM 3097 CG2 THR B 82 11.541 15.873 5.385 1.00 7.61 C ATOM 3098 HA THR B 82 9.029 14.741 5.290 1.00 0.00 H ATOM 3099 HB THR B 82 10.434 16.877 6.920 1.00 0.00 H ATOM 3100 HG1 THR B 82 8.739 17.577 5.444 1.00 0.00 H ATOM 3101 HG23 THR B 82 12.027 15.198 6.090 1.00 0.00 H ATOM 3102 HG21 THR B 82 11.342 15.345 4.452 1.00 0.00 H ATOM 3103 HG22 THR B 82 12.191 16.726 5.190 1.00 0.00 H ATOM 3104 H THR B 82 8.075 16.020 7.848 1.00 0.00 H ATOM 3105 N ASP B 83 10.189 12.995 6.600 1.00 9.58 N ATOM 3106 CA ASP B 83 10.922 11.985 7.329 1.00 11.31 C ATOM 3107 C ASP B 83 12.405 12.156 7.056 1.00 12.36 C ATOM 3108 O ASP B 83 12.823 12.290 5.902 1.00 11.28 O ATOM 3109 CB ASP B 83 10.433 10.578 6.967 1.00 11.22 C ATOM 3110 CG ASP B 83 9.123 10.212 7.661 1.00 12.88 C ATOM 3111 OD1 ASP B 83 8.798 10.802 8.720 1.00 12.62 O ATOM 3112 OD2 ASP B 83 8.414 9.320 7.151 1.00 14.28 O ATOM 3113 HA ASP B 83 10.747 12.108 8.398 1.00 0.00 H ATOM 3114 HB2 ASP B 83 10.282 10.528 5.889 1.00 0.00 H ATOM 3115 HB3 ASP B 83 11.196 9.857 7.260 1.00 0.00 H ATOM 3116 H ASP B 83 9.849 12.793 5.638 1.00 0.00 H ATOM 3117 N CYS B 84 13.182 12.186 8.136 1.00 14.87 N ATOM 3118 CA CYS B 84 14.635 12.232 8.056 1.00 16.42 C ATOM 3119 C CYS B 84 15.204 10.933 8.589 1.00 17.42 C ATOM 3120 O CYS B 84 15.099 10.632 9.781 1.00 18.21 O ATOM 3121 CB CYS B 84 15.187 13.405 8.854 1.00 16.23 C ATOM 3122 SG CYS B 84 14.598 14.996 8.310 1.00 16.72 S ATOM 3123 HA CYS B 84 14.926 12.365 7.014 1.00 0.00 H ATOM 3124 HB2 CYS B 84 16.274 13.395 8.770 1.00 0.00 H ATOM 3125 HB3 CYS B 84 14.903 13.273 9.898 1.00 0.00 H ATOM 3126 H CYS B 84 12.734 12.176 9.074 1.00 0.00 H ATOM 3127 N ARG B 85 15.803 10.164 7.690 1.00 18.67 N ATOM 3128 CA ARG B 85 16.297 8.846 8.040 1.00 19.64 C ATOM 3129 C ARG B 85 17.782 8.784 7.742 1.00 20.12 C ATOM 3130 O ARG B 85 18.202 9.054 6.619 1.00 20.46 O ATOM 3131 CB ARG B 85 15.528 7.785 7.250 1.00 19.93 C ATOM 3132 CG ARG B 85 16.009 6.357 7.424 1.00 20.01 C ATOM 3133 CD ARG B 85 15.697 5.770 8.799 1.00 20.64 C ATOM 3134 NE ARG B 85 16.264 4.426 8.924 1.00 22.08 N ATOM 3135 CZ ARG B 85 17.312 4.106 9.684 1.00 22.68 C ATOM 3136 NH1 ARG B 85 17.917 5.022 10.435 1.00 22.40 N ATOM 3137 NH2 ARG B 85 17.752 2.856 9.703 1.00 23.07 N ATOM 3138 HA ARG B 85 16.145 8.652 9.102 1.00 0.00 H ATOM 3139 HB2 ARG B 85 14.484 7.827 7.561 1.00 0.00 H ATOM 3140 HB3 ARG B 85 15.601 8.037 6.192 1.00 0.00 H ATOM 3141 HG2 ARG B 85 15.529 5.737 6.667 1.00 0.00 H ATOM 3142 HG3 ARG B 85 17.089 6.336 7.277 1.00 0.00 H ATOM 3143 HD2 ARG B 85 14.616 5.717 8.930 1.00 0.00 H ATOM 3144 HD3 ARG B 85 16.124 6.413 9.569 1.00 0.00 H ATOM 3145 HE ARG B 85 15.815 3.663 8.379 1.00 0.00 H ATOM 3146 HH12 ARG B 85 18.733 4.756 11.022 1.00 0.00 H ATOM 3147 HH11 ARG B 85 17.574 6.004 10.435 1.00 0.00 H ATOM 3148 HH22 ARG B 85 18.569 2.601 10.294 1.00 0.00 H ATOM 3149 HH21 ARG B 85 17.280 2.130 9.127 1.00 0.00 H ATOM 3150 H ARG B 85 15.921 10.512 6.717 1.00 0.00 H ATOM 3151 N GLU B 86 18.567 8.435 8.756 1.00 20.85 N ATOM 3152 CA GLU B 86 20.007 8.305 8.599 1.00 21.41 C ATOM 3153 C GLU B 86 20.338 7.262 7.525 1.00 21.49 C ATOM 3154 O GLU B 86 19.784 6.161 7.527 1.00 21.16 O ATOM 3155 CB GLU B 86 20.659 7.947 9.936 1.00 21.51 C ATOM 3156 CG GLU B 86 22.163 7.785 9.850 1.00 22.10 C ATOM 3157 CD GLU B 86 22.825 7.575 11.195 1.00 22.00 C ATOM 3158 OE1 GLU B 86 22.194 6.965 12.092 1.00 23.22 O ATOM 3159 OE2 GLU B 86 23.990 8.008 11.342 1.00 22.71 O ATOM 3160 HA GLU B 86 20.411 9.263 8.272 1.00 0.00 H ATOM 3161 HB2 GLU B 86 20.437 8.739 10.651 1.00 0.00 H ATOM 3162 HB3 GLU B 86 20.230 7.009 10.289 1.00 0.00 H ATOM 3163 HG2 GLU B 86 22.382 6.924 9.219 1.00 0.00 H ATOM 3164 HG3 GLU B 86 22.582 8.683 9.395 1.00 0.00 H ATOM 3165 H GLU B 86 18.140 8.250 9.686 1.00 0.00 H ATOM 3166 N THR B 87 21.220 7.636 6.600 1.00 21.71 N ATOM 3167 CA THR B 87 21.604 6.766 5.488 1.00 22.37 C ATOM 3168 C THR B 87 22.641 5.740 5.933 1.00 22.50 C ATOM 3169 O THR B 87 23.248 5.874 6.999 1.00 22.46 O ATOM 3170 CB THR B 87 22.190 7.572 4.307 1.00 22.26 C ATOM 3171 OG1 THR B 87 23.456 8.125 4.687 1.00 22.93 O ATOM 3172 CG2 THR B 87 21.246 8.699 3.880 1.00 22.81 C ATOM 3173 HA THR B 87 20.696 6.260 5.160 1.00 0.00 H ATOM 3174 HB THR B 87 22.316 6.896 3.462 1.00 0.00 H ATOM 3175 HG1 THR B 87 23.830 8.641 3.929 1.00 0.00 H ATOM 3176 HG23 THR B 87 20.284 8.276 3.592 1.00 0.00 H ATOM 3177 HG21 THR B 87 21.106 9.389 4.712 1.00 0.00 H ATOM 3178 HG22 THR B 87 21.678 9.232 3.033 1.00 0.00 H ATOM 3179 H THR B 87 21.651 8.580 6.670 1.00 0.00 H ATOM 3180 N GLY B 88 22.845 4.722 5.099 1.00 22.67 N ATOM 3181 CA GLY B 88 23.861 3.704 5.348 1.00 23.19 C ATOM 3182 C GLY B 88 25.269 4.272 5.378 1.00 23.49 C ATOM 3183 O GLY B 88 26.116 3.802 6.136 1.00 23.70 O ATOM 3184 HA3 GLY B 88 23.804 2.955 4.558 1.00 0.00 H ATOM 3185 HA2 GLY B 88 23.655 3.233 6.309 1.00 0.00 H ATOM 3186 H GLY B 88 22.261 4.650 4.242 1.00 0.00 H ATOM 3187 N SER B 89 25.506 5.298 4.564 1.00 23.66 N ATOM 3188 CA SER B 89 26.824 5.920 4.449 1.00 23.94 C ATOM 3189 C SER B 89 27.098 6.974 5.525 1.00 23.81 C ATOM 3190 O SER B 89 28.218 7.485 5.629 1.00 23.84 O ATOM 3191 CB SER B 89 27.000 6.518 3.053 1.00 23.89 C ATOM 3192 OG SER B 89 27.001 5.492 2.073 1.00 24.91 O ATOM 3193 HA SER B 89 27.558 5.130 4.608 1.00 0.00 H ATOM 3194 HB2 SER B 89 27.946 7.058 3.010 1.00 0.00 H ATOM 3195 HB3 SER B 89 26.180 7.207 2.851 1.00 0.00 H ATOM 3196 HG SER B 89 26.141 5.002 2.109 1.00 0.00 H ATOM 3197 H SER B 89 24.724 5.671 3.988 1.00 0.00 H ATOM 3198 N SER B 90 26.074 7.289 6.317 1.00 23.88 N ATOM 3199 CA SER B 90 26.194 8.232 7.426 1.00 23.61 C ATOM 3200 C SER B 90 27.103 7.676 8.516 1.00 23.75 C ATOM 3201 O SER B 90 27.019 6.500 8.871 1.00 23.72 O ATOM 3202 CB SER B 90 24.813 8.557 8.000 1.00 23.72 C ATOM 3203 OG SER B 90 24.893 9.394 9.144 1.00 22.86 O ATOM 3204 HA SER B 90 26.641 9.150 7.045 1.00 0.00 H ATOM 3205 HB2 SER B 90 24.320 7.626 8.279 1.00 0.00 H ATOM 3206 HB3 SER B 90 24.224 9.063 7.235 1.00 0.00 H ATOM 3207 HG SER B 90 25.421 8.940 9.848 1.00 0.00 H ATOM 3208 H SER B 90 25.151 6.845 6.138 1.00 0.00 H ATOM 3209 N LYS B 91 27.979 8.536 9.027 1.00 23.92 N ATOM 3210 CA LYS B 91 28.924 8.167 10.073 1.00 24.17 C ATOM 3211 C LYS B 91 29.229 9.420 10.892 1.00 24.19 C ATOM 3212 O LYS B 91 29.757 10.399 10.360 1.00 24.12 O ATOM 3213 CB LYS B 91 30.206 7.596 9.451 1.00 24.33 C ATOM 3214 CG LYS B 91 30.746 6.334 10.127 1.00 24.77 C ATOM 3215 CD LYS B 91 31.556 6.646 11.382 1.00 26.15 C ATOM 3216 CE LYS B 91 31.890 5.381 12.171 1.00 26.41 C ATOM 3217 NZ LYS B 91 32.789 4.452 11.430 1.00 26.63 N ATOM 3218 HA LYS B 91 28.500 7.397 10.717 1.00 0.00 H ATOM 3219 HB2 LYS B 91 29.999 7.359 8.407 1.00 0.00 H ATOM 3220 HB3 LYS B 91 30.978 8.364 9.502 1.00 0.00 H ATOM 3221 HG2 LYS B 91 29.905 5.697 10.402 1.00 0.00 H ATOM 3222 HG3 LYS B 91 31.385 5.805 9.420 1.00 0.00 H ATOM 3223 HD2 LYS B 91 32.485 7.136 11.090 1.00 0.00 H ATOM 3224 HD3 LYS B 91 30.978 7.316 12.018 1.00 0.00 H ATOM 3225 HE2 LYS B 91 30.961 4.858 12.399 1.00 0.00 H ATOM 3226 HE3 LYS B 91 32.380 5.671 13.101 1.00 0.00 H ATOM 3227 HZ1 LYS B 91 32.329 4.160 10.544 1.00 0.00 H ATOM 3228 HZ2 LYS B 91 33.684 4.936 11.215 1.00 0.00 H ATOM 3229 HZ3 LYS B 91 32.979 3.614 12.016 1.00 0.00 H ATOM 3230 H LYS B 91 27.990 9.511 8.666 1.00 0.00 H ATOM 3231 N TYR B 92 28.866 9.391 12.176 1.00 24.13 N ATOM 3232 CA TYR B 92 29.126 10.502 13.099 1.00 24.04 C ATOM 3233 C TYR B 92 30.602 10.933 13.050 1.00 23.93 C ATOM 3234 O TYR B 92 31.487 10.076 12.965 1.00 24.12 O ATOM 3235 CB TYR B 92 28.717 10.111 14.528 1.00 24.00 C ATOM 3236 CG TYR B 92 28.862 11.227 15.537 1.00 24.01 C ATOM 3237 CD1 TYR B 92 27.868 12.199 15.678 1.00 24.57 C ATOM 3238 CD2 TYR B 92 29.997 11.324 16.342 1.00 24.36 C ATOM 3239 CE1 TYR B 92 28.003 13.240 16.597 1.00 24.61 C ATOM 3240 CE2 TYR B 92 30.139 12.360 17.265 1.00 24.50 C ATOM 3241 CZ TYR B 92 29.137 13.312 17.385 1.00 24.48 C ATOM 3242 OH TYR B 92 29.267 14.336 18.294 1.00 24.36 O ATOM 3243 HA TYR B 92 28.524 11.355 12.785 1.00 0.00 H ATOM 3244 HB3 TYR B 92 29.342 9.277 14.847 1.00 0.00 H ATOM 3245 HB2 TYR B 92 27.673 9.797 14.512 1.00 0.00 H ATOM 3246 HD2 TYR B 92 30.786 10.578 16.248 1.00 0.00 H ATOM 3247 HE2 TYR B 92 31.031 12.421 17.888 1.00 0.00 H ATOM 3248 HE1 TYR B 92 27.220 13.992 16.693 1.00 0.00 H ATOM 3249 HD1 TYR B 92 26.972 12.143 15.060 1.00 0.00 H ATOM 3250 HH TYR B 92 28.469 14.919 18.248 1.00 0.00 H ATOM 3251 H TYR B 92 28.379 8.546 12.537 1.00 0.00 H ATOM 3252 N PRO B 93 30.881 12.256 13.104 1.00 23.87 N ATOM 3253 CA PRO B 93 29.979 13.402 13.272 1.00 23.81 C ATOM 3254 C PRO B 93 29.335 13.924 11.984 1.00 23.76 C ATOM 3255 O PRO B 93 28.556 14.882 12.033 1.00 24.02 O ATOM 3256 CB PRO B 93 30.890 14.466 13.883 1.00 23.87 C ATOM 3257 CG PRO B 93 32.234 14.172 13.312 1.00 23.90 C ATOM 3258 CD PRO B 93 32.286 12.695 12.988 1.00 23.78 C ATOM 3259 HA PRO B 93 29.117 13.122 13.878 1.00 0.00 H ATOM 3260 HD3 PRO B 93 32.661 12.532 11.978 1.00 0.00 H ATOM 3261 HD2 PRO B 93 32.919 12.164 13.699 1.00 0.00 H ATOM 3262 HG3 PRO B 93 33.008 14.420 14.038 1.00 0.00 H ATOM 3263 HG2 PRO B 93 32.388 14.757 12.405 1.00 0.00 H ATOM 3264 HB2 PRO B 93 30.560 15.466 13.600 1.00 0.00 H ATOM 3265 HB3 PRO B 93 30.905 14.384 14.970 1.00 0.00 H ATOM 3266 N ASN B 94 29.650 13.296 10.854 1.00 23.51 N ATOM 3267 CA ASN B 94 29.055 13.662 9.571 1.00 23.33 C ATOM 3268 C ASN B 94 27.734 12.921 9.363 1.00 22.97 C ATOM 3269 O ASN B 94 27.682 11.906 8.656 1.00 23.18 O ATOM 3270 CB ASN B 94 30.026 13.370 8.420 1.00 23.43 C ATOM 3271 CG ASN B 94 31.357 14.096 8.570 1.00 23.55 C ATOM 3272 OD1 ASN B 94 32.414 13.468 8.638 1.00 24.22 O ATOM 3273 ND2 ASN B 94 31.308 15.423 8.626 1.00 24.30 N ATOM 3274 HA ASN B 94 28.851 14.733 9.580 1.00 0.00 H ATOM 3275 HB2 ASN B 94 30.216 12.297 8.388 1.00 0.00 H ATOM 3276 HB3 ASN B 94 29.562 13.683 7.485 1.00 0.00 H ATOM 3277 HD22 ASN B 94 30.393 15.913 8.565 1.00 0.00 H ATOM 3278 HD21 ASN B 94 32.185 15.972 8.731 1.00 0.00 H ATOM 3279 H ASN B 94 30.342 12.520 10.885 1.00 0.00 H ATOM 3280 N CYS B 95 26.676 13.426 9.999 1.00 22.27 N ATOM 3281 CA CYS B 95 25.372 12.766 9.985 1.00 21.42 C ATOM 3282 C CYS B 95 24.647 13.005 8.675 1.00 21.05 C ATOM 3283 O CYS B 95 24.353 14.150 8.312 1.00 21.77 O ATOM 3284 CB CYS B 95 24.509 13.237 11.157 1.00 21.32 C ATOM 3285 SG CYS B 95 25.216 12.891 12.773 1.00 20.33 S ATOM 3286 HA CYS B 95 25.547 11.695 10.088 1.00 0.00 H ATOM 3287 HB2 CYS B 95 23.542 12.739 11.092 1.00 0.00 H ATOM 3288 HB3 CYS B 95 24.368 14.314 11.068 1.00 0.00 H ATOM 3289 H CYS B 95 26.782 14.319 10.522 1.00 0.00 H ATOM 3290 N ALA B 96 24.350 11.919 7.973 1.00 19.99 N ATOM 3291 CA ALA B 96 23.727 12.006 6.660 1.00 18.57 C ATOM 3292 C ALA B 96 22.329 11.421 6.699 1.00 17.60 C ATOM 3293 O ALA B 96 22.110 10.337 7.251 1.00 17.77 O ATOM 3294 CB ALA B 96 24.576 11.304 5.617 1.00 18.62 C ATOM 3295 HA ALA B 96 23.651 13.057 6.382 1.00 0.00 H ATOM 3296 HB1 ALA B 96 25.558 11.774 5.574 1.00 0.00 H ATOM 3297 HB2 ALA B 96 24.686 10.254 5.887 1.00 0.00 H ATOM 3298 HB3 ALA B 96 24.091 11.382 4.644 1.00 0.00 H ATOM 3299 H ALA B 96 24.568 10.983 8.370 1.00 0.00 H ATOM 3300 N TYR B 97 21.393 12.152 6.103 1.00 15.69 N ATOM 3301 CA TYR B 97 19.990 11.792 6.112 1.00 14.19 C ATOM 3302 C TYR B 97 19.397 11.782 4.712 1.00 13.85 C ATOM 3303 O TYR B 97 19.766 12.600 3.858 1.00 14.02 O ATOM 3304 CB TYR B 97 19.213 12.775 7.001 1.00 13.30 C ATOM 3305 CG TYR B 97 19.590 12.686 8.458 1.00 12.69 C ATOM 3306 CD1 TYR B 97 18.958 11.776 9.302 1.00 11.99 C ATOM 3307 CD2 TYR B 97 20.589 13.501 8.995 1.00 12.16 C ATOM 3308 CE1 TYR B 97 19.303 11.681 10.638 1.00 10.97 C ATOM 3309 CE2 TYR B 97 20.954 13.402 10.333 1.00 11.72 C ATOM 3310 CZ TYR B 97 20.300 12.492 11.151 1.00 11.55 C ATOM 3311 OH TYR B 97 20.647 12.387 12.478 1.00 11.69 O ATOM 3312 HA TYR B 97 19.907 10.781 6.511 1.00 0.00 H ATOM 3313 HB3 TYR B 97 18.148 12.562 6.905 1.00 0.00 H ATOM 3314 HB2 TYR B 97 19.412 13.789 6.653 1.00 0.00 H ATOM 3315 HD2 TYR B 97 21.091 14.227 8.355 1.00 0.00 H ATOM 3316 HE2 TYR B 97 21.746 14.033 10.735 1.00 0.00 H ATOM 3317 HE1 TYR B 97 18.791 10.969 11.285 1.00 0.00 H ATOM 3318 HD1 TYR B 97 18.178 11.128 8.903 1.00 0.00 H ATOM 3319 HH TYR B 97 20.086 11.696 12.911 1.00 0.00 H ATOM 3320 H TYR B 97 21.680 13.021 5.608 1.00 0.00 H ATOM 3321 N LYS B 98 18.496 10.834 4.478 1.00 13.08 N ATOM 3322 CA LYS B 98 17.613 10.877 3.328 1.00 12.61 C ATOM 3323 C LYS B 98 16.378 11.670 3.736 1.00 11.79 C ATOM 3324 O LYS B 98 15.738 11.382 4.764 1.00 11.62 O ATOM 3325 CB LYS B 98 17.220 9.469 2.868 1.00 13.07 C ATOM 3326 CG LYS B 98 16.043 9.410 1.870 1.00 14.13 C ATOM 3327 CD LYS B 98 16.417 9.963 0.497 1.00 14.85 C ATOM 3328 CE LYS B 98 15.209 10.035 -0.433 1.00 15.16 C ATOM 3329 NZ LYS B 98 15.615 10.394 -1.826 1.00 16.06 N ATOM 3330 HA LYS B 98 18.120 11.350 2.487 1.00 0.00 H ATOM 3331 HB2 LYS B 98 18.089 9.014 2.393 1.00 0.00 H ATOM 3332 HB3 LYS B 98 16.945 8.890 3.750 1.00 0.00 H ATOM 3333 HG2 LYS B 98 15.731 8.372 1.757 1.00 0.00 H ATOM 3334 HG3 LYS B 98 15.215 9.995 2.270 1.00 0.00 H ATOM 3335 HD2 LYS B 98 16.828 10.965 0.620 1.00 0.00 H ATOM 3336 HD3 LYS B 98 17.170 9.315 0.048 1.00 0.00 H ATOM 3337 HE2 LYS B 98 14.517 10.790 -0.059 1.00 0.00 H ATOM 3338 HE3 LYS B 98 14.713 9.064 -0.447 1.00 0.00 H ATOM 3339 HZ1 LYS B 98 16.084 11.322 -1.821 1.00 0.00 H ATOM 3340 HZ2 LYS B 98 16.271 9.674 -2.191 1.00 0.00 H ATOM 3341 HZ3 LYS B 98 14.771 10.435 -2.432 1.00 0.00 H ATOM 3342 H LYS B 98 18.421 10.036 5.140 1.00 0.00 H ATOM 3343 N THR B 99 16.068 12.674 2.928 1.00 11.01 N ATOM 3344 CA THR B 99 14.886 13.503 3.102 1.00 10.09 C ATOM 3345 C THR B 99 13.750 12.910 2.277 1.00 10.09 C ATOM 3346 O THR B 99 13.879 12.749 1.053 1.00 9.41 O ATOM 3347 CB THR B 99 15.163 14.949 2.631 1.00 10.20 C ATOM 3348 OG1 THR B 99 16.186 15.529 3.448 1.00 9.70 O ATOM 3349 CG2 THR B 99 13.915 15.805 2.722 1.00 9.30 C ATOM 3350 HA THR B 99 14.616 13.529 4.158 1.00 0.00 H ATOM 3351 HB THR B 99 15.484 14.911 1.590 1.00 0.00 H ATOM 3352 HG1 THR B 99 17.014 14.991 3.370 1.00 0.00 H ATOM 3353 HG23 THR B 99 13.131 15.369 2.102 1.00 0.00 H ATOM 3354 HG21 THR B 99 13.579 15.847 3.758 1.00 0.00 H ATOM 3355 HG22 THR B 99 14.140 16.812 2.371 1.00 0.00 H ATOM 3356 H THR B 99 16.702 12.879 2.129 1.00 0.00 H ATOM 3357 N THR B 100 12.649 12.577 2.945 1.00 9.73 N ATOM 3358 CA THR B 100 11.475 12.066 2.254 1.00 10.61 C ATOM 3359 C THR B 100 10.276 12.931 2.590 1.00 10.76 C ATOM 3360 O THR B 100 9.889 13.048 3.757 1.00 10.79 O ATOM 3361 CB THR B 100 11.187 10.587 2.602 1.00 10.54 C ATOM 3362 OG1 THR B 100 12.339 9.794 2.292 1.00 11.38 O ATOM 3363 CG2 THR B 100 9.988 10.061 1.802 1.00 11.11 C ATOM 3364 HA THR B 100 11.673 12.106 1.183 1.00 0.00 H ATOM 3365 HB THR B 100 10.956 10.521 3.665 1.00 0.00 H ATOM 3366 HG1 THR B 100 13.111 10.115 2.822 1.00 0.00 H ATOM 3367 HG23 THR B 100 9.107 10.660 2.033 1.00 0.00 H ATOM 3368 HG21 THR B 100 10.206 10.129 0.736 1.00 0.00 H ATOM 3369 HG22 THR B 100 9.802 9.021 2.070 1.00 0.00 H ATOM 3370 H THR B 100 12.627 12.684 3.979 1.00 0.00 H ATOM 3371 N GLN B 101 9.706 13.550 1.564 1.00 11.56 N ATOM 3372 CA GLN B 101 8.499 14.338 1.741 1.00 12.22 C ATOM 3373 C GLN B 101 7.304 13.397 1.735 1.00 12.13 C ATOM 3374 O GLN B 101 7.119 12.601 0.807 1.00 11.77 O ATOM 3375 CB GLN B 101 8.407 15.437 0.684 1.00 13.03 C ATOM 3376 CG GLN B 101 9.642 16.342 0.710 1.00 15.55 C ATOM 3377 CD GLN B 101 9.421 17.704 0.082 1.00 19.03 C ATOM 3378 OE1 GLN B 101 8.414 18.369 0.337 1.00 21.55 O ATOM 3379 NE2 GLN B 101 10.379 18.138 -0.732 1.00 20.54 N ATOM 3380 HA GLN B 101 8.516 14.856 2.700 1.00 0.00 H ATOM 3381 HB2 GLN B 101 8.325 14.977 -0.301 1.00 0.00 H ATOM 3382 HB3 GLN B 101 7.520 16.041 0.876 1.00 0.00 H ATOM 3383 HG2 GLN B 101 9.939 16.487 1.749 1.00 0.00 H ATOM 3384 HG3 GLN B 101 10.446 15.841 0.170 1.00 0.00 H ATOM 3385 HE22 GLN B 101 11.212 17.543 -0.919 1.00 0.00 H ATOM 3386 HE21 GLN B 101 10.296 19.072 -1.182 1.00 0.00 H ATOM 3387 H GLN B 101 10.130 13.470 0.618 1.00 0.00 H ATOM 3388 N VAL B 102 6.519 13.459 2.802 1.00 12.25 N ATOM 3389 CA VAL B 102 5.404 12.534 2.951 1.00 12.00 C ATOM 3390 C VAL B 102 4.116 13.226 3.385 1.00 11.80 C ATOM 3391 O VAL B 102 4.147 14.285 4.003 1.00 11.21 O ATOM 3392 CB VAL B 102 5.770 11.264 3.831 1.00 13.30 C ATOM 3393 CG1 VAL B 102 7.222 11.263 4.309 1.00 13.73 C ATOM 3394 CG2 VAL B 102 4.798 11.038 4.968 1.00 13.29 C ATOM 3395 HA VAL B 102 5.199 12.143 1.954 1.00 0.00 H ATOM 3396 HB VAL B 102 5.669 10.410 3.161 1.00 0.00 H ATOM 3397 HG11 VAL B 102 7.887 11.270 3.446 1.00 0.00 H ATOM 3398 HG12 VAL B 102 7.404 12.150 4.916 1.00 0.00 H ATOM 3399 HG13 VAL B 102 7.407 10.369 4.904 1.00 0.00 H ATOM 3400 HG21 VAL B 102 4.799 11.909 5.623 1.00 0.00 H ATOM 3401 HG22 VAL B 102 3.797 10.886 4.564 1.00 0.00 H ATOM 3402 HG23 VAL B 102 5.101 10.156 5.533 1.00 0.00 H ATOM 3403 H VAL B 102 6.701 14.172 3.537 1.00 0.00 H ATOM 3404 N GLU B 103 2.988 12.626 3.020 1.00 11.11 N ATOM 3405 CA GLU B 103 1.695 13.054 3.519 1.00 11.04 C ATOM 3406 C GLU B 103 0.995 11.835 4.096 1.00 11.18 C ATOM 3407 O GLU B 103 0.449 11.008 3.368 1.00 10.90 O ATOM 3408 CB GLU B 103 0.871 13.747 2.430 1.00 10.98 C ATOM 3409 CG GLU B 103 1.479 15.081 2.014 1.00 12.11 C ATOM 3410 CD GLU B 103 0.581 15.917 1.130 1.00 12.16 C ATOM 3411 OE1 GLU B 103 -0.630 16.032 1.415 1.00 12.16 O ATOM 3412 OE2 GLU B 103 1.110 16.491 0.160 1.00 13.68 O ATOM 3413 HA GLU B 103 1.819 13.802 4.302 1.00 0.00 H ATOM 3414 HB2 GLU B 103 0.822 13.095 1.558 1.00 0.00 H ATOM 3415 HB3 GLU B 103 -0.136 13.922 2.808 1.00 0.00 H ATOM 3416 HG2 GLU B 103 1.702 15.652 2.915 1.00 0.00 H ATOM 3417 HG3 GLU B 103 2.404 14.883 1.473 1.00 0.00 H ATOM 3418 H GLU B 103 3.034 11.826 2.357 1.00 0.00 H ATOM 3419 N LYS B 104 1.060 11.720 5.420 1.00 11.31 N ATOM 3420 CA LYS B 104 0.489 10.591 6.147 1.00 12.04 C ATOM 3421 C LYS B 104 -0.150 11.097 7.436 1.00 11.49 C ATOM 3422 O LYS B 104 0.132 12.216 7.874 1.00 11.74 O ATOM 3423 CB LYS B 104 1.580 9.565 6.496 1.00 12.19 C ATOM 3424 CG LYS B 104 2.120 8.754 5.325 1.00 13.35 C ATOM 3425 CD LYS B 104 3.365 7.969 5.735 1.00 13.39 C ATOM 3426 CE LYS B 104 4.030 7.306 4.527 1.00 16.15 C ATOM 3427 NZ LYS B 104 5.117 6.330 4.892 1.00 17.68 N ATOM 3428 HA LYS B 104 -0.259 10.110 5.517 1.00 0.00 H ATOM 3429 HB2 LYS B 104 2.415 10.103 6.945 1.00 0.00 H ATOM 3430 HB3 LYS B 104 1.165 8.868 7.224 1.00 0.00 H ATOM 3431 HG2 LYS B 104 1.352 8.057 4.989 1.00 0.00 H ATOM 3432 HG3 LYS B 104 2.376 9.431 4.510 1.00 0.00 H ATOM 3433 HD2 LYS B 104 4.076 8.650 6.202 1.00 0.00 H ATOM 3434 HD3 LYS B 104 3.079 7.198 6.450 1.00 0.00 H ATOM 3435 HE2 LYS B 104 4.464 8.086 3.902 1.00 0.00 H ATOM 3436 HE3 LYS B 104 3.265 6.773 3.962 1.00 0.00 H ATOM 3437 HZ1 LYS B 104 5.862 6.825 5.422 1.00 0.00 H ATOM 3438 HZ2 LYS B 104 4.717 5.571 5.480 1.00 0.00 H ATOM 3439 HZ3 LYS B 104 5.520 5.922 4.025 1.00 0.00 H ATOM 3440 H LYS B 104 1.539 12.468 5.961 1.00 0.00 H ATOM 3441 N HIS B 105 -1.018 10.276 8.026 1.00 11.35 N ATOM 3442 CA HIS B 105 -1.522 10.529 9.375 1.00 10.87 C ATOM 3443 C HIS B 105 -0.351 10.374 10.341 1.00 10.80 C ATOM 3444 O HIS B 105 0.500 9.511 10.149 1.00 11.07 O ATOM 3445 CB HIS B 105 -2.653 9.546 9.740 1.00 11.11 C ATOM 3446 CG HIS B 105 -3.857 9.634 8.848 1.00 12.72 C ATOM 3447 ND1 HIS B 105 -4.975 10.370 9.178 1.00 13.92 N ATOM 3448 CD2 HIS B 105 -4.114 9.080 7.640 1.00 14.24 C ATOM 3449 CE1 HIS B 105 -5.871 10.263 8.210 1.00 15.19 C ATOM 3450 NE2 HIS B 105 -5.370 9.489 7.264 1.00 15.42 N ATOM 3451 HA HIS B 105 -1.940 11.534 9.433 1.00 0.00 H ATOM 3452 HB2 HIS B 105 -2.257 8.532 9.681 1.00 0.00 H ATOM 3453 HB3 HIS B 105 -2.969 9.753 10.763 1.00 0.00 H ATOM 3454 HD2 HIS B 105 -3.448 8.430 7.072 1.00 0.00 H ATOM 3455 HE1 HIS B 105 -6.854 10.733 8.196 1.00 0.00 H ATOM 3456 H HIS B 105 -1.346 9.433 7.513 1.00 0.00 H ATOM 3457 N ILE B 106 -0.295 11.223 11.361 1.00 9.81 N ATOM 3458 CA ILE B 106 0.778 11.132 12.353 1.00 9.44 C ATOM 3459 C ILE B 106 0.234 10.561 13.644 1.00 8.62 C ATOM 3460 O ILE B 106 -0.959 10.666 13.925 1.00 8.87 O ATOM 3461 CB ILE B 106 1.464 12.497 12.625 1.00 9.86 C ATOM 3462 CG1 ILE B 106 0.511 13.483 13.325 1.00 9.66 C ATOM 3463 CG2 ILE B 106 2.024 13.078 11.321 1.00 10.70 C ATOM 3464 CD1 ILE B 106 1.167 14.806 13.729 1.00 9.60 C ATOM 3465 HA ILE B 106 1.540 10.470 11.941 1.00 0.00 H ATOM 3466 HB ILE B 106 2.297 12.330 13.308 1.00 0.00 H ATOM 3467 HG12 ILE B 106 -0.314 13.702 12.647 1.00 0.00 H ATOM 3468 HG13 ILE B 106 0.123 13.004 14.224 1.00 0.00 H ATOM 3469 HD11 ILE B 106 1.988 14.608 14.419 1.00 0.00 H ATOM 3470 HD12 ILE B 106 1.551 15.306 12.840 1.00 0.00 H ATOM 3471 HD13 ILE B 106 0.428 15.443 14.215 1.00 0.00 H ATOM 3472 HG21 ILE B 106 2.756 12.388 10.902 1.00 0.00 H ATOM 3473 HG22 ILE B 106 1.210 13.222 10.610 1.00 0.00 H ATOM 3474 HG23 ILE B 106 2.502 14.035 11.527 1.00 0.00 H ATOM 3475 H ILE B 106 -1.022 11.961 11.456 1.00 0.00 H ATOM 3476 N ILE B 107 1.115 9.946 14.422 1.00 7.64 N ATOM 3477 CA ILE B 107 0.736 9.445 15.736 1.00 7.25 C ATOM 3478 C ILE B 107 1.698 10.076 16.708 1.00 7.07 C ATOM 3479 O ILE B 107 2.910 9.917 16.562 1.00 6.96 O ATOM 3480 CB ILE B 107 0.825 7.913 15.819 1.00 7.15 C ATOM 3481 CG1 ILE B 107 -0.177 7.265 14.854 1.00 7.89 C ATOM 3482 CG2 ILE B 107 0.570 7.439 17.260 1.00 7.86 C ATOM 3483 CD1 ILE B 107 -0.020 5.759 14.726 1.00 7.75 C ATOM 3484 HA ILE B 107 -0.301 9.699 15.956 1.00 0.00 H ATOM 3485 HB ILE B 107 1.830 7.608 15.528 1.00 0.00 H ATOM 3486 HG12 ILE B 107 -1.185 7.476 15.212 1.00 0.00 H ATOM 3487 HG13 ILE B 107 -0.042 7.710 13.868 1.00 0.00 H ATOM 3488 HD11 ILE B 107 0.980 5.529 14.357 1.00 0.00 H ATOM 3489 HD12 ILE B 107 -0.164 5.296 15.702 1.00 0.00 H ATOM 3490 HD13 ILE B 107 -0.763 5.376 14.027 1.00 0.00 H ATOM 3491 HG21 ILE B 107 1.318 7.875 17.922 1.00 0.00 H ATOM 3492 HG22 ILE B 107 -0.425 7.755 17.575 1.00 0.00 H ATOM 3493 HG23 ILE B 107 0.637 6.352 17.301 1.00 0.00 H ATOM 3494 H ILE B 107 2.092 9.820 14.088 1.00 0.00 H ATOM 3495 N VAL B 108 1.154 10.804 17.680 1.00 7.01 N ATOM 3496 CA VAL B 108 1.969 11.453 18.701 1.00 7.18 C ATOM 3497 C VAL B 108 1.588 10.949 20.080 1.00 7.23 C ATOM 3498 O VAL B 108 0.426 10.592 20.328 1.00 7.93 O ATOM 3499 CB VAL B 108 1.863 13.008 18.667 1.00 6.92 C ATOM 3500 CG1 VAL B 108 2.487 13.566 17.392 1.00 7.59 C ATOM 3501 CG2 VAL B 108 0.407 13.480 18.819 1.00 7.47 C ATOM 3502 HA VAL B 108 3.004 11.193 18.480 1.00 0.00 H ATOM 3503 HB VAL B 108 2.422 13.395 19.519 1.00 0.00 H ATOM 3504 HG11 VAL B 108 3.539 13.284 17.350 1.00 0.00 H ATOM 3505 HG12 VAL B 108 1.966 13.159 16.526 1.00 0.00 H ATOM 3506 HG13 VAL B 108 2.400 14.653 17.392 1.00 0.00 H ATOM 3507 HG21 VAL B 108 -0.192 13.076 18.003 1.00 0.00 H ATOM 3508 HG22 VAL B 108 0.010 13.128 19.771 1.00 0.00 H ATOM 3509 HG23 VAL B 108 0.375 14.569 18.790 1.00 0.00 H ATOM 3510 H VAL B 108 0.120 10.913 17.713 1.00 0.00 H ATOM 3511 N ALA B 109 2.576 10.890 20.959 1.00 6.95 N ATOM 3512 CA ALA B 109 2.298 10.670 22.369 1.00 6.96 C ATOM 3513 C ALA B 109 2.015 12.044 22.961 1.00 7.59 C ATOM 3514 O ALA B 109 2.690 13.023 22.629 1.00 8.13 O ATOM 3515 CB ALA B 109 3.482 10.018 23.049 1.00 7.29 C ATOM 3516 HA ALA B 109 1.450 10.000 22.511 1.00 0.00 H ATOM 3517 HB1 ALA B 109 3.689 9.058 22.575 1.00 0.00 H ATOM 3518 HB2 ALA B 109 4.354 10.665 22.957 1.00 0.00 H ATOM 3519 HB3 ALA B 109 3.253 9.862 24.103 1.00 0.00 H ATOM 3520 H ALA B 109 3.559 11.002 20.638 1.00 0.00 H ATOM 3521 N CYS B 110 1.014 12.123 23.831 1.00 7.84 N ATOM 3522 CA CYS B 110 0.687 13.398 24.457 1.00 8.13 C ATOM 3523 C CYS B 110 0.879 13.361 25.964 1.00 8.08 C ATOM 3524 O CYS B 110 0.742 12.308 26.585 1.00 8.81 O ATOM 3525 CB CYS B 110 -0.734 13.821 24.099 1.00 8.09 C ATOM 3526 SG CYS B 110 -1.005 13.971 22.308 1.00 9.37 S ATOM 3527 HA CYS B 110 1.382 14.141 24.066 1.00 0.00 H ATOM 3528 HB2 CYS B 110 -0.936 14.787 24.563 1.00 0.00 H ATOM 3529 HB3 CYS B 110 -1.427 13.078 24.494 1.00 0.00 H ATOM 3530 H CYS B 110 0.462 11.273 24.066 1.00 0.00 H ATOM 3531 N GLY B 111 1.234 14.508 26.538 1.00 8.03 N ATOM 3532 CA GLY B 111 1.465 14.609 27.982 1.00 7.46 C ATOM 3533 C GLY B 111 1.331 16.037 28.464 1.00 7.17 C ATOM 3534 O GLY B 111 1.272 16.963 27.664 1.00 7.24 O ATOM 3535 HA3 GLY B 111 2.470 14.251 28.207 1.00 0.00 H ATOM 3536 HA2 GLY B 111 0.735 13.989 28.502 1.00 0.00 H ATOM 3537 H GLY B 111 1.351 15.355 25.946 1.00 0.00 H ATOM 3538 N GLY B 112 1.283 16.218 29.782 1.00 7.21 N ATOM 3539 CA GLY B 112 1.079 17.550 30.337 1.00 7.36 C ATOM 3540 C GLY B 112 -0.388 17.909 30.455 1.00 7.46 C ATOM 3541 O GLY B 112 -1.266 17.143 30.039 1.00 7.61 O ATOM 3542 HA3 GLY B 112 1.567 18.278 29.689 1.00 0.00 H ATOM 3543 HA2 GLY B 112 1.530 17.589 31.329 1.00 0.00 H ATOM 3544 H GLY B 112 1.392 15.404 30.420 1.00 0.00 H ATOM 3545 N LYS B 113 -0.649 19.065 31.062 1.00 7.75 N ATOM 3546 CA LYS B 113 -1.999 19.607 31.195 1.00 8.17 C ATOM 3547 C LYS B 113 -1.944 21.101 30.889 1.00 8.46 C ATOM 3548 O LYS B 113 -1.423 21.868 31.695 1.00 8.37 O ATOM 3549 CB LYS B 113 -2.543 19.387 32.612 1.00 8.19 C ATOM 3550 CG LYS B 113 -2.700 17.932 33.005 1.00 8.94 C ATOM 3551 CD LYS B 113 -3.894 17.301 32.319 1.00 10.92 C ATOM 3552 CE LYS B 113 -4.204 15.943 32.911 1.00 12.09 C ATOM 3553 NZ LYS B 113 -5.274 15.261 32.147 1.00 13.54 N ATOM 3554 HA LYS B 113 -2.665 19.096 30.500 1.00 0.00 H ATOM 3555 HB2 LYS B 113 -1.858 19.859 33.317 1.00 0.00 H ATOM 3556 HB3 LYS B 113 -3.520 19.866 32.680 1.00 0.00 H ATOM 3557 HG2 LYS B 113 -1.799 17.388 32.721 1.00 0.00 H ATOM 3558 HG3 LYS B 113 -2.836 17.868 34.085 1.00 0.00 H ATOM 3559 HD2 LYS B 113 -4.761 17.950 32.442 1.00 0.00 H ATOM 3560 HD3 LYS B 113 -3.676 17.186 31.257 1.00 0.00 H ATOM 3561 HE2 LYS B 113 -4.529 16.070 33.944 1.00 0.00 H ATOM 3562 HE3 LYS B 113 -3.303 15.330 32.888 1.00 0.00 H ATOM 3563 HZ1 LYS B 113 -6.138 15.840 32.170 1.00 0.00 H ATOM 3564 HZ2 LYS B 113 -4.967 15.133 31.162 1.00 0.00 H ATOM 3565 HZ3 LYS B 113 -5.466 14.333 32.575 1.00 0.00 H ATOM 3566 H LYS B 113 0.145 19.607 31.460 1.00 0.00 H ATOM 3567 N PRO B 114 -2.484 21.523 29.730 1.00 9.07 N ATOM 3568 CA PRO B 114 -3.175 20.701 28.735 1.00 9.49 C ATOM 3569 C PRO B 114 -2.274 19.667 28.069 1.00 9.18 C ATOM 3570 O PRO B 114 -1.065 19.879 27.937 1.00 9.55 O ATOM 3571 CB PRO B 114 -3.647 21.722 27.692 1.00 9.88 C ATOM 3572 CG PRO B 114 -2.745 22.895 27.873 1.00 10.78 C ATOM 3573 CD PRO B 114 -2.444 22.943 29.332 1.00 9.37 C ATOM 3574 HA PRO B 114 -3.974 20.121 29.197 1.00 0.00 H ATOM 3575 HD3 PRO B 114 -1.459 23.373 29.515 1.00 0.00 H ATOM 3576 HD2 PRO B 114 -3.197 23.521 29.868 1.00 0.00 H ATOM 3577 HG3 PRO B 114 -3.243 23.811 27.556 1.00 0.00 H ATOM 3578 HG2 PRO B 114 -1.828 22.763 27.298 1.00 0.00 H ATOM 3579 HB2 PRO B 114 -3.551 21.315 26.685 1.00 0.00 H ATOM 3580 HB3 PRO B 114 -4.685 22.004 27.872 1.00 0.00 H ATOM 3581 N SER B 115 -2.882 18.562 27.652 1.00 8.83 N ATOM 3582 CA SER B 115 -2.178 17.492 26.957 1.00 8.51 C ATOM 3583 C SER B 115 -1.688 18.004 25.609 1.00 8.12 C ATOM 3584 O SER B 115 -2.486 18.442 24.784 1.00 7.98 O ATOM 3585 CB SER B 115 -3.120 16.301 26.776 1.00 8.90 C ATOM 3586 OG SER B 115 -2.437 15.159 26.316 1.00 10.77 O ATOM 3587 HA SER B 115 -1.316 17.169 27.541 1.00 0.00 H ATOM 3588 HB2 SER B 115 -3.890 16.567 26.052 1.00 0.00 H ATOM 3589 HB3 SER B 115 -3.587 16.071 27.734 1.00 0.00 H ATOM 3590 HG SER B 115 -3.078 14.412 26.212 1.00 0.00 H ATOM 3591 H SER B 115 -3.901 18.456 27.829 1.00 0.00 H ATOM 3592 N VAL B 116 -0.371 17.977 25.423 1.00 7.37 N ATOM 3593 CA VAL B 116 0.274 18.432 24.181 1.00 7.46 C ATOM 3594 C VAL B 116 1.239 17.351 23.674 1.00 7.19 C ATOM 3595 O VAL B 116 1.628 16.473 24.444 1.00 7.38 O ATOM 3596 CB VAL B 116 1.045 19.762 24.389 1.00 7.55 C ATOM 3597 CG1 VAL B 116 0.071 20.917 24.682 1.00 7.62 C ATOM 3598 CG2 VAL B 116 2.101 19.623 25.501 1.00 8.26 C ATOM 3599 HA VAL B 116 -0.509 18.610 23.443 1.00 0.00 H ATOM 3600 HB VAL B 116 1.572 19.996 23.464 1.00 0.00 H ATOM 3601 HG11 VAL B 116 -0.614 21.035 23.843 1.00 0.00 H ATOM 3602 HG12 VAL B 116 -0.495 20.693 25.586 1.00 0.00 H ATOM 3603 HG13 VAL B 116 0.635 21.839 24.824 1.00 0.00 H ATOM 3604 HG21 VAL B 116 1.609 19.355 26.436 1.00 0.00 H ATOM 3605 HG22 VAL B 116 2.814 18.845 25.228 1.00 0.00 H ATOM 3606 HG23 VAL B 116 2.625 20.571 25.623 1.00 0.00 H ATOM 3607 H VAL B 116 0.231 17.618 26.191 1.00 0.00 H ATOM 3608 N PRO B 117 1.618 17.393 22.378 1.00 7.62 N ATOM 3609 CA PRO B 117 2.541 16.347 21.912 1.00 6.80 C ATOM 3610 C PRO B 117 3.901 16.390 22.607 1.00 7.02 C ATOM 3611 O PRO B 117 4.466 17.461 22.813 1.00 6.82 O ATOM 3612 CB PRO B 117 2.673 16.625 20.403 1.00 7.29 C ATOM 3613 CG PRO B 117 1.418 17.425 20.057 1.00 7.35 C ATOM 3614 CD PRO B 117 1.207 18.286 21.279 1.00 7.72 C ATOM 3615 HA PRO B 117 2.163 15.350 22.138 1.00 0.00 H ATOM 3616 HD3 PRO B 117 1.831 19.179 21.244 1.00 0.00 H ATOM 3617 HD2 PRO B 117 0.162 18.578 21.379 1.00 0.00 H ATOM 3618 HG3 PRO B 117 0.567 16.765 19.893 1.00 0.00 H ATOM 3619 HG2 PRO B 117 1.577 18.038 19.170 1.00 0.00 H ATOM 3620 HB2 PRO B 117 3.572 17.205 20.194 1.00 0.00 H ATOM 3621 HB3 PRO B 117 2.705 15.693 19.839 1.00 0.00 H ATOM 3622 N VAL B 118 4.394 15.218 22.992 1.00 6.85 N ATOM 3623 CA VAL B 118 5.692 15.116 23.653 1.00 7.41 C ATOM 3624 C VAL B 118 6.653 14.167 22.926 1.00 7.63 C ATOM 3625 O VAL B 118 7.857 14.234 23.125 1.00 8.07 O ATOM 3626 CB VAL B 118 5.540 14.749 25.160 1.00 7.24 C ATOM 3627 CG1 VAL B 118 4.889 15.900 25.920 1.00 7.10 C ATOM 3628 CG2 VAL B 118 4.735 13.449 25.345 1.00 7.67 C ATOM 3629 HA VAL B 118 6.146 16.106 23.602 1.00 0.00 H ATOM 3630 HB VAL B 118 6.536 14.578 25.568 1.00 0.00 H ATOM 3631 HG11 VAL B 118 5.511 16.791 25.830 1.00 0.00 H ATOM 3632 HG12 VAL B 118 3.903 16.100 25.500 1.00 0.00 H ATOM 3633 HG13 VAL B 118 4.789 15.629 26.971 1.00 0.00 H ATOM 3634 HG21 VAL B 118 3.740 13.575 24.918 1.00 0.00 H ATOM 3635 HG22 VAL B 118 5.248 12.631 24.840 1.00 0.00 H ATOM 3636 HG23 VAL B 118 4.649 13.224 26.408 1.00 0.00 H ATOM 3637 H VAL B 118 3.843 14.353 22.819 1.00 0.00 H ATOM 3638 N HIS B 119 6.106 13.306 22.068 1.00 8.02 N ATOM 3639 CA HIS B 119 6.865 12.266 21.386 1.00 9.36 C ATOM 3640 C HIS B 119 6.203 12.068 20.029 1.00 8.43 C ATOM 3641 O HIS B 119 4.981 12.074 19.936 1.00 8.57 O ATOM 3642 CB HIS B 119 6.738 11.009 22.254 1.00 10.85 C ATOM 3643 CG HIS B 119 7.512 9.819 21.794 1.00 14.88 C ATOM 3644 ND1 HIS B 119 8.694 9.433 22.392 1.00 19.04 N ATOM 3645 CD2 HIS B 119 7.222 8.862 20.880 1.00 17.89 C ATOM 3646 CE1 HIS B 119 9.122 8.314 21.836 1.00 19.86 C ATOM 3647 NE2 HIS B 119 8.249 7.949 20.911 1.00 19.87 N ATOM 3648 HA HIS B 119 7.918 12.506 21.241 1.00 0.00 H ATOM 3649 HB2 HIS B 119 7.078 11.261 23.259 1.00 0.00 H ATOM 3650 HB3 HIS B 119 5.685 10.730 22.287 1.00 0.00 H ATOM 3651 HD2 HIS B 119 6.340 8.823 20.240 1.00 0.00 H ATOM 3652 HE1 HIS B 119 10.038 7.782 22.095 1.00 0.00 H ATOM 3653 H HIS B 119 5.087 13.380 21.876 1.00 0.00 H ATOM 3654 N PHE B 120 7.000 11.933 18.976 1.00 7.79 N ATOM 3655 CA PHE B 120 6.443 11.595 17.665 1.00 7.13 C ATOM 3656 C PHE B 120 6.584 10.097 17.495 1.00 7.52 C ATOM 3657 O PHE B 120 7.687 9.600 17.304 1.00 7.31 O ATOM 3658 CB PHE B 120 7.172 12.332 16.535 1.00 6.63 C ATOM 3659 CG PHE B 120 6.516 12.162 15.194 1.00 6.72 C ATOM 3660 CD1 PHE B 120 6.663 10.987 14.471 1.00 5.71 C ATOM 3661 CD2 PHE B 120 5.732 13.178 14.665 1.00 6.74 C ATOM 3662 CE1 PHE B 120 6.038 10.830 13.231 1.00 6.50 C ATOM 3663 CE2 PHE B 120 5.108 13.029 13.439 1.00 6.08 C ATOM 3664 CZ PHE B 120 5.259 11.857 12.721 1.00 5.08 C ATOM 3665 HA PHE B 120 5.398 11.901 17.614 1.00 0.00 H ATOM 3666 HB2 PHE B 120 7.198 13.395 16.775 1.00 0.00 H ATOM 3667 HB3 PHE B 120 8.191 11.950 16.473 1.00 0.00 H ATOM 3668 HD2 PHE B 120 5.606 14.106 15.223 1.00 0.00 H ATOM 3669 HE2 PHE B 120 4.496 13.837 13.038 1.00 0.00 H ATOM 3670 HZ PHE B 120 4.766 11.741 11.756 1.00 0.00 H ATOM 3671 HE1 PHE B 120 6.162 9.905 12.668 1.00 0.00 H ATOM 3672 HD1 PHE B 120 7.272 10.178 14.874 1.00 0.00 H ATOM 3673 H PHE B 120 8.026 12.068 19.083 1.00 0.00 H ATOM 3674 N ASP B 121 5.467 9.379 17.557 1.00 6.76 N ATOM 3675 CA ASP B 121 5.526 7.926 17.629 1.00 7.39 C ATOM 3676 C ASP B 121 5.744 7.259 16.275 1.00 7.24 C ATOM 3677 O ASP B 121 6.560 6.335 16.145 1.00 7.65 O ATOM 3678 CB ASP B 121 4.266 7.380 18.292 1.00 7.18 C ATOM 3679 CG ASP B 121 4.472 6.002 18.861 1.00 8.05 C ATOM 3680 OD1 ASP B 121 5.419 5.832 19.659 1.00 11.42 O ATOM 3681 OD2 ASP B 121 3.689 5.096 18.520 1.00 7.91 O ATOM 3682 HA ASP B 121 6.399 7.682 18.235 1.00 0.00 H ATOM 3683 HB2 ASP B 121 3.974 8.053 19.098 1.00 0.00 H ATOM 3684 HB3 ASP B 121 3.469 7.338 17.550 1.00 0.00 H ATOM 3685 H ASP B 121 4.544 9.859 17.554 1.00 0.00 H ATOM 3686 N ALA B 122 4.997 7.723 15.279 1.00 7.61 N ATOM 3687 CA ALA B 122 4.968 7.085 13.970 1.00 7.79 C ATOM 3688 C ALA B 122 4.098 7.872 13.013 1.00 8.41 C ATOM 3689 O ALA B 122 3.347 8.754 13.427 1.00 8.95 O ATOM 3690 CB ALA B 122 4.416 5.658 14.095 1.00 7.96 C ATOM 3691 HA ALA B 122 5.986 7.053 13.582 1.00 0.00 H ATOM 3692 HB1 ALA B 122 5.055 5.080 14.763 1.00 0.00 H ATOM 3693 HB2 ALA B 122 3.405 5.695 14.500 1.00 0.00 H ATOM 3694 HB3 ALA B 122 4.398 5.189 13.111 1.00 0.00 H ATOM 3695 H ALA B 122 4.414 8.569 15.439 1.00 0.00 H ATOM 3696 N SER B 123 4.188 7.540 11.733 1.00 8.86 N ATOM 3697 CA SER B 123 3.180 7.974 10.785 1.00 9.40 C ATOM 3698 C SER B 123 2.555 6.718 10.211 1.00 9.52 C ATOM 3699 O SER B 123 3.195 5.660 10.180 1.00 9.82 O ATOM 3700 CB SER B 123 3.765 8.859 9.676 1.00 9.65 C ATOM 3701 OG SER B 123 4.763 8.172 8.947 1.00 11.26 O ATOM 3702 HA SER B 123 2.436 8.592 11.287 1.00 0.00 H ATOM 3703 HB2 SER B 123 4.203 9.750 10.126 1.00 0.00 H ATOM 3704 HB3 SER B 123 2.965 9.152 8.996 1.00 0.00 H ATOM 3705 HG SER B 123 5.494 7.907 9.560 1.00 0.00 H ATOM 3706 H SER B 123 4.989 6.963 11.405 1.00 0.00 H ATOM 3707 N VAL B 124 1.299 6.826 9.798 1.00 9.44 N ATOM 3708 CA VAL B 124 0.566 5.672 9.286 1.00 9.83 C ATOM 3709 C VAL B 124 -0.101 6.015 7.954 1.00 9.78 C ATOM 3710 O VAL B 124 -0.482 7.159 7.697 1.00 9.60 O ATOM 3711 CB VAL B 124 -0.455 5.113 10.331 1.00 10.15 C ATOM 3712 CG1 VAL B 124 -1.421 6.195 10.804 1.00 11.38 C ATOM 3713 CG2 VAL B 124 -1.204 3.893 9.785 1.00 11.36 C ATOM 3714 HA VAL B 124 1.282 4.870 9.106 1.00 0.00 H ATOM 3715 OXT VAL B 124 -0.252 5.139 7.104 1.00 9.67 O ATOM 3716 HB VAL B 124 0.116 4.784 11.200 1.00 0.00 H ATOM 3717 HG11 VAL B 124 -0.858 7.004 11.270 1.00 0.00 H ATOM 3718 HG12 VAL B 124 -1.977 6.582 9.950 1.00 0.00 H ATOM 3719 HG13 VAL B 124 -2.115 5.769 11.529 1.00 0.00 H ATOM 3720 HG21 VAL B 124 -1.750 4.176 8.885 1.00 0.00 H ATOM 3721 HG22 VAL B 124 -0.489 3.106 9.545 1.00 0.00 H ATOM 3722 HG23 VAL B 124 -1.905 3.532 10.538 1.00 0.00 H ATOM 3723 H VAL B 124 0.827 7.752 9.840 1.00 0.00 H TER 3724 VAL B 124 HETATM 3725 O HOH 1 26.412 21.814 4.954 1.00 23.67 O HETATM 3726 O HOH 2 16.610 25.183 1.803 1.00 30.08 O HETATM 3727 O HOH 3 16.031 22.379 2.131 1.00 26.84 O HETATM 3728 O HOH 4 3.255 22.395 0.531 1.00 42.18 O HETATM 3729 O HOH 5 8.836 21.633 0.705 1.00 28.99 O HETATM 3730 O HOH 6 10.226 23.805 -2.654 1.00 38.29 O HETATM 3731 O HOH 7 12.778 26.554 -4.554 1.00 39.15 O HETATM 3732 O HOH 8 16.451 27.725 -6.909 1.00 47.58 O HETATM 3733 O HOH 9 16.021 32.254 -3.012 1.00 52.11 O HETATM 3734 O HOH 10 15.157 33.764 0.619 1.00 13.89 O HETATM 3735 O HOH 11 16.542 31.813 4.078 1.00 13.41 O HETATM 3736 O HOH 12 13.076 33.960 5.315 1.00 24.91 O HETATM 3737 O HOH 13 15.014 41.407 2.193 1.00 28.19 O HETATM 3738 O HOH 14 17.525 40.888 3.306 1.00 18.53 O HETATM 3739 O HOH 15 20.504 38.034 0.640 1.00 12.90 O HETATM 3740 O HOH 16 27.450 37.914 0.579 1.00 16.38 O HETATM 3741 O HOH 17 28.976 40.479 0.561 1.00 18.14 O HETATM 3742 O HOH 18 30.677 43.307 0.706 1.00 22.40 O HETATM 3743 O HOH 19 27.938 43.378 -1.236 1.00 23.36 O HETATM 3744 O HOH 20 49.543 47.168 3.036 1.00 39.06 O HETATM 3745 O HOH 21 29.676 44.648 -4.313 1.00 34.00 O HETATM 3746 O HOH 22 31.965 41.142 -9.238 1.00 30.30 O HETATM 3747 O HOH 23 30.330 39.330 -10.357 1.00 24.85 O HETATM 3748 O HOH 24 33.797 41.313 -11.526 1.00 40.15 O HETATM 3749 O HOH 25 33.887 39.448 -13.464 1.00 35.34 O HETATM 3750 O HOH 26 36.327 35.718 -12.694 1.00 22.20 O HETATM 3751 O HOH 27 35.328 31.937 -11.677 1.00 29.56 O HETATM 3752 O HOH 28 33.263 30.002 -10.132 1.00 22.72 O HETATM 3753 O HOH 29 32.077 32.434 -10.291 1.00 23.01 O HETATM 3754 O HOH 30 31.439 35.558 -12.905 1.00 26.55 O HETATM 3755 O HOH 31 24.942 32.077 -8.672 1.00 40.50 O HETATM 3756 O HOH 32 26.276 31.196 -6.512 1.00 15.94 O HETATM 3757 O HOH 33 24.956 29.814 -4.603 1.00 23.30 O HETATM 3758 O HOH 34 22.437 26.476 -6.554 1.00 46.65 O HETATM 3759 O HOH 35 25.704 28.264 -9.277 1.00 34.70 O HETATM 3760 O HOH 36 19.231 33.838 -5.531 1.00 21.99 O HETATM 3761 O HOH 37 44.816 30.393 11.118 1.00 12.53 O HETATM 3762 O HOH 38 46.534 28.099 10.089 1.00 14.34 O HETATM 3763 O HOH 39 45.672 25.713 8.533 1.00 29.22 O HETATM 3764 O HOH 40 45.831 24.717 5.300 1.00 24.02 O HETATM 3765 O HOH 41 44.321 19.593 -0.511 1.00 36.91 O HETATM 3766 O HOH 42 41.982 22.388 1.328 1.00 23.19 O HETATM 3767 O HOH 43 45.095 23.862 -0.242 1.00 30.70 O HETATM 3768 O HOH 44 45.227 25.694 -2.578 1.00 24.70 O HETATM 3769 O HOH 45 46.933 27.634 -1.179 1.00 28.62 O HETATM 3770 O HOH 46 47.392 30.543 0.066 1.00 20.31 O HETATM 3771 O HOH 47 45.576 29.359 2.684 1.00 22.94 O HETATM 3772 O HOH 48 48.607 35.225 3.283 1.00 19.63 O HETATM 3773 O HOH 49 48.097 37.777 6.112 1.00 39.27 O HETATM 3774 O HOH 50 48.979 40.532 4.102 1.00 32.54 O HETATM 3775 O HOH 51 49.332 40.817 6.740 1.00 32.61 O HETATM 3776 O HOH 52 48.958 42.773 8.647 1.00 22.29 O HETATM 3777 O HOH 53 46.650 43.409 9.907 1.00 20.67 O HETATM 3778 O HOH 54 45.314 41.535 11.204 1.00 30.72 O HETATM 3779 O HOH 55 41.688 41.089 9.753 1.00 18.76 O HETATM 3780 O HOH 56 39.238 42.117 9.644 1.00 27.05 O HETATM 3781 O HOH 57 37.816 41.027 11.801 1.00 30.05 O HETATM 3782 O HOH 58 35.216 43.575 9.668 1.00 34.72 O HETATM 3783 O HOH 59 37.399 44.188 8.254 1.00 19.43 O HETATM 3784 O HOH 60 33.522 43.273 7.043 1.00 20.54 O HETATM 3785 O HOH 61 36.713 44.612 13.059 1.00 31.06 O HETATM 3786 O HOH 62 37.723 51.073 9.153 1.00 22.96 O HETATM 3787 O HOH 63 40.323 52.396 8.773 1.00 40.50 O HETATM 3788 O HOH 64 46.314 46.846 2.867 1.00 22.18 O HETATM 3789 O HOH 65 45.454 44.104 3.383 1.00 17.43 O HETATM 3790 O HOH 66 47.010 41.760 2.758 1.00 16.79 O HETATM 3791 O HOH 67 49.949 44.082 4.941 1.00 27.20 O HETATM 3792 O HOH 68 51.365 37.767 1.273 1.00 37.10 O HETATM 3793 O HOH 69 49.037 41.978 -3.918 1.00 32.41 O HETATM 3794 O HOH 70 21.246 42.594 7.800 1.00 41.06 O HETATM 3795 O HOH 71 20.097 43.134 10.495 1.00 32.30 O HETATM 3796 O HOH 72 40.208 39.980 -8.542 1.00 33.13 O HETATM 3797 O HOH 73 43.663 38.425 -6.850 1.00 30.98 O HETATM 3798 O HOH 74 45.767 37.376 -8.106 1.00 30.01 O HETATM 3799 O HOH 75 46.876 35.099 -8.731 1.00 37.16 O HETATM 3800 O HOH 76 48.381 33.264 -6.534 1.00 35.02 O HETATM 3801 O HOH 77 46.534 31.508 -6.215 1.00 25.86 O HETATM 3802 O HOH 78 42.885 29.216 -7.374 1.00 28.25 O HETATM 3803 O HOH 79 41.341 30.653 -5.850 1.00 17.65 O HETATM 3804 O HOH 80 39.405 30.969 -7.634 1.00 25.94 O HETATM 3805 O HOH 81 40.231 33.213 -7.179 1.00 23.29 O HETATM 3806 O HOH 82 36.947 30.795 -8.245 1.00 41.59 O HETATM 3807 O HOH 83 38.335 27.474 -9.959 1.00 35.67 O HETATM 3808 O HOH 84 40.160 30.396 -10.259 1.00 32.31 O HETATM 3809 O HOH 85 36.176 25.474 -6.581 1.00 17.24 O HETATM 3810 O HOH 86 36.270 21.765 -0.368 1.00 19.25 O HETATM 3811 O HOH 87 27.279 23.014 13.071 1.00 23.10 O HETATM 3812 O HOH 88 29.173 23.882 15.103 1.00 33.98 O HETATM 3813 O HOH 89 22.397 28.847 15.623 1.00 18.63 O HETATM 3814 O HOH 90 11.391 25.232 18.760 1.00 28.52 O HETATM 3815 O HOH 91 11.300 24.476 21.511 1.00 17.03 O HETATM 3816 O HOH 92 9.343 25.888 22.720 1.00 29.47 O HETATM 3817 O HOH 93 7.086 24.766 23.796 1.00 24.54 O HETATM 3818 O HOH 94 5.610 25.002 25.887 1.00 25.65 O HETATM 3819 O HOH 95 6.859 24.270 28.103 1.00 30.90 O HETATM 3820 O HOH 96 6.119 19.540 28.916 1.00 13.46 O HETATM 3821 O HOH 97 5.345 25.758 14.782 1.00 15.73 O HETATM 3822 O HOH 98 7.562 25.511 13.377 1.00 17.38 O HETATM 3823 O HOH 99 9.580 24.720 16.468 1.00 17.69 O HETATM 3824 O HOH 100 6.740 25.028 17.062 1.00 17.08 O HETATM 3825 O HOH 101 5.927 27.575 20.908 1.00 30.23 O HETATM 3826 O HOH 102 3.804 26.410 22.400 1.00 24.85 O HETATM 3827 O HOH 103 2.897 23.767 25.010 1.00 21.50 O HETATM 3828 O HOH 104 3.502 22.579 22.697 1.00 18.20 O HETATM 3829 O HOH 105 12.924 17.265 27.944 1.00 22.60 O HETATM 3830 O HOH 106 15.204 17.923 26.719 1.00 32.94 O HETATM 3831 O HOH 107 17.403 20.434 29.051 1.00 35.50 O HETATM 3832 O HOH 108 15.887 25.174 30.338 1.00 42.88 O HETATM 3833 O HOH 109 11.625 24.566 28.081 1.00 21.60 O HETATM 3834 O HOH 110 13.061 25.204 25.802 1.00 34.49 O HETATM 3835 O HOH 111 13.633 24.061 23.233 1.00 26.75 O HETATM 3836 O HOH 112 17.060 16.194 20.827 1.00 23.81 O HETATM 3837 O HOH 113 24.980 19.860 8.412 1.00 34.12 O HETATM 3838 O HOH 114 26.482 21.867 7.977 1.00 27.65 O HETATM 3839 O HOH 115 38.832 37.133 12.465 1.00 33.58 O HETATM 3840 O HOH 116 27.404 34.983 15.354 1.00 30.16 O HETATM 3841 O HOH 117 24.984 35.334 16.556 1.00 38.26 O HETATM 3842 O HOH 118 26.423 36.044 18.768 1.00 38.43 O HETATM 3843 O HOH 119 28.960 37.570 18.575 1.00 55.38 O HETATM 3844 O HOH 120 28.288 39.992 12.653 1.00 29.28 O HETATM 3845 O HOH 121 27.161 40.041 10.156 1.00 25.25 O HETATM 3846 O HOH 122 26.900 42.855 9.614 1.00 31.95 O HETATM 3847 O HOH 123 25.844 44.890 7.842 1.00 33.98 O HETATM 3848 O HOH 124 29.237 47.546 3.527 1.00 33.36 O HETATM 3849 O HOH 125 35.807 46.153 0.652 1.00 39.08 O HETATM 3850 O HOH 126 37.777 44.763 1.986 1.00 18.14 O HETATM 3851 O HOH 127 39.853 47.758 0.647 1.00 29.79 O HETATM 3852 O HOH 128 36.799 48.484 1.769 1.00 38.16 O HETATM 3853 O HOH 129 38.171 45.473 -4.062 1.00 28.48 O HETATM 3854 O HOH 130 43.142 48.028 -0.844 1.00 14.56 O HETATM 3855 O HOH 131 54.019 35.478 -6.043 1.00 45.02 O HETATM 3856 O HOH 132 28.353 30.274 17.629 1.00 27.25 O HETATM 3857 O HOH 133 24.222 24.726 19.798 1.00 31.36 O HETATM 3858 O HOH 134 25.304 32.831 17.158 1.00 26.00 O HETATM 3859 O HOH 135 17.654 31.885 17.347 1.00 36.28 O HETATM 3860 O HOH 136 15.902 31.725 14.544 1.00 38.68 O HETATM 3861 O HOH 137 17.791 29.989 13.814 1.00 21.74 O HETATM 3862 O HOH 138 17.686 30.817 11.231 1.00 17.00 O HETATM 3863 O HOH 139 12.002 25.264 6.770 1.00 34.03 O HETATM 3864 O HOH 140 8.336 25.517 6.067 1.00 46.22 O HETATM 3865 O HOH 141 4.990 28.999 4.517 1.00 31.58 O HETATM 3866 O HOH 142 2.928 30.385 4.730 1.00 28.07 O HETATM 3867 O HOH 143 3.920 32.661 3.741 1.00 45.28 O HETATM 3868 O HOH 144 1.838 33.172 2.049 1.00 40.51 O HETATM 3869 O HOH 145 3.616 33.025 0.072 1.00 46.39 O HETATM 3870 O HOH 146 3.885 31.953 -3.027 1.00 48.59 O HETATM 3871 O HOH 147 0.403 30.780 2.406 1.00 23.26 O HETATM 3872 O HOH 148 -1.186 25.951 3.409 1.00 30.11 O HETATM 3873 O HOH 149 9.871 14.952 21.009 1.00 14.65 O HETATM 3874 O HOH 150 30.744 47.498 6.571 1.00 34.07 O HETATM 3875 O HOH 151 32.267 49.647 5.178 1.00 32.78 O HETATM 3876 O HOH 152 14.464 39.995 20.043 1.00 33.05 O HETATM 3877 O HOH 153 16.596 40.570 16.094 1.00 32.51 O HETATM 3878 O HOH 154 19.082 39.727 16.402 1.00 26.49 O HETATM 3879 O HOH 155 20.471 40.935 14.283 1.00 22.46 O HETATM 3880 O HOH 156 10.484 36.997 17.365 1.00 29.11 O HETATM 3881 O HOH 157 10.327 37.253 20.493 1.00 27.66 O HETATM 3882 O HOH 158 10.570 30.450 19.688 1.00 36.17 O HETATM 3883 O HOH 159 5.397 22.118 29.661 1.00 27.82 O HETATM 3884 O HOH 160 12.124 29.425 -3.584 1.00 48.48 O HETATM 3885 O HOH 161 36.062 20.760 2.057 1.00 26.64 O HETATM 3886 O HOH 162 37.922 20.013 3.763 1.00 31.98 O HETATM 3887 O HOH 163 29.353 40.026 17.743 1.00 58.39 O HETATM 3888 O HOH 164 36.062 23.173 -8.283 1.00 31.30 O HETATM 3889 O HOH 165 -2.118 20.643 2.834 1.00 36.22 O HETATM 3890 O HOH 166 2.262 22.944 32.575 1.00 26.78 O HETATM 3891 O HOH 167 11.384 7.979 5.532 1.00 25.24 O HETATM 3892 O HOH 168 37.318 33.039 12.448 1.00 28.71 O HETATM 3893 O HOH 169 30.634 7.277 16.752 1.00 38.91 O HETATM 3894 O HOH 170 10.502 12.956 -1.207 1.00 25.24 O HETATM 3895 O HOH 171 13.558 16.316 -0.997 1.00 37.13 O HETATM 3896 O HOH 172 15.586 13.714 -1.265 1.00 34.71 O HETATM 3897 O HOH 173 17.746 13.411 0.738 1.00 14.59 O HETATM 3898 O HOH 174 19.020 15.467 3.823 1.00 17.47 O HETATM 3899 O HOH 175 22.604 13.072 2.845 1.00 29.64 O HETATM 3900 O HOH 176 25.571 14.559 3.506 1.00 42.12 O HETATM 3901 O HOH 177 24.845 18.903 4.289 1.00 29.46 O HETATM 3902 O HOH 178 24.663 22.913 3.286 1.00 19.13 O HETATM 3903 O HOH 179 21.290 22.801 0.814 1.00 18.69 O HETATM 3904 O HOH 180 18.736 22.600 2.024 1.00 58.41 O HETATM 3905 O HOH 181 18.297 20.994 0.305 1.00 51.47 O HETATM 3906 O HOH 182 18.626 24.516 0.314 1.00 29.57 O HETATM 3907 O HOH 183 11.400 19.196 3.520 1.00 30.45 O HETATM 3908 O HOH 184 7.703 17.592 3.044 1.00 18.76 O HETATM 3909 O HOH 185 5.239 16.919 2.859 1.00 19.30 O HETATM 3910 O HOH 186 3.818 17.170 0.601 1.00 25.74 O HETATM 3911 O HOH 187 5.845 19.915 2.520 1.00 37.40 O HETATM 3912 O HOH 188 16.692 19.365 -5.561 1.00 31.27 O HETATM 3913 O HOH 189 23.450 19.210 -1.204 1.00 20.62 O HETATM 3914 O HOH 190 21.789 16.355 0.158 1.00 19.56 O HETATM 3915 O HOH 191 27.993 16.952 0.716 1.00 36.05 O HETATM 3916 O HOH 192 29.917 21.608 2.630 1.00 25.67 O HETATM 3917 O HOH 193 32.303 23.158 3.008 1.00 19.38 O HETATM 3918 O HOH 194 35.038 23.111 2.839 1.00 20.47 O HETATM 3919 O HOH 195 35.102 23.277 5.484 1.00 24.72 O HETATM 3920 O HOH 196 32.498 23.876 6.524 1.00 16.88 O HETATM 3921 O HOH 197 32.969 23.129 9.442 1.00 29.58 O HETATM 3922 O HOH 198 34.702 24.169 11.288 1.00 17.05 O HETATM 3923 O HOH 199 37.078 22.775 10.514 1.00 38.23 O HETATM 3924 O HOH 200 40.033 23.944 9.994 1.00 23.56 O HETATM 3925 O HOH 201 41.337 22.778 6.503 1.00 25.59 O HETATM 3926 O HOH 202 41.090 26.285 6.796 1.00 15.30 O HETATM 3927 O HOH 203 39.734 28.587 7.207 1.00 11.41 O HETATM 3928 O HOH 204 43.371 29.406 13.086 1.00 16.80 O HETATM 3929 O HOH 205 30.496 23.363 10.348 1.00 30.18 O HETATM 3930 O HOH 206 26.278 20.596 14.894 1.00 31.33 O HETATM 3931 O HOH 207 23.806 20.720 16.039 1.00 35.43 O HETATM 3932 O HOH 208 21.762 25.009 15.939 1.00 21.98 O HETATM 3933 O HOH 209 19.481 27.359 18.009 1.00 40.26 O HETATM 3934 O HOH 210 17.867 25.431 17.080 1.00 22.19 O HETATM 3935 O HOH 211 16.136 24.660 18.865 1.00 32.59 O HETATM 3936 O HOH 212 3.637 18.732 28.442 1.00 22.90 O HETATM 3937 O HOH 213 0.784 21.694 28.472 1.00 26.00 O HETATM 3938 O HOH 214 1.895 20.356 31.774 1.00 21.81 O HETATM 3939 O HOH 215 -1.879 14.492 29.855 1.00 28.43 O HETATM 3940 O HOH 216 -1.150 12.212 28.539 1.00 33.93 O HETATM 3941 O HOH 217 -4.890 13.972 25.148 1.00 23.19 O HETATM 3942 O HOH 218 -6.773 16.211 25.540 1.00 28.18 O HETATM 3943 O HOH 219 -5.120 18.468 24.554 1.00 19.36 O HETATM 3944 O HOH 220 -5.662 18.772 21.843 1.00 20.89 O HETATM 3945 O HOH 221 -2.601 19.896 22.666 1.00 22.73 O HETATM 3946 O HOH 222 -4.722 23.125 19.038 1.00 23.69 O HETATM 3947 O HOH 223 -6.671 23.222 15.017 1.00 36.59 O HETATM 3948 O HOH 224 -7.536 20.325 13.828 1.00 40.49 O HETATM 3949 O HOH 225 -5.419 18.619 13.620 1.00 18.14 O HETATM 3950 O HOH 226 -5.445 18.451 10.935 1.00 27.63 O HETATM 3951 O HOH 227 -5.507 15.908 11.583 1.00 25.49 O HETATM 3952 O HOH 228 -3.296 19.433 9.548 1.00 22.41 O HETATM 3953 O HOH 229 -3.623 21.370 6.408 1.00 34.71 O HETATM 3954 O HOH 230 -5.607 22.941 8.778 1.00 22.52 O HETATM 3955 O HOH 231 -5.049 25.337 7.800 1.00 20.27 O HETATM 3956 O HOH 232 -1.777 23.391 9.282 1.00 12.88 O HETATM 3957 O HOH 233 -4.066 25.992 11.972 1.00 26.55 O HETATM 3958 O HOH 234 -6.554 24.677 11.843 1.00 25.50 O HETATM 3959 O HOH 235 -0.439 28.925 12.573 1.00 13.86 O HETATM 3960 O HOH 236 2.064 27.342 13.518 1.00 11.03 O HETATM 3961 O HOH 237 4.269 28.318 14.786 1.00 17.01 O HETATM 3962 O HOH 238 3.668 29.225 17.271 1.00 24.55 O HETATM 3963 O HOH 239 0.987 28.213 17.609 1.00 26.84 O HETATM 3964 O HOH 240 -0.249 27.413 15.314 1.00 17.33 O HETATM 3965 O HOH 241 9.969 26.355 14.491 1.00 28.82 O HETATM 3966 O HOH 242 4.720 20.075 22.050 1.00 11.97 O HETATM 3967 O HOH 243 9.571 15.662 24.338 1.00 18.20 O HETATM 3968 O HOH 244 10.797 14.021 25.987 1.00 26.41 O HETATM 3969 O HOH 245 19.057 20.910 23.139 1.00 42.42 O HETATM 3970 O HOH 246 19.778 18.569 21.928 1.00 31.34 O HETATM 3971 O HOH 247 18.948 13.835 19.547 1.00 34.11 O HETATM 3972 O HOH 248 21.265 12.602 19.076 1.00 35.73 O HETATM 3973 O HOH 249 16.191 8.281 18.812 1.00 29.94 O HETATM 3974 O HOH 250 15.308 8.011 16.145 1.00 18.10 O HETATM 3975 O HOH 251 14.921 5.311 15.902 1.00 28.01 O HETATM 3976 O HOH 252 12.500 4.060 15.742 1.00 29.69 O HETATM 3977 O HOH 253 8.252 5.293 17.986 1.00 21.45 O HETATM 3978 O HOH 254 7.690 4.466 14.453 1.00 25.49 O HETATM 3979 O HOH 255 6.594 6.066 11.228 1.00 26.97 O HETATM 3980 O HOH 256 6.933 9.322 10.054 1.00 21.36 O HETATM 3981 O HOH 257 6.983 7.139 7.646 1.00 30.76 O HETATM 3982 O HOH 258 13.762 9.417 4.409 1.00 15.38 O HETATM 3983 O HOH 259 23.994 6.011 1.746 1.00 36.55 O HETATM 3984 O HOH 260 27.137 1.761 4.449 1.00 47.06 O HETATM 3985 O HOH 261 24.525 4.798 9.371 1.00 46.55 O HETATM 3986 O HOH 262 22.115 3.306 9.328 1.00 48.18 O HETATM 3987 O HOH 263 20.538 4.554 11.614 1.00 23.67 O HETATM 3988 O HOH 264 22.842 6.710 14.604 1.00 24.76 O HETATM 3989 O HOH 265 22.046 4.956 16.360 1.00 40.08 O HETATM 3990 O HOH 266 20.183 5.132 18.345 1.00 39.08 O HETATM 3991 O HOH 267 25.452 7.749 14.817 1.00 30.58 O HETATM 3992 O HOH 268 28.315 8.187 17.746 1.00 31.25 O HETATM 3993 O HOH 269 33.446 11.565 16.675 1.00 37.28 O HETATM 3994 O HOH 270 27.492 16.425 14.457 1.00 34.09 O HETATM 3995 O HOH 271 25.041 17.765 11.589 1.00 36.46 O HETATM 3996 O HOH 272 23.307 16.617 9.926 1.00 18.85 O HETATM 3997 O HOH 273 34.102 24.397 14.109 1.00 23.41 O HETATM 3998 O HOH 274 36.254 23.179 15.698 1.00 31.88 O HETATM 3999 O HOH 275 39.195 23.996 15.990 1.00 27.93 O HETATM 4000 O HOH 276 41.829 24.870 18.007 1.00 36.47 O HETATM 4001 O HOH 277 44.584 25.618 19.423 1.00 39.27 O HETATM 4002 O HOH 278 42.588 25.318 22.251 1.00 35.78 O HETATM 4003 O HOH 279 35.378 27.837 21.105 1.00 32.40 O HETATM 4004 O HOH 280 35.045 30.497 17.944 1.00 27.30 O HETATM 4005 O HOH 281 37.610 31.417 17.283 1.00 26.34 O HETATM 4006 O HOH 282 38.315 33.333 15.565 1.00 27.20 O HETATM 4007 O HOH 283 35.127 33.490 10.233 1.00 15.38 O HETATM 4008 O HOH 284 29.643 32.191 14.765 1.00 23.75 O HETATM 4009 O HOH 285 31.287 26.763 17.859 1.00 58.44 O HETATM 4010 O HOH 286 -0.696 22.677 5.208 1.00 21.71 O HETATM 4011 O HOH 287 -2.218 18.637 4.751 1.00 19.62 O HETATM 4012 O HOH 288 -1.651 16.093 3.914 1.00 24.41 O HETATM 4013 O HOH 289 -5.003 16.267 4.660 1.00 27.41 O HETATM 4014 O HOH 290 -7.416 15.632 3.908 1.00 42.65 O HETATM 4015 O HOH 291 -6.462 12.889 5.074 1.00 25.65 O HETATM 4016 O HOH 292 -2.065 8.247 5.729 1.00 32.50 O HETATM 4017 O HOH 293 -1.409 8.594 3.153 1.00 27.45 O HETATM 4018 O HOH 294 -10.546 10.813 10.572 1.00 43.50 O HETATM 4019 O HOH 295 -8.373 11.031 14.672 1.00 27.39 O HETATM 4020 O HOH 296 -10.860 16.260 18.376 1.00 41.63 O HETATM 4021 O HOH 297 -9.275 18.320 17.130 1.00 34.56 O HETATM 4022 O HOH 298 -12.101 13.987 21.432 1.00 42.22 O HETATM 4023 O HOH 299 -8.420 13.346 23.988 1.00 28.87 O HETATM 4024 O HOH 300 -5.763 15.541 29.422 1.00 36.84 O HETATM 4025 O HOH 301 -5.527 18.227 28.362 1.00 24.19 O HETATM 4026 O HOH 302 -2.461 6.833 29.750 1.00 30.68 O HETATM 4027 O HOH 303 0.387 5.979 29.147 1.00 16.12 O HETATM 4028 O HOH 304 2.143 7.954 29.463 1.00 29.32 O HETATM 4029 O HOH 305 5.144 8.874 29.924 1.00 18.86 O HETATM 4030 O HOH 306 4.457 6.402 24.046 1.00 26.21 O HETATM 4031 O HOH 307 5.773 4.669 21.684 1.00 26.14 O HETATM 4032 O HOH 308 1.695 3.878 17.202 1.00 23.69 O HETATM 4033 O HOH 309 -1.249 1.997 16.308 1.00 36.56 O HETATM 4034 O HOH 310 -4.444 1.341 17.476 1.00 31.84 O HETATM 4035 O HOH 311 -6.867 1.955 14.997 1.00 47.50 O HETATM 4036 O HOH 312 -7.556 2.917 17.950 1.00 37.26 O HETATM 4037 O HOH 313 -9.828 5.156 20.002 1.00 27.68 O HETATM 4038 O HOH 314 -6.049 2.500 21.519 1.00 28.09 O HETATM 4039 O HOH 315 -4.105 2.695 23.970 1.00 28.18 O HETATM 4040 O HOH 316 -6.127 3.145 25.921 1.00 31.86 O HETATM 4041 O HOH 317 -1.894 4.661 23.168 1.00 21.22 O HETATM 4042 O HOH 318 -0.616 1.206 23.235 1.00 27.07 O HETATM 4043 O HOH 319 1.493 -0.728 19.718 1.00 30.75 O HETATM 4044 O HOH 320 2.392 -1.721 21.788 1.00 44.63 O HETATM 4045 O HOH 321 5.500 -2.208 22.838 1.00 26.95 O HETATM 4046 O HOH 322 5.706 -1.741 18.656 1.00 34.03 O HETATM 4047 O HOH 323 7.703 5.672 20.413 1.00 66.17 O HETATM 4048 O HOH 324 19.181 3.757 5.878 1.00 22.05 O HETATM 4049 O HOH 325 21.071 2.099 6.701 1.00 26.64 O HETATM 4050 O HOH 326 -11.743 11.783 17.974 1.00 28.81 O HETATM 4051 O HOH 327 23.107 0.548 6.021 1.00 25.37 O HETATM 4052 O5' U A 2 29.556 42.948 8.515 1.00 -0.39 O HETATM 4053 C5' U A 2 29.958 44.132 7.814 1.00 0.07 C HETATM 4054 C4' U A 2 29.772 43.990 6.287 1.00 0.11 C HETATM 4055 O4' U A 2 30.819 43.102 5.780 1.00 -0.34 O HETATM 4056 C1' U A 2 30.283 42.344 4.676 1.00 0.21 C HETATM 4057 N1 U A 2 30.206 40.906 5.054 1.00 -0.16 N HETATM 4058 C6 U A 2 30.283 40.468 6.401 1.00 0.06 C HETATM 4059 C5 U A 2 30.196 39.111 6.703 1.00 0.01 C HETATM 4060 C4 U A 2 30.046 38.186 5.665 1.00 0.18 C HETATM 4061 O4 U A 2 29.974 36.982 5.892 1.00 -0.41 O HETATM 4062 N3 U A 2 29.959 38.621 4.344 1.00 -0.19 N HETATM 4063 C2 U A 2 30.055 39.975 4.028 1.00 0.33 C HETATM 4064 O2 U A 2 29.990 40.351 2.855 1.00 -0.38 O HETATM 4065 H8 U A 2 29.826 37.952 3.612 1.00 0.23 H HETATM 4066 H7 U A 2 30.244 38.774 7.737 1.00 0.03 H HETATM 4067 H6 U A 2 30.411 41.195 7.202 1.00 0.12 H HETATM 4068 C2' U A 2 28.888 42.899 4.408 1.00 0.17 C HETATM 4069 O2' U A 2 29.038 44.004 3.505 1.00 -0.26 O HETATM 4070 P U A 2 27.827 44.373 2.509 1.00 0.20 P HETATM 4071 O1P U A 2 26.581 44.603 3.261 1.00 -0.55 O HETATM 4072 O2P U A 2 28.332 45.669 1.657 1.00 -0.55 O HETATM 4073 O3P U A 2 27.722 43.176 1.452 1.00 -0.55 O HETATM 4074 C3' U A 2 28.468 43.341 5.805 1.00 0.12 C HETATM 4075 O3' U A 2 27.402 44.298 5.744 1.00 -0.39 O HETATM 4076 H11 U A 2 27.159 44.557 6.625 1.00 0.21 H HETATM 4077 H10 U A 2 28.172 42.490 6.437 1.00 0.07 H HETATM 4078 H9 U A 2 28.200 42.148 3.993 1.00 0.07 H HETATM 4079 H5 U A 2 30.918 42.460 3.785 1.00 0.10 H HETATM 4080 H4 U A 2 29.859 44.990 5.838 1.00 0.06 H HETATM 4081 H2 U A 2 31.020 44.327 8.026 1.00 0.06 H HETATM 4082 H3 U A 2 29.351 44.978 8.169 1.00 0.06 H HETATM 4083 H1 U A 2 28.638 42.775 8.342 1.00 0.21 H CONECT 1 2 22 23 24 CONECT 22 1 CONECT 23 1 CONECT 24 1 CONECT 365 364 1260 CONECT 442 441 2314 CONECT 452 451 2304 CONECT 585 584 1423 CONECT 858 857 1664 CONECT 970 969 1068 CONECT 1068 970 1067 CONECT 1260 365 1259 CONECT 1423 585 1422 CONECT 1664 858 1663 CONECT 1863 1864 1884 1885 1886 CONECT 1884 1863 CONECT 1885 1863 CONECT 1886 1863 CONECT 2227 2226 3122 CONECT 2304 452 2303 CONECT 2314 442 2313 CONECT 2447 2446 3285 CONECT 2720 2719 3526 CONECT 2832 2831 2930 CONECT 2930 2832 2929 CONECT 3122 2227 3121 CONECT 3285 2447 3284 CONECT 3526 2720 3525 CONECT 4052 4053 4083 CONECT 4053 4052 4054 4081 4082 CONECT 4054 4053 4055 4074 4080 CONECT 4055 4054 4056 CONECT 4056 4055 4057 4068 4079 CONECT 4057 4056 4058 4063 CONECT 4058 4057 4059 4067 CONECT 4059 4058 4060 4066 CONECT 4060 4059 4061 4062 CONECT 4061 4060 CONECT 4062 4060 4063 4065 CONECT 4063 4057 4062 4064 CONECT 4064 4063 CONECT 4065 4062 CONECT 4066 4059 CONECT 4067 4058 CONECT 4068 4056 4069 4074 4078 CONECT 4069 4068 4070 CONECT 4070 4069 4071 4072 4073 CONECT 4071 4070 CONECT 4072 4070 CONECT 4073 4070 CONECT 4074 4054 4068 4075 4077 CONECT 4075 4074 4076 CONECT 4076 4075 CONECT 4077 4074 CONECT 4078 4068 CONECT 4079 4056 CONECT 4080 4054 CONECT 4081 4053 CONECT 4082 4053 CONECT 4083 4052 MASTER 0 0 0 0 0 0 0 0 4081 2 60 20 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: 3djo
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
1n3z
RCSB PDB
PDBbind
124aa, >1N3Z_1|Chain... *
3djp
RCSB PDB
PDBbind
124aa, >3DJP_1|Chains... at 100%
3djq
RCSB PDB
PDBbind
124aa, >3DJQ_1|Chains... at 100%
3djv
RCSB PDB
PDBbind
124aa, >3DJV_1|Chains... at 100%
3djx
RCSB PDB
PDBbind
124aa, >3DJX_1|Chains... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
1o0m
RCSB PDB
PDBbind
U2P
Entry Information
PDB ID
3djo
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
Seminal ribonuclease
Ligand Name
U2P
EC.Number
E.C.3.1.27.5
Resolution
1.6(Å)
Affinity (Kd/Ki/IC50)
Ki=40.8uM
Release Year
2009
Protein/NA Sequence
Check fasta file
Primary Reference
(2009) Eur.J.Med.Chem. Vol. 44: pp. 4496-4508
Ligand Properties
Formula
C
9
H
1
4
N
2
O
9
P
Molecular Weight
325.189
Exact Mass
325.044
No. of atoms
35
No. of bonds
36
Polar Surface Area
188.06
LOGP Value
-3.56 (
Computed with XLOGP3
)
-3.17 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 7
No. of Rotatable Bonds: 5
No. of Nitrogen and Oxygen Atoms: 11
No. of Rings: 2
Canonical SMILES
OC[C@H]1O[C@H]([C@@H]([C@@H]1O)OP(O)(O)O)n1ccc(=O)[nH]c1=O
InChI String
InChI=1S/C9H15N2O9P/c12-3-4-6(14)7(20-21(16,17)18)8(19-4)11-2-1-5(13)10-9(11)15/h1-2,4,6-8,12,14,16-18,21H,3H2,(H,10,13,15)/t4-,6-,7-,8-/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P00669
Entrez Gene ID
NCBI Entrez Gene ID:
280930
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
times since Nov 2007. 
娌叕缃戝畨澶囷細姝ｅ湪鐢宠涓