Browse entries in the PDBbind-CN Database
HEADER 5XVW_COMPLEX COMPND 5XVW_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 132 SER PRO ARG THR VAL GLU GLU ILE PHE LYS ASP TYR SER SEQRES 2 A 132 ALA ARG ARG ALA ALA LEU LEU ARG ALA LEU THR LYS ASP SEQRES 3 A 132 VAL ASP ASP PHE TYR SER GLN CYS ASP PRO GLU LYS GLU SEQRES 4 A 132 ASN LEU CYS LEU TYR GLY HIS PRO ASN GLU SER TRP GLU SEQRES 5 A 132 VAL ASN LEU PRO ALA GLU GLU VAL PRO PRO GLU LEU PRO SEQRES 6 A 132 GLU PRO ALA LEU GLY ILE ASN PHE ALA ARG ASP GLY MET SEQRES 7 A 132 GLN ARG LYS ASP TRP LEU SER LEU VAL ALA VAL HIS SER SEQRES 8 A 132 ASP CYS TRP LEU LEU SER VAL SER PHE TYR PHE GLY ALA SEQRES 9 A 132 ARG LEU ASN ARG ASN GLU ARG LYS ARG LEU PHE SER LEU SEQRES 10 A 132 ILE ASN ASP LEU PRO THR LEU PHE ASP VAL VAL THR GLY SEQRES 11 A 132 ARG LYS SEQRES 1 B 131 SER PRO ARG THR VAL GLU GLU ILE PHE LYS ASP TYR SER SEQRES 2 B 131 ALA ARG ARG ALA ALA LEU LEU ARG ALA LEU THR LYS ASP SEQRES 3 B 131 VAL ASP ASP PHE TYR SER GLN CYS ASP PRO GLU LYS GLU SEQRES 4 B 131 ASN LEU CYS LEU TYR GLY HIS PRO ASN GLU SER TRP GLU SEQRES 5 B 131 VAL ASN LEU PRO ALA GLU GLU VAL PRO PRO GLU LEU PRO SEQRES 6 B 131 GLU PRO ALA LEU GLY ILE ASN PHE ALA ARG ASP GLY MET SEQRES 7 B 131 GLN ARG LYS ASP TRP LEU SER LEU VAL ALA VAL HIS SER SEQRES 8 B 131 ASP CYS TRP LEU LEU SER VAL SER PHE TYR PHE GLY ALA SEQRES 9 B 131 ARG LEU ASN ARG ASN GLU ARG LYS ARG LEU PHE SER LEU SEQRES 10 B 131 ILE ASN ASP LEU PRO THR LEU PHE ASP VAL VAL THR GLY SEQRES 11 B 131 ARG HET ILE A 495 183 ATOM 1 N SER A -1 6.197 7.781 -34.544 1.00 43.60 N ATOM 2 CA SER A -1 5.886 8.454 -33.284 1.00 44.33 C ATOM 3 C SER A -1 7.132 9.093 -32.677 1.00 41.74 C ATOM 4 O SER A -1 8.236 8.560 -32.842 1.00 38.98 O ATOM 5 CB SER A -1 5.272 7.470 -32.280 1.00 48.44 C ATOM 6 OG SER A -1 3.962 7.103 -32.668 1.00 53.04 O ATOM 7 HG SER A -1 3.588 6.469 -32.006 1.00 0.00 H ATOM 8 HN3 SER A -1 6.903 7.036 -34.373 1.00 0.00 H ATOM 9 HN2 SER A -1 6.579 8.473 -35.220 1.00 0.00 H ATOM 10 HN1 SER A -1 5.330 7.357 -34.932 1.00 0.00 H ATOM 11 N PRO A 10 6.959 10.210 -31.965 1.00 36.01 N ATOM 12 CA PRO A 10 8.090 10.804 -31.242 1.00 38.46 C ATOM 13 C PRO A 10 8.745 9.780 -30.334 1.00 35.25 C ATOM 14 O PRO A 10 8.062 9.048 -29.603 1.00 33.24 O ATOM 15 CB PRO A 10 7.439 11.932 -30.433 1.00 36.50 C ATOM 16 CG PRO A 10 6.194 12.240 -31.142 1.00 31.86 C ATOM 17 CD PRO A 10 5.710 10.952 -31.721 1.00 33.46 C ATOM 18 N ARG A 11 10.098 9.743 -30.357 1.00 34.86 N ATOM 19 CA ARG A 11 10.854 8.765 -29.572 1.00 34.14 C ATOM 20 C ARG A 11 11.936 9.378 -28.689 1.00 32.52 C ATOM 21 O ARG A 11 12.139 8.910 -27.571 1.00 36.20 O ATOM 22 CB ARG A 11 11.496 7.707 -30.497 1.00 42.68 C ATOM 23 CG ARG A 11 10.502 6.731 -31.120 1.00 51.68 C ATOM 24 CD ARG A 11 11.206 5.586 -31.858 1.00 58.64 C ATOM 25 NE ARG A 11 11.697 5.967 -33.182 1.00 65.64 N ATOM 26 CZ ARG A 11 11.036 5.743 -34.316 1.00 71.06 C ATOM 27 NH1 ARG A 11 9.850 5.144 -34.285 1.00 73.36 N ATOM 28 NH2 ARG A 11 11.554 6.120 -35.482 1.00 70.05 N ATOM 29 HE ARG A 11 12.620 6.443 -33.241 1.00 0.00 H ATOM 30 HH12 ARG A 11 9.333 4.969 -35.170 1.00 0.00 H ATOM 31 HH11 ARG A 11 9.439 4.851 -33.376 1.00 0.00 H ATOM 32 HH22 ARG A 11 11.033 5.942 -36.364 1.00 0.00 H ATOM 33 HH21 ARG A 11 12.480 6.592 -35.511 1.00 0.00 H ATOM 34 H ARG A 11 10.614 10.427 -30.947 1.00 0.00 H ATOM 35 N THR A 12 12.627 10.410 -29.152 1.00 33.09 N ATOM 36 CA THR A 12 13.655 11.040 -28.335 1.00 34.59 C ATOM 37 C THR A 12 13.028 12.104 -27.443 1.00 33.87 C ATOM 38 O THR A 12 11.920 12.573 -27.689 1.00 29.12 O ATOM 39 CB THR A 12 14.741 11.672 -29.206 1.00 30.60 C ATOM 40 OG1 THR A 12 14.216 12.813 -29.898 1.00 30.94 O ATOM 41 CG2 THR A 12 15.235 10.657 -30.225 1.00 36.24 C ATOM 42 HG1 THR A 12 14.927 13.214 -30.458 1.00 0.00 H ATOM 43 H THR A 12 12.433 10.773 -30.107 1.00 0.00 H ATOM 44 N VAL A 13 13.761 12.481 -26.395 1.00 32.13 N ATOM 45 CA VAL A 13 13.303 13.574 -25.541 1.00 30.49 C ATOM 46 C VAL A 13 13.037 14.820 -26.375 1.00 28.63 C ATOM 47 O VAL A 13 12.027 15.494 -26.174 1.00 27.50 O ATOM 48 CB VAL A 13 14.317 13.831 -24.403 1.00 30.00 C ATOM 49 CG1 VAL A 13 14.101 15.189 -23.785 1.00 26.27 C ATOM 50 CG2 VAL A 13 14.221 12.728 -23.338 1.00 27.75 C ATOM 51 H VAL A 13 14.658 11.997 -26.186 1.00 0.00 H ATOM 52 N GLU A 14 13.898 15.115 -27.384 1.00 24.06 N ATOM 53 CA GLU A 14 13.648 16.296 -28.206 1.00 26.67 C ATOM 54 C GLU A 14 12.365 16.151 -29.016 1.00 23.34 C ATOM 55 O GLU A 14 11.603 17.109 -29.156 1.00 24.95 O ATOM 56 CB GLU A 14 14.809 16.593 -29.175 1.00 27.58 C ATOM 57 CG GLU A 14 14.543 17.875 -30.002 1.00 32.82 C ATOM 58 CD GLU A 14 15.695 18.308 -30.933 1.00 41.29 C ATOM 59 OE1 GLU A 14 16.679 17.555 -31.087 1.00 39.45 O ATOM 60 OE2 GLU A 14 15.591 19.423 -31.512 1.00 43.29 O ATOM 61 H GLU A 14 14.723 14.509 -27.568 1.00 0.00 H ATOM 62 N GLU A 15 12.122 14.964 -29.575 1.00 25.93 N ATOM 63 CA GLU A 15 10.933 14.788 -30.405 1.00 24.57 C ATOM 64 C GLU A 15 9.674 14.831 -29.552 1.00 23.32 C ATOM 65 O GLU A 15 8.652 15.386 -29.969 1.00 28.75 O ATOM 66 CB GLU A 15 10.991 13.458 -31.149 1.00 30.26 C ATOM 67 CG GLU A 15 11.854 13.482 -32.401 1.00 29.84 C ATOM 68 CD GLU A 15 12.167 12.080 -32.864 1.00 37.10 C ATOM 69 OE1 GLU A 15 11.903 11.125 -32.091 1.00 33.38 O ATOM 70 OE2 GLU A 15 12.710 11.934 -33.981 1.00 41.06 O ATOM 71 H GLU A 15 12.775 14.169 -29.421 1.00 0.00 H ATOM 72 N ILE A 16 9.733 14.222 -28.380 1.00 25.33 N ATOM 73 CA ILE A 16 8.559 14.171 -27.510 1.00 23.91 C ATOM 74 C ILE A 16 8.225 15.559 -26.996 1.00 25.12 C ATOM 75 O ILE A 16 7.058 15.973 -26.990 1.00 24.74 O ATOM 76 CB ILE A 16 8.799 13.178 -26.366 1.00 22.83 C ATOM 77 CG1 ILE A 16 8.853 11.743 -26.915 1.00 24.53 C ATOM 78 CG2 ILE A 16 7.687 13.313 -25.303 1.00 21.00 C ATOM 79 CD1 ILE A 16 9.376 10.725 -25.930 1.00 27.99 C ATOM 80 H ILE A 16 10.621 13.776 -28.075 1.00 0.00 H ATOM 81 N PHE A 17 9.245 16.321 -26.601 1.00 25.66 N ATOM 82 CA PHE A 17 9.005 17.662 -26.089 1.00 22.38 C ATOM 83 C PHE A 17 8.529 18.623 -27.176 1.00 23.24 C ATOM 84 O PHE A 17 7.757 19.545 -26.887 1.00 24.02 O ATOM 85 CB PHE A 17 10.277 18.189 -25.389 1.00 23.01 C ATOM 86 CG PHE A 17 10.112 19.572 -24.829 1.00 25.85 C ATOM 87 CD1 PHE A 17 9.171 19.807 -23.815 1.00 26.83 C ATOM 88 CD2 PHE A 17 10.847 20.640 -25.321 1.00 28.13 C ATOM 89 CE1 PHE A 17 8.978 21.082 -23.305 1.00 24.40 C ATOM 90 CE2 PHE A 17 10.665 21.920 -24.797 1.00 30.12 C ATOM 91 CZ PHE A 17 9.717 22.130 -23.788 1.00 25.59 C ATOM 92 H PHE A 17 10.217 15.955 -26.659 1.00 0.00 H ATOM 93 N LYS A 18 8.976 18.460 -28.430 1.00 23.33 N ATOM 94 CA LYS A 18 8.453 19.331 -29.475 1.00 25.10 C ATOM 95 C LYS A 18 6.989 18.998 -29.761 1.00 25.39 C ATOM 96 O LYS A 18 6.170 19.895 -29.993 1.00 23.83 O ATOM 97 CB LYS A 18 9.325 19.216 -30.728 1.00 28.58 C ATOM 98 CG LYS A 18 10.638 19.973 -30.542 1.00 35.67 C ATOM 99 CD LYS A 18 11.479 20.078 -31.817 1.00 44.57 C ATOM 100 CE LYS A 18 12.612 21.092 -31.623 1.00 51.57 C ATOM 101 NZ LYS A 18 12.090 22.449 -31.223 1.00 51.46 N ATOM 102 HZ1 LYS A 18 11.455 22.807 -31.965 1.00 0.00 H ATOM 103 HZ2 LYS A 18 11.568 22.368 -30.327 1.00 0.00 H ATOM 104 HZ3 LYS A 18 12.888 23.104 -31.102 1.00 0.00 H ATOM 105 H LYS A 18 9.681 17.728 -28.652 1.00 0.00 H ATOM 106 N ASP A 19 6.647 17.708 -29.720 1.00 23.87 N ATOM 107 CA ASP A 19 5.254 17.278 -29.850 1.00 24.55 C ATOM 108 C ASP A 19 4.400 17.835 -28.711 1.00 24.58 C ATOM 109 O ASP A 19 3.288 18.341 -28.941 1.00 26.47 O ATOM 110 CB ASP A 19 5.204 15.740 -29.882 1.00 20.98 C ATOM 111 CG ASP A 19 3.768 15.173 -29.882 1.00 28.85 C ATOM 112 OD1 ASP A 19 3.144 15.116 -28.799 1.00 28.37 O ATOM 113 OD2 ASP A 19 3.286 14.756 -30.959 1.00 26.12 O ATOM 114 H ASP A 19 7.389 16.991 -29.592 1.00 0.00 H ATOM 115 N TYR A 20 4.921 17.772 -27.482 1.00 18.66 N ATOM 116 CA TYR A 20 4.235 18.335 -26.316 1.00 20.14 C ATOM 117 C TYR A 20 4.001 19.821 -26.485 1.00 23.81 C ATOM 118 O TYR A 20 2.907 20.328 -26.207 1.00 25.10 O ATOM 119 CB TYR A 20 5.075 18.103 -25.038 1.00 21.14 C ATOM 120 CG TYR A 20 4.517 18.802 -23.807 1.00 23.21 C ATOM 121 CD1 TYR A 20 4.790 20.148 -23.534 1.00 22.34 C ATOM 122 CD2 TYR A 20 3.731 18.105 -22.910 1.00 24.08 C ATOM 123 CE1 TYR A 20 4.232 20.772 -22.391 1.00 25.70 C ATOM 124 CE2 TYR A 20 3.180 18.714 -21.794 1.00 26.99 C ATOM 125 CZ TYR A 20 3.434 20.042 -21.541 1.00 28.07 C ATOM 126 OH TYR A 20 2.874 20.603 -20.402 1.00 29.50 O ATOM 127 HH TYR A 20 3.201 20.119 -19.602 1.00 0.00 H ATOM 128 H TYR A 20 5.843 17.309 -27.349 1.00 0.00 H ATOM 129 N SER A 21 5.049 20.548 -26.880 1.00 21.94 N ATOM 130 CA SER A 21 4.960 22.004 -26.941 1.00 24.68 C ATOM 131 C SER A 21 3.922 22.441 -27.966 1.00 24.19 C ATOM 132 O SER A 21 3.246 23.464 -27.779 1.00 23.20 O ATOM 133 CB SER A 21 6.326 22.605 -27.281 1.00 25.04 C ATOM 134 OG SER A 21 7.285 22.275 -26.295 1.00 26.45 O ATOM 135 HG SER A 21 7.375 21.291 -26.241 1.00 0.00 H ATOM 136 H SER A 21 5.935 20.074 -27.146 1.00 0.00 H ATOM 137 N ALA A 22 3.806 21.679 -29.058 1.00 26.34 N ATOM 138 CA ALA A 22 2.888 22.000 -30.141 1.00 26.32 C ATOM 139 C ALA A 22 1.446 21.757 -29.722 1.00 25.52 C ATOM 140 O ALA A 22 0.559 22.584 -29.977 1.00 23.95 O ATOM 141 CB ALA A 22 3.234 21.161 -31.372 1.00 26.54 C ATOM 142 H ALA A 22 4.394 20.825 -29.137 1.00 0.00 H ATOM 143 N ARG A 23 1.184 20.596 -29.124 1.00 23.66 N ATOM 144 CA ARG A 23 -0.145 20.364 -28.576 1.00 28.13 C ATOM 145 C ARG A 23 -0.495 21.409 -27.535 1.00 27.57 C ATOM 146 O ARG A 23 -1.619 21.913 -27.504 1.00 24.28 O ATOM 147 CB ARG A 23 -0.220 18.975 -27.971 1.00 22.54 C ATOM 148 CG ARG A 23 0.020 17.857 -28.936 1.00 21.67 C ATOM 149 CD ARG A 23 -0.078 16.529 -28.167 1.00 24.69 C ATOM 150 NE ARG A 23 0.461 15.439 -28.960 1.00 21.62 N ATOM 151 CZ ARG A 23 -0.246 14.718 -29.827 1.00 28.02 C ATOM 152 NH1 ARG A 23 -1.552 14.938 -29.988 1.00 23.05 N ATOM 153 NH2 ARG A 23 0.357 13.757 -30.532 1.00 26.97 N ATOM 154 HE ARG A 23 1.468 15.206 -28.843 1.00 0.00 H ATOM 155 HH12 ARG A 23 -2.095 14.369 -30.668 1.00 0.00 H ATOM 156 HH11 ARG A 23 -2.027 15.679 -29.433 1.00 0.00 H ATOM 157 HH22 ARG A 23 -0.189 13.190 -31.211 1.00 0.00 H ATOM 158 HH21 ARG A 23 1.373 13.576 -30.402 1.00 0.00 H ATOM 159 H ARG A 23 1.919 19.864 -29.049 1.00 0.00 H ATOM 160 N ARG A 24 0.453 21.743 -26.659 1.00 23.87 N ATOM 161 CA ARG A 24 0.162 22.716 -25.616 1.00 22.94 C ATOM 162 C ARG A 24 -0.152 24.080 -26.216 1.00 28.21 C ATOM 163 O ARG A 24 -1.038 24.788 -25.732 1.00 25.80 O ATOM 164 CB ARG A 24 1.345 22.829 -24.651 1.00 21.10 C ATOM 165 CG ARG A 24 1.203 23.972 -23.651 1.00 25.94 C ATOM 166 CD ARG A 24 2.491 24.106 -22.790 1.00 28.48 C ATOM 167 NE ARG A 24 2.400 25.262 -21.902 1.00 28.11 N ATOM 168 CZ ARG A 24 2.564 26.517 -22.305 1.00 27.93 C ATOM 169 NH1 ARG A 24 2.861 26.776 -23.572 1.00 28.45 N ATOM 170 NH2 ARG A 24 2.458 27.510 -21.437 1.00 26.37 N ATOM 171 HE ARG A 24 2.195 25.093 -20.897 1.00 0.00 H ATOM 172 HH12 ARG A 24 2.989 27.759 -23.886 1.00 0.00 H ATOM 173 HH11 ARG A 24 2.966 25.996 -24.252 1.00 0.00 H ATOM 174 HH22 ARG A 24 2.586 28.493 -21.753 1.00 0.00 H ATOM 175 HH21 ARG A 24 2.246 27.308 -20.439 1.00 0.00 H ATOM 176 H ARG A 24 1.397 21.310 -26.721 1.00 0.00 H ATOM 177 N ALA A 25 0.563 24.463 -27.279 1.00 25.64 N ATOM 178 CA ALA A 25 0.307 25.755 -27.897 1.00 22.74 C ATOM 179 C ALA A 25 -1.111 25.809 -28.449 1.00 20.07 C ATOM 180 O ALA A 25 -1.781 26.841 -28.363 1.00 23.06 O ATOM 181 CB ALA A 25 1.319 26.025 -29.015 1.00 25.71 C ATOM 182 H ALA A 25 1.301 23.839 -27.663 1.00 0.00 H ATOM 183 N ALA A 26 -1.582 24.694 -29.002 1.00 22.04 N ATOM 184 CA ALA A 26 -2.944 24.633 -29.526 1.00 23.25 C ATOM 185 C ALA A 26 -3.958 24.775 -28.398 1.00 20.96 C ATOM 186 O ALA A 26 -4.923 25.548 -28.503 1.00 23.29 O ATOM 187 CB ALA A 26 -3.144 23.311 -30.264 1.00 24.99 C ATOM 188 H ALA A 26 -0.972 23.854 -29.062 1.00 0.00 H ATOM 189 N LEU A 27 -3.766 24.017 -27.325 1.00 19.27 N ATOM 190 CA LEU A 27 -4.690 24.107 -26.182 1.00 21.59 C ATOM 191 C LEU A 27 -4.639 25.480 -25.508 1.00 23.70 C ATOM 192 O LEU A 27 -5.676 25.999 -25.065 1.00 26.47 O ATOM 193 CB LEU A 27 -4.392 22.983 -25.188 1.00 20.55 C ATOM 194 CG LEU A 27 -4.640 21.598 -25.780 1.00 23.82 C ATOM 195 CD1 LEU A 27 -4.393 20.527 -24.741 1.00 25.02 C ATOM 196 CD2 LEU A 27 -6.064 21.479 -26.380 1.00 31.00 C ATOM 197 H LEU A 27 -2.962 23.359 -27.292 1.00 0.00 H ATOM 198 N LEU A 28 -3.449 26.086 -25.394 1.00 24.83 N ATOM 199 CA LEU A 28 -3.376 27.436 -24.838 1.00 25.31 C ATOM 200 C LEU A 28 -4.199 28.420 -25.665 1.00 28.68 C ATOM 201 O LEU A 28 -4.930 29.254 -25.110 1.00 28.76 O ATOM 202 CB LEU A 28 -1.920 27.894 -24.747 1.00 31.00 C ATOM 203 CG LEU A 28 -1.655 29.292 -24.186 1.00 36.31 C ATOM 204 CD1 LEU A 28 -2.245 29.453 -22.783 1.00 35.74 C ATOM 205 CD2 LEU A 28 -0.166 29.576 -24.178 1.00 43.16 C ATOM 206 H LEU A 28 -2.583 25.599 -25.699 1.00 0.00 H ATOM 207 N ARG A 29 -4.097 28.339 -26.992 1.00 25.66 N ATOM 208 CA ARG A 29 -4.931 29.180 -27.848 1.00 24.45 C ATOM 209 C ARG A 29 -6.412 28.913 -27.604 1.00 25.10 C ATOM 210 O ARG A 29 -7.204 29.855 -27.479 1.00 25.94 O ATOM 211 CB ARG A 29 -4.565 28.951 -29.324 1.00 25.11 C ATOM 212 CG ARG A 29 -5.311 29.867 -30.284 1.00 30.28 C ATOM 213 CD ARG A 29 -4.555 30.055 -31.626 1.00 34.71 C ATOM 214 NE ARG A 29 -4.172 28.773 -32.220 1.00 35.78 N ATOM 215 CZ ARG A 29 -4.968 28.042 -32.996 1.00 34.55 C ATOM 216 NH1 ARG A 29 -6.204 28.453 -33.292 1.00 30.33 N ATOM 217 NH2 ARG A 29 -4.527 26.891 -33.478 1.00 33.71 N ATOM 218 HE ARG A 29 -3.217 28.411 -32.023 1.00 0.00 H ATOM 219 HH12 ARG A 29 -6.814 27.870 -33.900 1.00 0.00 H ATOM 220 HH11 ARG A 29 -6.556 29.356 -32.914 1.00 0.00 H ATOM 221 HH22 ARG A 29 -5.141 26.312 -34.086 1.00 0.00 H ATOM 222 HH21 ARG A 29 -3.566 26.565 -33.249 1.00 0.00 H ATOM 223 H ARG A 29 -3.421 27.674 -27.420 1.00 0.00 H ATOM 224 N ALA A 30 -6.803 27.633 -27.489 1.00 23.61 N ATOM 225 CA ALA A 30 -8.219 27.324 -27.281 1.00 27.21 C ATOM 226 C ALA A 30 -8.748 27.949 -25.999 1.00 25.69 C ATOM 227 O ALA A 30 -9.908 28.366 -25.938 1.00 25.99 O ATOM 228 CB ALA A 30 -8.448 25.818 -27.247 1.00 23.52 C ATOM 229 H ALA A 30 -6.104 26.866 -27.547 1.00 0.00 H ATOM 230 N LEU A 31 -7.920 28.025 -24.965 1.00 21.52 N ATOM 231 CA LEU A 31 -8.412 28.486 -23.671 1.00 23.13 C ATOM 232 C LEU A 31 -8.200 29.977 -23.439 1.00 27.52 C ATOM 233 O LEU A 31 -8.673 30.499 -22.419 1.00 28.69 O ATOM 234 CB LEU A 31 -7.756 27.712 -22.548 1.00 23.70 C ATOM 235 CG LEU A 31 -8.080 26.219 -22.593 1.00 29.87 C ATOM 236 CD1 LEU A 31 -6.956 25.446 -21.903 1.00 32.07 C ATOM 237 CD2 LEU A 31 -9.429 25.975 -21.902 1.00 31.30 C ATOM 238 H LEU A 31 -6.922 27.756 -25.077 1.00 0.00 H ATOM 239 N THR A 32 -7.531 30.671 -24.357 1.00 25.03 N ATOM 240 CA THR A 32 -7.300 32.103 -24.210 1.00 27.26 C ATOM 241 C THR A 32 -7.806 32.842 -25.444 1.00 28.84 C ATOM 242 O THR A 32 -8.969 33.245 -25.484 1.00 28.59 O ATOM 243 CB THR A 32 -5.806 32.384 -23.953 1.00 30.09 C ATOM 244 OG1 THR A 32 -5.010 31.896 -25.049 1.00 26.89 O ATOM 245 CG2 THR A 32 -5.360 31.710 -22.688 1.00 28.14 C ATOM 246 HG1 THR A 32 -5.144 30.920 -25.144 1.00 0.00 H ATOM 247 H THR A 32 -7.165 30.181 -25.198 1.00 0.00 H ATOM 248 N LYS A 33 -6.968 32.964 -26.485 1.00 28.17 N ATOM 249 CA LYS A 33 -7.346 33.740 -27.663 1.00 24.65 C ATOM 250 C LYS A 33 -8.688 33.313 -28.254 1.00 22.30 C ATOM 251 O LYS A 33 -9.493 34.159 -28.653 1.00 24.24 O ATOM 252 CB LYS A 33 -6.265 33.600 -28.734 1.00 26.71 C ATOM 253 CG LYS A 33 -6.501 34.402 -29.965 1.00 28.50 C ATOM 254 CD LYS A 33 -5.220 34.305 -30.825 1.00 34.53 C ATOM 255 CE LYS A 33 -5.098 35.408 -31.820 1.00 35.17 C ATOM 256 NZ LYS A 33 -3.701 35.366 -32.403 1.00 32.03 N ATOM 257 HZ1 LYS A 33 -3.005 35.492 -31.641 1.00 0.00 H ATOM 258 HZ2 LYS A 33 -3.547 34.447 -32.866 1.00 0.00 H ATOM 259 HZ3 LYS A 33 -3.595 36.129 -33.101 1.00 0.00 H ATOM 260 H LYS A 33 -6.038 32.500 -26.452 1.00 0.00 H ATOM 261 N ASP A 34 -8.927 32.008 -28.361 1.00 24.96 N ATOM 262 CA ASP A 34 -10.119 31.469 -29.011 1.00 26.89 C ATOM 263 C ASP A 34 -11.147 30.971 -28.002 1.00 24.12 C ATOM 264 O ASP A 34 -12.000 30.151 -28.355 1.00 28.06 O ATOM 265 CB ASP A 34 -9.763 30.301 -29.928 1.00 25.26 C ATOM 266 CG ASP A 34 -8.871 30.692 -31.084 1.00 29.09 C ATOM 267 OD1 ASP A 34 -8.849 31.885 -31.474 1.00 28.66 O ATOM 268 OD2 ASP A 34 -8.207 29.767 -31.590 1.00 25.67 O ATOM 269 H ASP A 34 -8.234 31.342 -27.964 1.00 0.00 H ATOM 270 N VAL A 35 -11.068 31.431 -26.756 1.00 20.85 N ATOM 271 CA VAL A 35 -11.907 30.870 -25.694 1.00 20.27 C ATOM 272 C VAL A 35 -13.399 30.999 -25.994 1.00 25.45 C ATOM 273 O VAL A 35 -14.184 30.127 -25.594 1.00 26.64 O ATOM 274 CB VAL A 35 -11.551 31.517 -24.340 1.00 22.69 C ATOM 275 CG1 VAL A 35 -11.953 32.985 -24.324 1.00 28.63 C ATOM 276 CG2 VAL A 35 -12.214 30.734 -23.167 1.00 24.04 C ATOM 277 H VAL A 35 -10.402 32.198 -26.533 1.00 0.00 H ATOM 278 N ASP A 36 -13.829 32.076 -26.668 1.00 27.72 N ATOM 279 CA ASP A 36 -15.250 32.210 -26.986 1.00 31.39 C ATOM 280 C ASP A 36 -15.699 31.135 -27.963 1.00 31.74 C ATOM 281 O ASP A 36 -16.821 30.620 -27.857 1.00 28.35 O ATOM 282 CB ASP A 36 -15.553 33.602 -27.546 1.00 39.44 C ATOM 283 CG ASP A 36 -15.385 34.697 -26.509 1.00 48.18 C ATOM 284 OD1 ASP A 36 -15.795 34.507 -25.349 1.00 47.21 O ATOM 285 OD2 ASP A 36 -14.815 35.751 -26.842 1.00 51.42 O ATOM 286 H ASP A 36 -13.156 32.812 -26.963 1.00 0.00 H ATOM 287 N ASP A 37 -14.846 30.805 -28.940 1.00 28.09 N ATOM 288 CA ASP A 37 -15.159 29.730 -29.875 1.00 30.54 C ATOM 289 C ASP A 37 -15.215 28.388 -29.167 1.00 24.60 C ATOM 290 O ASP A 37 -16.143 27.604 -29.389 1.00 26.81 O ATOM 291 CB ASP A 37 -14.113 29.710 -31.001 1.00 26.12 C ATOM 292 CG ASP A 37 -13.951 31.079 -31.645 1.00 32.42 C ATOM 293 OD1 ASP A 37 -14.857 31.467 -32.414 1.00 36.76 O ATOM 294 OD2 ASP A 37 -12.933 31.762 -31.363 1.00 33.29 O ATOM 295 H ASP A 37 -13.948 31.322 -29.034 1.00 0.00 H ATOM 296 N PHE A 38 -14.239 28.119 -28.296 1.00 21.48 N ATOM 297 CA PHE A 38 -14.191 26.858 -27.569 1.00 20.42 C ATOM 298 C PHE A 38 -15.402 26.724 -26.653 1.00 26.03 C ATOM 299 O PHE A 38 -16.063 25.679 -26.603 1.00 24.42 O ATOM 300 CB PHE A 38 -12.887 26.810 -26.758 1.00 20.35 C ATOM 301 CG PHE A 38 -12.874 25.750 -25.713 1.00 22.96 C ATOM 302 CD1 PHE A 38 -12.853 24.421 -26.076 1.00 24.31 C ATOM 303 CD2 PHE A 38 -12.914 26.080 -24.362 1.00 25.37 C ATOM 304 CE1 PHE A 38 -12.871 23.435 -25.123 1.00 25.20 C ATOM 305 CE2 PHE A 38 -12.918 25.091 -23.397 1.00 23.33 C ATOM 306 CZ PHE A 38 -12.898 23.769 -23.776 1.00 25.85 C ATOM 307 H PHE A 38 -13.495 28.827 -28.133 1.00 0.00 H ATOM 308 N TYR A 39 -15.715 27.797 -25.939 1.00 23.02 N ATOM 309 CA TYR A 39 -16.849 27.775 -25.024 1.00 25.74 C ATOM 310 C TYR A 39 -18.147 27.472 -25.774 1.00 26.64 C ATOM 311 O TYR A 39 -18.917 26.587 -25.379 1.00 29.51 O ATOM 312 CB TYR A 39 -16.916 29.116 -24.301 1.00 23.47 C ATOM 313 CG TYR A 39 -17.989 29.148 -23.216 1.00 26.10 C ATOM 314 CD1 TYR A 39 -19.311 29.389 -23.536 1.00 32.53 C ATOM 315 CD2 TYR A 39 -17.661 28.906 -21.883 1.00 35.01 C ATOM 316 CE1 TYR A 39 -20.299 29.417 -22.541 1.00 38.13 C ATOM 317 CE2 TYR A 39 -18.639 28.929 -20.892 1.00 38.43 C ATOM 318 CZ TYR A 39 -19.949 29.190 -21.237 1.00 39.39 C ATOM 319 OH TYR A 39 -20.918 29.208 -20.247 1.00 44.31 O ATOM 320 HH TYR A 39 -21.799 29.408 -20.653 1.00 0.00 H ATOM 321 H TYR A 39 -15.146 28.662 -26.033 1.00 0.00 H ATOM 322 N SER A 40 -18.374 28.169 -26.895 1.00 27.66 N ATOM 323 CA SER A 40 -19.585 27.997 -27.699 1.00 30.75 C ATOM 324 C SER A 40 -19.685 26.598 -28.297 1.00 30.18 C ATOM 325 O SER A 40 -20.792 26.089 -28.477 1.00 33.84 O ATOM 326 CB SER A 40 -19.617 29.049 -28.809 1.00 40.94 C ATOM 327 OG SER A 40 -20.583 28.719 -29.798 1.00 50.46 O ATOM 328 HG SER A 40 -20.358 27.842 -30.198 1.00 0.00 H ATOM 329 H SER A 40 -17.662 28.860 -27.206 1.00 0.00 H ATOM 330 N GLN A 41 -18.554 25.968 -28.630 1.00 25.00 N ATOM 331 CA GLN A 41 -18.596 24.638 -29.227 1.00 23.47 C ATOM 332 C GLN A 41 -18.961 23.558 -28.221 1.00 27.95 C ATOM 333 O GLN A 41 -19.482 22.505 -28.623 1.00 28.23 O ATOM 334 CB GLN A 41 -17.248 24.299 -29.886 1.00 23.43 C ATOM 335 CG GLN A 41 -17.002 25.120 -31.124 1.00 26.13 C ATOM 336 CD GLN A 41 -15.592 24.973 -31.682 1.00 29.70 C ATOM 337 OE1 GLN A 41 -14.835 24.053 -31.314 1.00 29.97 O ATOM 338 NE2 GLN A 41 -15.227 25.890 -32.572 1.00 29.65 N ATOM 339 HE22 GLN A 41 -15.893 26.640 -32.849 1.00 0.00 H ATOM 340 HE21 GLN A 41 -14.276 25.858 -32.991 1.00 0.00 H ATOM 341 H GLN A 41 -17.637 26.430 -28.462 1.00 0.00 H ATOM 342 N CYS A 42 -18.727 23.806 -26.928 1.00 27.32 N ATOM 343 CA CYS A 42 -18.982 22.826 -25.874 1.00 26.32 C ATOM 344 C CYS A 42 -20.430 22.910 -25.387 1.00 25.47 C ATOM 345 O CYS A 42 -20.722 23.133 -24.214 1.00 30.23 O ATOM 346 CB CYS A 42 -18.000 23.032 -24.727 1.00 27.22 C ATOM 347 SG CYS A 42 -16.345 22.480 -25.179 1.00 27.31 S ATOM 348 H CYS A 42 -18.347 24.737 -26.661 1.00 0.00 H ATOM 349 N ASP A 43 -21.338 22.699 -26.320 1.00 27.81 N ATOM 350 CA ASP A 43 -22.775 22.802 -26.053 1.00 27.80 C ATOM 351 C ASP A 43 -23.247 21.611 -25.226 1.00 24.79 C ATOM 352 O ASP A 43 -23.154 20.476 -25.696 1.00 26.03 O ATOM 353 CB ASP A 43 -23.488 22.853 -27.398 1.00 31.89 C ATOM 354 CG ASP A 43 -24.990 23.046 -27.293 1.00 37.40 C ATOM 355 OD1 ASP A 43 -25.575 23.036 -26.185 1.00 41.71 O ATOM 356 OD2 ASP A 43 -25.578 23.203 -28.386 1.00 41.11 O ATOM 357 H ASP A 43 -21.023 22.451 -27.279 1.00 0.00 H ATOM 358 N PRO A 44 -23.809 21.821 -24.037 1.00 29.16 N ATOM 359 CA PRO A 44 -24.171 20.673 -23.187 1.00 34.48 C ATOM 360 C PRO A 44 -25.219 19.751 -23.797 1.00 35.41 C ATOM 361 O PRO A 44 -25.320 18.593 -23.360 1.00 32.06 O ATOM 362 CB PRO A 44 -24.680 21.337 -21.898 1.00 38.64 C ATOM 363 CG PRO A 44 -24.065 22.709 -21.909 1.00 37.54 C ATOM 364 CD PRO A 44 -23.992 23.111 -23.349 1.00 33.35 C ATOM 365 N GLU A 45 -25.945 20.201 -24.828 1.00 35.70 N ATOM 366 CA GLU A 45 -26.923 19.340 -25.491 1.00 41.11 C ATOM 367 C GLU A 45 -26.271 18.234 -26.310 1.00 42.67 C ATOM 368 O GLU A 45 -26.875 17.171 -26.504 1.00 39.94 O ATOM 369 CB GLU A 45 -27.796 20.143 -26.440 1.00 40.28 C ATOM 370 CG GLU A 45 -28.357 21.424 -25.923 1.00 47.29 C ATOM 371 CD GLU A 45 -29.509 21.863 -26.804 1.00 55.52 C ATOM 372 OE1 GLU A 45 -29.780 21.128 -27.785 1.00 54.63 O ATOM 373 OE2 GLU A 45 -30.112 22.931 -26.546 1.00 57.50 O ATOM 374 H GLU A 45 -25.811 21.177 -25.162 1.00 0.00 H ATOM 375 N LYS A 46 -25.085 18.484 -26.856 1.00 37.98 N ATOM 376 CA LYS A 46 -24.499 17.551 -27.807 1.00 35.36 C ATOM 377 C LYS A 46 -24.053 16.280 -27.099 1.00 33.95 C ATOM 378 O LYS A 46 -24.062 16.185 -25.869 1.00 32.03 O ATOM 379 CB LYS A 46 -23.333 18.214 -28.537 1.00 31.84 C ATOM 380 CG LYS A 46 -23.827 19.334 -29.438 1.00 35.20 C ATOM 381 CD LYS A 46 -22.689 20.161 -30.012 1.00 40.47 C ATOM 382 CE LYS A 46 -23.215 21.122 -31.073 1.00 42.95 C ATOM 383 NZ LYS A 46 -22.134 22.047 -31.513 1.00 47.15 N ATOM 384 HZ1 LYS A 46 -21.794 22.594 -30.697 1.00 0.00 H ATOM 385 HZ2 LYS A 46 -21.349 21.495 -31.913 1.00 0.00 H ATOM 386 HZ3 LYS A 46 -22.507 22.695 -32.236 1.00 0.00 H ATOM 387 H LYS A 46 -24.572 19.352 -26.602 1.00 0.00 H ATOM 388 N GLU A 47 -23.661 15.287 -27.895 1.00 30.77 N ATOM 389 CA GLU A 47 -23.050 14.102 -27.323 1.00 31.14 C ATOM 390 C GLU A 47 -21.737 14.490 -26.631 1.00 25.73 C ATOM 391 O GLU A 47 -21.304 15.644 -26.673 1.00 30.30 O ATOM 392 CB GLU A 47 -22.830 13.041 -28.394 1.00 36.61 C ATOM 393 CG GLU A 47 -24.146 12.495 -28.963 1.00 46.80 C ATOM 394 CD GLU A 47 -24.811 11.489 -28.035 1.00 51.61 C ATOM 395 OE1 GLU A 47 -24.613 10.267 -28.252 1.00 53.21 O ATOM 396 OE2 GLU A 47 -25.505 11.919 -27.076 1.00 48.97 O ATOM 397 H GLU A 47 -23.793 15.361 -28.924 1.00 0.00 H ATOM 398 N ASN A 48 -21.131 13.524 -25.963 1.00 26.64 N ATOM 399 CA ASN A 48 -19.933 13.810 -25.170 1.00 25.37 C ATOM 400 C ASN A 48 -18.796 14.306 -26.068 1.00 29.69 C ATOM 401 O ASN A 48 -18.500 13.699 -27.096 1.00 28.65 O ATOM 402 CB ASN A 48 -19.503 12.573 -24.375 1.00 30.93 C ATOM 403 CG ASN A 48 -19.425 11.292 -25.210 1.00 33.35 C ATOM 404 OD1 ASN A 48 -19.165 11.293 -26.426 1.00 36.59 O ATOM 405 ND2 ASN A 48 -19.638 10.181 -24.543 1.00 29.98 N ATOM 406 HD22 ASN A 48 -19.853 10.218 -23.526 1.00 0.00 H ATOM 407 HD21 ASN A 48 -19.592 9.264 -25.032 1.00 0.00 H ATOM 408 H ASN A 48 -21.507 12.555 -26.001 1.00 0.00 H ATOM 409 N LEU A 49 -18.189 15.436 -25.696 1.00 27.66 N ATOM 410 CA LEU A 49 -17.151 16.085 -26.489 1.00 22.99 C ATOM 411 C LEU A 49 -15.890 16.249 -25.654 1.00 26.59 C ATOM 412 O LEU A 49 -15.934 16.271 -24.427 1.00 21.57 O ATOM 413 CB LEU A 49 -17.599 17.463 -26.988 1.00 24.41 C ATOM 414 CG LEU A 49 -18.873 17.501 -27.833 1.00 29.16 C ATOM 415 CD1 LEU A 49 -19.338 18.948 -27.927 1.00 29.81 C ATOM 416 CD2 LEU A 49 -18.626 16.907 -29.224 1.00 29.94 C ATOM 417 H LEU A 49 -18.470 15.875 -24.796 1.00 0.00 H ATOM 418 N CYS A 50 -14.761 16.366 -26.339 1.00 24.40 N ATOM 419 CA CYS A 50 -13.476 16.521 -25.678 1.00 25.90 C ATOM 420 C CYS A 50 -12.673 17.559 -26.433 1.00 25.72 C ATOM 421 O CYS A 50 -12.933 17.839 -27.612 1.00 25.48 O ATOM 422 CB CYS A 50 -12.667 15.227 -25.632 1.00 29.36 C ATOM 423 SG CYS A 50 -13.616 13.691 -25.545 1.00 41.89 S ATOM 424 H CYS A 50 -14.796 16.346 -27.378 1.00 0.00 H ATOM 425 N LEU A 51 -11.669 18.094 -25.738 1.00 21.72 N ATOM 426 CA LEU A 51 -10.760 19.092 -26.281 1.00 24.73 C ATOM 427 C LEU A 51 -9.439 18.399 -26.603 1.00 21.65 C ATOM 428 O LEU A 51 -8.792 17.840 -25.711 1.00 21.64 O ATOM 429 CB LEU A 51 -10.566 20.241 -25.288 1.00 27.66 C ATOM 430 CG LEU A 51 -9.528 21.317 -25.711 1.00 26.99 C ATOM 431 CD1 LEU A 51 -9.952 22.049 -26.991 1.00 24.56 C ATOM 432 CD2 LEU A 51 -9.266 22.305 -24.580 1.00 24.61 C ATOM 433 H LEU A 51 -11.528 17.782 -24.756 1.00 0.00 H ATOM 434 N TYR A 52 -9.076 18.399 -27.883 1.00 21.71 N ATOM 435 CA TYR A 52 -7.868 17.780 -28.409 1.00 23.14 C ATOM 436 C TYR A 52 -6.910 18.869 -28.855 1.00 23.36 C ATOM 437 O TYR A 52 -7.335 19.894 -29.395 1.00 20.83 O ATOM 438 CB TYR A 52 -8.177 16.878 -29.612 1.00 28.33 C ATOM 439 CG TYR A 52 -8.867 15.594 -29.250 1.00 33.52 C ATOM 440 CD1 TYR A 52 -10.266 15.536 -29.203 1.00 33.94 C ATOM 441 CD2 TYR A 52 -8.140 14.439 -28.940 1.00 26.66 C ATOM 442 CE1 TYR A 52 -10.930 14.376 -28.856 1.00 39.01 C ATOM 443 CE2 TYR A 52 -8.802 13.254 -28.597 1.00 32.96 C ATOM 444 CZ TYR A 52 -10.209 13.238 -28.549 1.00 38.96 C ATOM 445 OH TYR A 52 -10.922 12.099 -28.186 1.00 40.35 O ATOM 446 HH TYR A 52 -11.892 12.295 -28.215 1.00 0.00 H ATOM 447 H TYR A 52 -9.704 18.878 -28.560 1.00 0.00 H ATOM 448 N GLY A 53 -5.627 18.672 -28.581 1.00 23.86 N ATOM 449 CA GLY A 53 -4.569 19.479 -29.171 1.00 27.80 C ATOM 450 C GLY A 53 -3.645 18.567 -29.959 1.00 24.45 C ATOM 451 O GLY A 53 -3.323 17.465 -29.516 1.00 25.24 O ATOM 452 H GLY A 53 -5.367 17.912 -27.920 1.00 0.00 H ATOM 453 N HIS A 54 -3.250 19.021 -31.121 1.00 24.41 N ATOM 454 CA HIS A 54 -2.538 18.187 -32.068 1.00 21.66 C ATOM 455 C HIS A 54 -1.170 18.778 -32.337 1.00 22.82 C ATOM 456 O HIS A 54 -0.953 19.987 -32.179 1.00 22.95 O ATOM 457 CB HIS A 54 -3.318 18.075 -33.385 1.00 24.84 C ATOM 458 CG HIS A 54 -4.598 17.318 -33.263 1.00 29.65 C ATOM 459 ND1 HIS A 54 -4.638 15.961 -33.020 1.00 33.21 N ATOM 460 CD2 HIS A 54 -5.886 17.725 -33.350 1.00 29.85 C ATOM 461 CE1 HIS A 54 -5.897 15.565 -32.957 1.00 32.02 C ATOM 462 NE2 HIS A 54 -6.673 16.613 -33.169 1.00 32.19 N ATOM 463 H HIS A 54 -3.453 20.010 -31.372 1.00 0.00 H ATOM 464 N PRO A 55 -0.215 17.957 -32.785 1.00 25.37 N ATOM 465 CA PRO A 55 1.149 18.461 -32.977 1.00 26.50 C ATOM 466 C PRO A 55 1.319 19.384 -34.188 1.00 27.06 C ATOM 467 O PRO A 55 2.421 19.927 -34.364 1.00 23.12 O ATOM 468 CB PRO A 55 1.984 17.174 -33.104 1.00 28.19 C ATOM 469 CG PRO A 55 1.041 16.132 -33.517 1.00 31.84 C ATOM 470 CD PRO A 55 -0.292 16.489 -32.905 1.00 28.48 C ATOM 471 N ASN A 56 0.273 19.615 -35.001 1.00 24.94 N ATOM 472 CA ASN A 56 0.305 20.691 -35.992 1.00 25.72 C ATOM 473 C ASN A 56 -0.180 22.009 -35.401 1.00 23.60 C ATOM 474 O ASN A 56 -0.454 22.950 -36.149 1.00 26.35 O ATOM 475 CB ASN A 56 -0.511 20.326 -37.240 1.00 23.29 C ATOM 476 CG ASN A 56 -1.953 20.012 -36.946 1.00 28.42 C ATOM 477 OD1 ASN A 56 -2.408 20.150 -35.819 1.00 24.27 O ATOM 478 ND2 ASN A 56 -2.691 19.580 -37.970 1.00 31.79 N ATOM 479 HD22 ASN A 56 -2.263 19.477 -38.912 1.00 0.00 H ATOM 480 HD21 ASN A 56 -3.694 19.346 -37.826 1.00 0.00 H ATOM 481 H ASN A 56 -0.575 19.018 -34.924 1.00 0.00 H ATOM 482 N GLU A 57 -0.322 22.066 -34.072 1.00 18.30 N ATOM 483 CA GLU A 57 -0.762 23.228 -33.300 1.00 21.53 C ATOM 484 C GLU A 57 -2.214 23.608 -33.586 1.00 24.94 C ATOM 485 O GLU A 57 -2.613 24.765 -33.356 1.00 24.34 O ATOM 486 CB GLU A 57 0.170 24.439 -33.494 1.00 25.75 C ATOM 487 CG GLU A 57 1.638 24.099 -33.051 1.00 26.64 C ATOM 488 CD GLU A 57 2.575 25.290 -32.934 1.00 39.78 C ATOM 489 OE1 GLU A 57 2.111 26.438 -32.980 1.00 46.75 O ATOM 490 OE2 GLU A 57 3.798 25.070 -32.773 1.00 45.21 O ATOM 491 H GLU A 57 -0.098 21.203 -33.537 1.00 0.00 H ATOM 492 N SER A 58 -3.022 22.648 -34.021 1.00 23.10 N ATOM 493 CA SER A 58 -4.459 22.844 -34.155 1.00 20.50 C ATOM 494 C SER A 58 -5.152 22.283 -32.923 1.00 21.46 C ATOM 495 O SER A 58 -4.681 21.306 -32.319 1.00 22.94 O ATOM 496 CB SER A 58 -5.032 22.149 -35.391 1.00 28.53 C ATOM 497 OG SER A 58 -4.808 20.743 -35.301 1.00 32.85 O ATOM 498 HG SER A 58 -3.835 20.568 -35.247 1.00 0.00 H ATOM 499 H SER A 58 -2.615 21.725 -34.275 1.00 0.00 H ATOM 500 N TRP A 59 -6.260 22.926 -32.546 1.00 22.74 N ATOM 501 CA TRP A 59 -7.121 22.424 -31.472 1.00 21.22 C ATOM 502 C TRP A 59 -8.506 22.155 -32.044 1.00 25.62 C ATOM 503 O TRP A 59 -8.914 22.778 -33.027 1.00 24.22 O ATOM 504 CB TRP A 59 -7.223 23.402 -30.286 1.00 21.81 C ATOM 505 CG TRP A 59 -7.962 24.714 -30.545 1.00 22.13 C ATOM 506 CD1 TRP A 59 -7.401 25.924 -30.837 1.00 22.83 C ATOM 507 CD2 TRP A 59 -9.385 24.954 -30.441 1.00 25.62 C ATOM 508 NE1 TRP A 59 -8.371 26.880 -30.980 1.00 24.96 N ATOM 509 CE2 TRP A 59 -9.598 26.319 -30.723 1.00 27.95 C ATOM 510 CE3 TRP A 59 -10.497 24.141 -30.150 1.00 26.37 C ATOM 511 CZ2 TRP A 59 -10.889 26.901 -30.743 1.00 27.96 C ATOM 512 CZ3 TRP A 59 -11.783 24.714 -30.180 1.00 25.10 C ATOM 513 CH2 TRP A 59 -11.961 26.085 -30.476 1.00 24.65 C ATOM 514 HE1 TRP A 59 -8.205 27.873 -31.242 1.00 0.00 H ATOM 515 H TRP A 59 -6.520 23.810 -33.029 1.00 0.00 H ATOM 516 N GLU A 60 -9.217 21.198 -31.448 1.00 23.18 N ATOM 517 CA GLU A 60 -10.581 20.917 -31.893 1.00 21.56 C ATOM 518 C GLU A 60 -11.393 20.409 -30.708 1.00 20.48 C ATOM 519 O GLU A 60 -10.852 19.917 -29.714 1.00 22.60 O ATOM 520 CB GLU A 60 -10.609 19.890 -33.026 1.00 24.53 C ATOM 521 CG GLU A 60 -10.068 18.509 -32.584 1.00 28.55 C ATOM 522 CD GLU A 60 -10.227 17.413 -33.640 1.00 36.00 C ATOM 523 OE1 GLU A 60 -9.431 16.455 -33.619 1.00 43.04 O ATOM 524 OE2 GLU A 60 -11.150 17.488 -34.472 1.00 41.52 O ATOM 525 H GLU A 60 -8.802 20.651 -30.667 1.00 0.00 H ATOM 526 N VAL A 61 -12.703 20.573 -30.811 1.00 23.67 N ATOM 527 CA VAL A 61 -13.657 19.958 -29.896 1.00 23.85 C ATOM 528 C VAL A 61 -14.384 18.888 -30.699 1.00 23.97 C ATOM 529 O VAL A 61 -14.971 19.193 -31.742 1.00 25.20 O ATOM 530 CB VAL A 61 -14.619 21.011 -29.319 1.00 27.05 C ATOM 531 CG1 VAL A 61 -15.798 20.356 -28.529 1.00 31.88 C ATOM 532 CG2 VAL A 61 -13.835 21.991 -28.431 1.00 24.27 C ATOM 533 H VAL A 61 -13.069 21.169 -31.581 1.00 0.00 H ATOM 534 N ASN A 62 -14.320 17.633 -30.246 1.00 25.47 N ATOM 535 CA ASN A 62 -14.773 16.516 -31.069 1.00 30.04 C ATOM 536 C ASN A 62 -15.275 15.381 -30.185 1.00 33.23 C ATOM 537 O ASN A 62 -14.974 15.309 -28.985 1.00 31.87 O ATOM 538 CB ASN A 62 -13.651 15.979 -31.979 1.00 35.80 C ATOM 539 CG ASN A 62 -14.124 15.643 -33.392 1.00 39.01 C ATOM 540 OD1 ASN A 62 -15.306 15.655 -33.691 1.00 40.32 O ATOM 541 ND2 ASN A 62 -13.180 15.326 -34.263 1.00 47.41 N ATOM 542 HD22 ASN A 62 -12.182 15.327 -33.971 1.00 0.00 H ATOM 543 HD21 ASN A 62 -13.436 15.076 -35.239 1.00 0.00 H ATOM 544 H ASN A 62 -13.942 17.449 -29.294 1.00 0.00 H ATOM 545 N LEU A 63 -16.058 14.499 -30.801 1.00 30.15 N ATOM 546 CA LEU A 63 -16.327 13.197 -30.209 1.00 32.27 C ATOM 547 C LEU A 63 -15.026 12.446 -29.951 1.00 35.36 C ATOM 548 O LEU A 63 -14.033 12.652 -30.658 1.00 34.08 O ATOM 549 CB LEU A 63 -17.186 12.361 -31.145 1.00 32.57 C ATOM 550 CG LEU A 63 -18.606 12.787 -31.379 1.00 33.81 C ATOM 551 CD1 LEU A 63 -19.098 12.107 -32.661 1.00 40.01 C ATOM 552 CD2 LEU A 63 -19.394 12.358 -30.153 1.00 35.98 C ATOM 553 H LEU A 63 -16.484 14.743 -31.718 1.00 0.00 H ATOM 554 N PRO A 64 -15.007 11.529 -28.987 1.00 36.09 N ATOM 555 CA PRO A 64 -13.857 10.627 -28.863 1.00 37.63 C ATOM 556 C PRO A 64 -13.877 9.600 -29.983 1.00 36.87 C ATOM 557 O PRO A 64 -14.873 9.425 -30.684 1.00 33.02 O ATOM 558 CB PRO A 64 -14.070 9.973 -27.501 1.00 35.18 C ATOM 559 CG PRO A 64 -15.593 9.911 -27.408 1.00 32.12 C ATOM 560 CD PRO A 64 -16.054 11.217 -27.993 1.00 31.97 C ATOM 561 N ALA A 65 -12.750 8.918 -30.151 1.00 43.21 N ATOM 562 CA ALA A 65 -12.643 7.931 -31.218 1.00 44.60 C ATOM 563 C ALA A 65 -13.609 6.779 -30.968 1.00 40.86 C ATOM 564 O ALA A 65 -13.810 6.352 -29.826 1.00 34.06 O ATOM 565 CB ALA A 65 -11.212 7.408 -31.320 1.00 48.30 C ATOM 566 H ALA A 65 -11.942 9.089 -29.519 1.00 0.00 H ATOM 567 N GLU A 66 -14.213 6.279 -32.051 1.00 42.15 N ATOM 568 CA GLU A 66 -15.244 5.252 -31.919 1.00 44.10 C ATOM 569 C GLU A 66 -14.656 3.905 -31.506 1.00 38.72 C ATOM 570 O GLU A 66 -15.278 3.160 -30.741 1.00 44.98 O ATOM 571 CB GLU A 66 -16.013 5.102 -33.231 1.00 53.44 C ATOM 572 CG GLU A 66 -17.109 6.130 -33.445 1.00 64.43 C ATOM 573 CD GLU A 66 -18.174 6.098 -32.363 1.00 71.72 C ATOM 574 OE1 GLU A 66 -18.429 5.011 -31.802 1.00 74.40 O ATOM 575 OE2 GLU A 66 -18.766 7.163 -32.079 1.00 74.00 O ATOM 576 H GLU A 66 -13.947 6.624 -32.995 1.00 0.00 H ATOM 577 N GLU A 67 -13.482 3.561 -32.012 1.00 31.34 N ATOM 578 CA GLU A 67 -12.888 2.271 -31.706 1.00 36.58 C ATOM 579 C GLU A 67 -11.974 2.405 -30.498 1.00 33.71 C ATOM 580 O GLU A 67 -11.212 3.369 -30.378 1.00 32.30 O ATOM 581 CB GLU A 67 -12.119 1.714 -32.907 1.00 43.83 C ATOM 582 CG GLU A 67 -12.989 1.522 -34.160 1.00 57.77 C ATOM 583 CD GLU A 67 -14.177 0.580 -33.943 1.00 67.52 C ATOM 584 OE1 GLU A 67 -13.958 -0.572 -33.509 1.00 71.34 O ATOM 585 OE2 GLU A 67 -15.332 0.990 -34.213 1.00 71.04 O ATOM 586 H GLU A 67 -12.978 4.223 -32.637 1.00 0.00 H ATOM 587 N VAL A 68 -12.087 1.446 -29.591 1.00 31.55 N ATOM 588 CA VAL A 68 -11.319 1.434 -28.350 1.00 28.18 C ATOM 589 C VAL A 68 -10.689 0.048 -28.237 1.00 27.28 C ATOM 590 O VAL A 68 -11.203 -0.906 -28.837 1.00 31.56 O ATOM 591 CB VAL A 68 -12.224 1.778 -27.150 1.00 30.27 C ATOM 592 CG1 VAL A 68 -12.775 3.220 -27.279 1.00 26.25 C ATOM 593 CG2 VAL A 68 -13.370 0.799 -27.045 1.00 33.29 C ATOM 594 H VAL A 68 -12.752 0.667 -29.771 1.00 0.00 H ATOM 595 N PRO A 69 -9.554 -0.120 -27.536 1.00 27.12 N ATOM 596 CA PRO A 69 -8.845 0.938 -26.822 1.00 27.40 C ATOM 597 C PRO A 69 -8.107 1.878 -27.787 1.00 31.12 C ATOM 598 O PRO A 69 -7.749 1.491 -28.920 1.00 27.94 O ATOM 599 CB PRO A 69 -7.876 0.160 -25.907 1.00 25.43 C ATOM 600 CG PRO A 69 -7.603 -1.112 -26.649 1.00 26.61 C ATOM 601 CD PRO A 69 -8.854 -1.417 -27.468 1.00 25.19 C ATOM 602 N PRO A 70 -7.900 3.114 -27.353 1.00 32.81 N ATOM 603 CA PRO A 70 -7.304 4.127 -28.229 1.00 36.42 C ATOM 604 C PRO A 70 -5.794 3.966 -28.355 1.00 31.57 C ATOM 605 O PRO A 70 -5.121 3.428 -27.474 1.00 29.17 O ATOM 606 CB PRO A 70 -7.654 5.437 -27.513 1.00 38.87 C ATOM 607 CG PRO A 70 -7.622 5.050 -26.048 1.00 39.68 C ATOM 608 CD PRO A 70 -8.171 3.636 -25.996 1.00 38.04 C ATOM 609 N GLU A 71 -5.252 4.467 -29.473 1.00 26.62 N ATOM 610 CA GLU A 71 -3.799 4.444 -29.615 1.00 29.57 C ATOM 611 C GLU A 71 -3.146 5.334 -28.565 1.00 35.54 C ATOM 612 O GLU A 71 -2.262 4.889 -27.821 1.00 42.55 O ATOM 613 CB GLU A 71 -3.365 4.871 -31.025 1.00 34.72 C ATOM 614 CG GLU A 71 -1.846 4.875 -31.142 1.00 44.05 C ATOM 615 CD GLU A 71 -1.301 5.619 -32.360 1.00 52.13 C ATOM 616 OE1 GLU A 71 -2.088 6.024 -33.247 1.00 53.07 O ATOM 617 OE2 GLU A 71 -0.065 5.818 -32.401 1.00 55.42 O ATOM 618 H GLU A 71 -5.853 4.864 -30.223 1.00 0.00 H ATOM 619 N LEU A 72 -3.586 6.603 -28.472 1.00 30.74 N ATOM 620 CA LEU A 72 -3.036 7.526 -27.490 1.00 30.69 C ATOM 621 C LEU A 72 -3.962 7.652 -26.290 1.00 25.15 C ATOM 622 O LEU A 72 -5.166 7.385 -26.384 1.00 27.01 O ATOM 623 CB LEU A 72 -2.836 8.928 -28.092 1.00 34.87 C ATOM 624 CG LEU A 72 -1.888 9.182 -29.264 1.00 42.35 C ATOM 625 CD1 LEU A 72 -1.775 10.694 -29.504 1.00 43.17 C ATOM 626 CD2 LEU A 72 -0.538 8.566 -29.003 1.00 41.36 C ATOM 627 H LEU A 72 -4.335 6.931 -29.115 1.00 0.00 H ATOM 628 N PRO A 73 -3.432 8.066 -25.142 1.00 23.81 N ATOM 629 CA PRO A 73 -4.314 8.476 -24.050 1.00 24.12 C ATOM 630 C PRO A 73 -5.316 9.505 -24.553 1.00 26.47 C ATOM 631 O PRO A 73 -5.002 10.345 -25.410 1.00 27.55 O ATOM 632 CB PRO A 73 -3.346 9.061 -23.020 1.00 26.42 C ATOM 633 CG PRO A 73 -2.051 8.206 -23.220 1.00 24.78 C ATOM 634 CD PRO A 73 -2.005 8.118 -24.748 1.00 25.34 C ATOM 635 N GLU A 74 -6.560 9.420 -24.022 1.00 24.86 N ATOM 636 CA GLU A 74 -7.637 10.280 -24.466 1.00 24.35 C ATOM 637 C GLU A 74 -7.884 11.401 -23.467 1.00 23.31 C ATOM 638 O GLU A 74 -7.686 11.220 -22.251 1.00 24.74 O ATOM 639 CB GLU A 74 -8.925 9.470 -24.640 1.00 27.33 C ATOM 640 CG GLU A 74 -8.819 8.389 -25.687 1.00 35.01 C ATOM 641 CD GLU A 74 -10.177 7.819 -26.079 1.00 45.36 C ATOM 642 OE1 GLU A 74 -10.820 7.134 -25.246 1.00 43.60 O ATOM 643 OE2 GLU A 74 -10.606 8.079 -27.227 1.00 49.35 O ATOM 644 H GLU A 74 -6.746 8.719 -23.276 1.00 0.00 H ATOM 645 N PRO A 75 -8.328 12.582 -23.953 1.00 26.13 N ATOM 646 CA PRO A 75 -8.622 13.695 -23.038 1.00 23.37 C ATOM 647 C PRO A 75 -9.902 13.455 -22.252 1.00 27.37 C ATOM 648 O PRO A 75 -10.580 12.452 -22.479 1.00 26.92 O ATOM 649 CB PRO A 75 -8.762 14.909 -23.962 1.00 22.40 C ATOM 650 CG PRO A 75 -9.135 14.349 -25.276 1.00 26.87 C ATOM 651 CD PRO A 75 -8.508 12.959 -25.364 1.00 25.99 C ATOM 652 N ALA A 76 -10.223 14.363 -21.332 1.00 24.65 N ATOM 653 CA ALA A 76 -11.401 14.212 -20.492 1.00 25.50 C ATOM 654 C ALA A 76 -12.652 14.205 -21.363 1.00 27.42 C ATOM 655 O ALA A 76 -12.803 15.039 -22.258 1.00 26.41 O ATOM 656 CB ALA A 76 -11.465 15.340 -19.464 1.00 23.03 C ATOM 657 H ALA A 76 -9.617 15.200 -21.211 1.00 0.00 H ATOM 658 N LEU A 77 -13.539 13.255 -21.098 1.00 22.46 N ATOM 659 CA LEU A 77 -14.722 13.043 -21.921 1.00 24.16 C ATOM 660 C LEU A 77 -15.922 13.819 -21.397 1.00 26.50 C ATOM 661 O LEU A 77 -16.223 13.784 -20.195 1.00 26.29 O ATOM 662 CB LEU A 77 -15.048 11.553 -21.942 1.00 34.31 C ATOM 663 CG LEU A 77 -16.314 11.128 -22.677 1.00 38.35 C ATOM 664 CD1 LEU A 77 -15.995 11.048 -24.136 1.00 34.40 C ATOM 665 CD2 LEU A 77 -16.783 9.781 -22.124 1.00 43.01 C ATOM 666 H LEU A 77 -13.384 12.640 -20.274 1.00 0.00 H ATOM 667 N GLY A 78 -16.649 14.464 -22.305 1.00 28.06 N ATOM 668 CA GLY A 78 -17.912 15.062 -21.902 1.00 32.04 C ATOM 669 C GLY A 78 -17.783 16.355 -21.140 1.00 28.79 C ATOM 670 O GLY A 78 -18.634 16.643 -20.276 1.00 25.11 O ATOM 671 H GLY A 78 -16.319 14.540 -23.288 1.00 0.00 H ATOM 672 N ILE A 79 -16.719 17.134 -21.402 1.00 21.92 N ATOM 673 CA ILE A 79 -16.554 18.418 -20.723 1.00 23.65 C ATOM 674 C ILE A 79 -17.733 19.344 -21.006 1.00 22.67 C ATOM 675 O ILE A 79 -18.084 20.183 -20.166 1.00 26.85 O ATOM 676 CB ILE A 79 -15.195 19.068 -21.087 1.00 26.28 C ATOM 677 CG1 ILE A 79 -15.053 19.310 -22.592 1.00 27.76 C ATOM 678 CG2 ILE A 79 -14.071 18.155 -20.625 1.00 23.31 C ATOM 679 CD1 ILE A 79 -13.788 20.126 -22.983 1.00 25.87 C ATOM 680 H ILE A 79 -16.008 16.821 -22.093 1.00 0.00 H ATOM 681 N ASN A 80 -18.369 19.213 -22.170 1.00 22.49 N ATOM 682 CA ASN A 80 -19.519 20.065 -22.446 1.00 20.25 C ATOM 683 C ASN A 80 -20.672 19.806 -21.477 1.00 25.74 C ATOM 684 O ASN A 80 -21.477 20.711 -21.208 1.00 24.51 O ATOM 685 CB ASN A 80 -19.978 19.879 -23.891 1.00 22.09 C ATOM 686 CG ASN A 80 -20.237 18.431 -24.249 1.00 19.75 C ATOM 687 OD1 ASN A 80 -19.471 17.544 -23.905 1.00 23.58 O ATOM 688 ND2 ASN A 80 -21.327 18.193 -24.946 1.00 23.11 N ATOM 689 HD22 ASN A 80 -21.952 18.978 -25.218 1.00 0.00 H ATOM 690 HD21 ASN A 80 -21.564 17.219 -25.225 1.00 0.00 H ATOM 691 H ASN A 80 -18.050 18.514 -22.870 1.00 0.00 H ATOM 692 N PHE A 81 -20.777 18.591 -20.945 1.00 23.71 N ATOM 693 CA PHE A 81 -21.917 18.300 -20.065 1.00 28.20 C ATOM 694 C PHE A 81 -21.922 19.177 -18.823 1.00 29.42 C ATOM 695 O PHE A 81 -22.994 19.426 -18.243 1.00 30.63 O ATOM 696 CB PHE A 81 -21.910 16.834 -19.620 1.00 26.06 C ATOM 697 CG PHE A 81 -22.075 15.858 -20.735 1.00 24.17 C ATOM 698 CD1 PHE A 81 -22.557 16.259 -21.978 1.00 29.59 C ATOM 699 CD2 PHE A 81 -21.777 14.525 -20.534 1.00 29.10 C ATOM 700 CE1 PHE A 81 -22.707 15.337 -22.997 1.00 30.35 C ATOM 701 CE2 PHE A 81 -21.923 13.599 -21.539 1.00 30.14 C ATOM 702 CZ PHE A 81 -22.401 14.002 -22.774 1.00 31.67 C ATOM 703 H PHE A 81 -20.065 17.861 -21.148 1.00 0.00 H ATOM 704 N ALA A 82 -20.753 19.648 -18.400 1.00 28.27 N ATOM 705 CA ALA A 82 -20.600 20.402 -17.164 1.00 27.81 C ATOM 706 C ALA A 82 -20.665 21.913 -17.362 1.00 29.20 C ATOM 707 O ALA A 82 -20.653 22.644 -16.365 1.00 29.37 O ATOM 708 CB ALA A 82 -19.262 20.038 -16.495 1.00 25.48 C ATOM 709 H ALA A 82 -19.908 19.469 -18.979 1.00 0.00 H ATOM 710 N ARG A 83 -20.708 22.389 -18.615 1.00 28.21 N ATOM 711 CA ARG A 83 -20.418 23.796 -18.903 1.00 27.34 C ATOM 712 C ARG A 83 -21.378 24.745 -18.186 1.00 30.84 C ATOM 713 O ARG A 83 -20.956 25.766 -17.624 1.00 28.93 O ATOM 714 CB ARG A 83 -20.445 24.037 -20.417 1.00 28.83 C ATOM 715 CG ARG A 83 -19.840 25.374 -20.857 1.00 32.87 C ATOM 716 CD ARG A 83 -20.296 25.793 -22.233 1.00 30.04 C ATOM 717 NE ARG A 83 -21.750 26.039 -22.310 1.00 28.42 N ATOM 718 CZ ARG A 83 -22.399 26.328 -23.435 1.00 31.62 C ATOM 719 NH1 ARG A 83 -21.733 26.407 -24.605 1.00 28.81 N ATOM 720 NH2 ARG A 83 -23.717 26.542 -23.406 1.00 26.67 N ATOM 721 HE ARG A 83 -22.301 25.983 -21.430 1.00 0.00 H ATOM 722 HH12 ARG A 83 -22.246 26.633 -25.481 1.00 0.00 H ATOM 723 HH11 ARG A 83 -20.707 26.242 -24.631 1.00 0.00 H ATOM 724 HH22 ARG A 83 -24.227 26.768 -24.284 1.00 0.00 H ATOM 725 HH21 ARG A 83 -24.234 26.483 -22.505 1.00 0.00 H ATOM 726 H ARG A 83 -20.952 21.748 -19.397 1.00 0.00 H ATOM 727 N ASP A 84 -22.670 24.454 -18.212 1.00 28.96 N ATOM 728 CA ASP A 84 -23.592 25.469 -17.720 1.00 31.45 C ATOM 729 C ASP A 84 -23.904 25.316 -16.234 1.00 40.26 C ATOM 730 O ASP A 84 -24.537 26.209 -15.656 1.00 44.44 O ATOM 731 CB ASP A 84 -24.869 25.467 -18.580 1.00 32.29 C ATOM 732 CG ASP A 84 -24.610 25.995 -20.000 1.00 35.48 C ATOM 733 OD1 ASP A 84 -23.566 26.650 -20.202 1.00 33.25 O ATOM 734 OD2 ASP A 84 -25.423 25.754 -20.920 1.00 36.55 O ATOM 735 H ASP A 84 -23.012 23.539 -18.569 1.00 0.00 H ATOM 736 N GLY A 85 -23.426 24.246 -15.596 1.00 34.99 N ATOM 737 CA GLY A 85 -23.658 23.983 -14.189 1.00 35.18 C ATOM 738 C GLY A 85 -22.628 24.570 -13.252 1.00 35.87 C ATOM 739 O GLY A 85 -22.622 24.235 -12.059 1.00 40.15 O ATOM 740 H GLY A 85 -22.857 23.564 -16.137 1.00 0.00 H ATOM 741 N MET A 86 -21.754 25.446 -13.742 1.00 34.09 N ATOM 742 CA MET A 86 -20.753 26.057 -12.881 1.00 37.32 C ATOM 743 C MET A 86 -20.360 27.406 -13.471 1.00 32.32 C ATOM 744 O MET A 86 -20.735 27.750 -14.596 1.00 31.05 O ATOM 745 CB MET A 86 -19.537 25.122 -12.675 1.00 38.78 C ATOM 746 CG MET A 86 -18.729 24.768 -13.942 1.00 33.78 C ATOM 747 SD MET A 86 -17.731 23.222 -13.930 1.00 32.77 S ATOM 748 CE MET A 86 -16.457 23.555 -12.710 1.00 27.66 C ATOM 749 H MET A 86 -21.787 25.696 -14.751 1.00 0.00 H ATOM 750 N GLN A 87 -19.638 28.191 -12.672 1.00 27.36 N ATOM 751 CA GLN A 87 -19.101 29.446 -13.157 1.00 27.82 C ATOM 752 C GLN A 87 -18.171 29.169 -14.337 1.00 28.25 C ATOM 753 O GLN A 87 -17.469 28.154 -14.368 1.00 28.33 O ATOM 754 CB GLN A 87 -18.337 30.159 -12.040 1.00 33.92 C ATOM 755 CG GLN A 87 -19.253 30.591 -10.871 1.00 43.03 C ATOM 756 CD GLN A 87 -18.550 31.495 -9.877 1.00 50.39 C ATOM 757 OE1 GLN A 87 -17.361 31.781 -10.006 1.00 51.61 O ATOM 758 NE2 GLN A 87 -19.292 31.961 -8.882 1.00 56.04 N ATOM 759 HE22 GLN A 87 -20.294 31.693 -8.811 1.00 0.00 H ATOM 760 HE21 GLN A 87 -18.872 32.594 -8.172 1.00 0.00 H ATOM 761 H GLN A 87 -19.458 27.900 -11.690 1.00 0.00 H ATOM 762 N ARG A 88 -18.185 30.075 -15.316 1.00 26.80 N ATOM 763 CA ARG A 88 -17.376 29.875 -16.518 1.00 24.47 C ATOM 764 C ARG A 88 -15.891 29.789 -16.184 1.00 27.71 C ATOM 765 O ARG A 88 -15.166 28.949 -16.747 1.00 26.80 O ATOM 766 CB ARG A 88 -17.641 31.003 -17.508 1.00 27.79 C ATOM 767 CG ARG A 88 -16.737 31.021 -18.739 1.00 27.19 C ATOM 768 CD ARG A 88 -17.148 32.143 -19.693 1.00 32.33 C ATOM 769 NE ARG A 88 -16.102 32.440 -20.681 1.00 29.62 N ATOM 770 CZ ARG A 88 -16.308 32.641 -21.981 1.00 38.71 C ATOM 771 NH1 ARG A 88 -17.538 32.604 -22.497 1.00 39.23 N ATOM 772 NH2 ARG A 88 -15.270 32.904 -22.769 1.00 35.39 N ATOM 773 HE ARG A 88 -15.122 32.498 -20.337 1.00 0.00 H ATOM 774 HH12 ARG A 88 -17.680 32.763 -23.515 1.00 0.00 H ATOM 775 HH11 ARG A 88 -18.355 32.416 -21.881 1.00 0.00 H ATOM 776 HH22 ARG A 88 -15.417 33.063 -23.786 1.00 0.00 H ATOM 777 HH21 ARG A 88 -14.311 32.951 -22.368 1.00 0.00 H ATOM 778 H ARG A 88 -18.774 30.927 -15.224 1.00 0.00 H ATOM 779 N LYS A 89 -15.411 30.654 -15.287 1.00 28.99 N ATOM 780 CA LYS A 89 -13.993 30.600 -14.943 1.00 33.79 C ATOM 781 C LYS A 89 -13.631 29.281 -14.262 1.00 29.15 C ATOM 782 O LYS A 89 -12.506 28.792 -14.421 1.00 26.74 O ATOM 783 CB LYS A 89 -13.604 31.782 -14.057 1.00 42.27 C ATOM 784 CG LYS A 89 -14.215 31.741 -12.673 1.00 50.60 C ATOM 785 CD LYS A 89 -13.463 32.642 -11.710 1.00 56.96 C ATOM 786 CE LYS A 89 -13.968 32.447 -10.289 1.00 61.19 C ATOM 787 NZ LYS A 89 -13.663 31.084 -9.767 1.00 62.62 N ATOM 788 HZ1 LYS A 89 -14.118 30.372 -10.373 1.00 0.00 H ATOM 789 HZ2 LYS A 89 -12.634 30.936 -9.769 1.00 0.00 H ATOM 790 HZ3 LYS A 89 -14.026 30.997 -8.796 1.00 0.00 H ATOM 791 H LYS A 89 -16.037 31.355 -14.841 1.00 0.00 H ATOM 792 N ASP A 90 -14.570 28.669 -13.551 1.00 26.42 N ATOM 793 CA ASP A 90 -14.278 27.394 -12.900 1.00 27.93 C ATOM 794 C ASP A 90 -14.345 26.242 -13.894 1.00 27.78 C ATOM 795 O ASP A 90 -13.578 25.278 -13.798 1.00 25.02 O ATOM 796 CB ASP A 90 -15.272 27.143 -11.749 1.00 32.41 C ATOM 797 CG ASP A 90 -15.082 28.102 -10.567 1.00 35.50 C ATOM 798 OD1 ASP A 90 -13.960 28.622 -10.360 1.00 34.45 O ATOM 799 OD2 ASP A 90 -16.073 28.315 -9.829 1.00 35.49 O ATOM 800 H ASP A 90 -15.513 29.097 -13.457 1.00 0.00 H ATOM 801 N TRP A 91 -15.299 26.295 -14.826 1.00 26.49 N ATOM 802 CA TRP A 91 -15.327 25.307 -15.896 1.00 28.26 C ATOM 803 C TRP A 91 -14.037 25.356 -16.715 1.00 25.96 C ATOM 804 O TRP A 91 -13.447 24.314 -17.024 1.00 22.61 O ATOM 805 CB TRP A 91 -16.556 25.552 -16.788 1.00 24.49 C ATOM 806 CG TRP A 91 -16.657 24.581 -17.871 1.00 21.86 C ATOM 807 CD1 TRP A 91 -17.025 23.273 -17.762 1.00 21.79 C ATOM 808 CD2 TRP A 91 -16.372 24.804 -19.261 1.00 23.72 C ATOM 809 NE1 TRP A 91 -16.982 22.670 -18.996 1.00 26.64 N ATOM 810 CE2 TRP A 91 -16.578 23.582 -19.932 1.00 24.41 C ATOM 811 CE3 TRP A 91 -15.952 25.913 -19.996 1.00 22.24 C ATOM 812 CZ2 TRP A 91 -16.400 23.439 -21.317 1.00 23.55 C ATOM 813 CZ3 TRP A 91 -15.769 25.766 -21.381 1.00 25.43 C ATOM 814 CH2 TRP A 91 -15.980 24.533 -22.011 1.00 26.91 C ATOM 815 HE1 TRP A 91 -17.219 21.676 -19.188 1.00 0.00 H ATOM 816 H TRP A 91 -16.022 27.041 -14.788 1.00 0.00 H ATOM 817 N LEU A 92 -13.566 26.560 -17.052 1.00 23.07 N ATOM 818 CA LEU A 92 -12.337 26.677 -17.837 1.00 23.04 C ATOM 819 C LEU A 92 -11.118 26.177 -17.053 1.00 27.50 C ATOM 820 O LEU A 92 -10.216 25.543 -17.624 1.00 24.28 O ATOM 821 CB LEU A 92 -12.137 28.136 -18.267 1.00 25.37 C ATOM 822 CG LEU A 92 -13.071 28.699 -19.345 1.00 24.70 C ATOM 823 CD1 LEU A 92 -12.844 30.201 -19.444 1.00 26.30 C ATOM 824 CD2 LEU A 92 -12.884 28.015 -20.723 1.00 25.84 C ATOM 825 H LEU A 92 -14.075 27.417 -16.755 1.00 0.00 H ATOM 826 N SER A 93 -11.077 26.447 -15.745 1.00 25.70 N ATOM 827 CA SER A 93 -10.008 25.923 -14.900 1.00 23.90 C ATOM 828 C SER A 93 -10.010 24.403 -14.893 1.00 20.72 C ATOM 829 O SER A 93 -8.947 23.781 -14.956 1.00 23.87 O ATOM 830 CB SER A 93 -10.164 26.434 -13.454 1.00 27.98 C ATOM 831 OG SER A 93 -10.076 27.845 -13.405 1.00 35.91 O ATOM 832 HG SER A 93 -10.794 28.239 -13.961 1.00 0.00 H ATOM 833 H SER A 93 -11.819 27.040 -15.322 1.00 0.00 H ATOM 834 N LEU A 94 -11.197 23.785 -14.794 1.00 21.68 N ATOM 835 CA LEU A 94 -11.284 22.324 -14.803 1.00 25.40 C ATOM 836 C LEU A 94 -10.835 21.756 -16.146 1.00 24.28 C ATOM 837 O LEU A 94 -10.071 20.778 -16.193 1.00 23.57 O ATOM 838 CB LEU A 94 -12.715 21.865 -14.505 1.00 34.85 C ATOM 839 CG LEU A 94 -12.877 20.337 -14.598 1.00 45.19 C ATOM 840 CD1 LEU A 94 -13.497 19.781 -13.319 1.00 49.60 C ATOM 841 CD2 LEU A 94 -13.665 19.873 -15.844 1.00 49.69 C ATOM 842 H LEU A 94 -12.065 24.351 -14.710 1.00 0.00 H ATOM 843 N VAL A 95 -11.313 22.342 -17.241 1.00 19.51 N ATOM 844 CA VAL A 95 -10.818 21.924 -18.551 1.00 21.09 C ATOM 845 C VAL A 95 -9.307 22.078 -18.602 1.00 24.42 C ATOM 846 O VAL A 95 -8.601 21.198 -19.105 1.00 22.55 O ATOM 847 CB VAL A 95 -11.499 22.704 -19.687 1.00 23.32 C ATOM 848 CG1 VAL A 95 -10.877 22.313 -21.037 1.00 19.51 C ATOM 849 CG2 VAL A 95 -13.010 22.366 -19.710 1.00 23.16 C ATOM 850 H VAL A 95 -12.032 23.090 -17.165 1.00 0.00 H ATOM 851 N ALA A 96 -8.789 23.185 -18.067 1.00 24.55 N ATOM 852 CA ALA A 96 -7.343 23.415 -18.113 1.00 25.96 C ATOM 853 C ALA A 96 -6.563 22.344 -17.351 1.00 26.33 C ATOM 854 O ALA A 96 -5.560 21.832 -17.867 1.00 23.12 O ATOM 855 CB ALA A 96 -7.006 24.813 -17.590 1.00 24.83 C ATOM 856 H ALA A 96 -9.412 23.885 -17.617 1.00 0.00 H ATOM 857 N VAL A 97 -6.994 21.988 -16.126 1.00 20.26 N ATOM 858 CA VAL A 97 -6.293 20.942 -15.363 1.00 23.04 C ATOM 859 C VAL A 97 -6.313 19.618 -16.111 1.00 22.23 C ATOM 860 O VAL A 97 -5.287 18.928 -16.222 1.00 22.30 O ATOM 861 CB VAL A 97 -6.908 20.752 -13.962 1.00 26.91 C ATOM 862 CG1 VAL A 97 -6.149 19.609 -13.225 1.00 28.58 C ATOM 863 CG2 VAL A 97 -6.782 21.976 -13.178 1.00 31.05 C ATOM 864 H VAL A 97 -7.828 22.455 -15.716 1.00 0.00 H ATOM 865 N HIS A 98 -7.490 19.220 -16.611 1.00 19.39 N ATOM 866 CA HIS A 98 -7.559 17.939 -17.306 1.00 16.88 C ATOM 867 C HIS A 98 -6.736 17.972 -18.584 1.00 18.56 C ATOM 868 O HIS A 98 -6.270 16.924 -19.037 1.00 16.73 O ATOM 869 CB HIS A 98 -8.999 17.583 -17.648 1.00 19.62 C ATOM 870 CG HIS A 98 -9.743 16.997 -16.488 1.00 25.01 C ATOM 871 ND1 HIS A 98 -9.686 15.657 -16.187 1.00 25.91 N ATOM 872 CD2 HIS A 98 -10.506 17.569 -15.529 1.00 29.48 C ATOM 873 CE1 HIS A 98 -10.410 15.417 -15.107 1.00 29.98 C ATOM 874 NE2 HIS A 98 -10.915 16.562 -14.683 1.00 29.33 N ATOM 875 H HIS A 98 -8.338 19.812 -16.506 1.00 0.00 H ATOM 876 N SER A 99 -6.595 19.152 -19.188 1.00 15.31 N ATOM 877 CA SER A 99 -5.822 19.260 -20.431 1.00 16.79 C ATOM 878 C SER A 99 -4.325 19.222 -20.127 1.00 19.30 C ATOM 879 O SER A 99 -3.553 18.641 -20.899 1.00 22.93 O ATOM 880 CB SER A 99 -6.189 20.541 -21.193 1.00 19.56 C ATOM 881 OG SER A 99 -7.558 20.538 -21.661 1.00 20.75 O ATOM 882 HG SER A 99 -7.695 19.771 -22.272 1.00 0.00 H ATOM 883 H SER A 99 -7.035 20.000 -18.777 1.00 0.00 H ATOM 884 N ASP A 100 -3.910 19.807 -18.999 1.00 19.99 N ATOM 885 CA ASP A 100 -2.529 19.657 -18.527 1.00 23.95 C ATOM 886 C ASP A 100 -2.195 18.189 -18.297 1.00 23.90 C ATOM 887 O ASP A 100 -1.118 17.713 -18.676 1.00 22.84 O ATOM 888 CB ASP A 100 -2.322 20.425 -17.211 1.00 23.58 C ATOM 889 CG ASP A 100 -2.192 21.931 -17.411 1.00 28.18 C ATOM 890 OD1 ASP A 100 -1.604 22.362 -18.435 1.00 27.93 O ATOM 891 OD2 ASP A 100 -2.673 22.673 -16.530 1.00 26.54 O ATOM 892 H ASP A 100 -4.579 20.379 -18.445 1.00 0.00 H ATOM 893 N CYS A 101 -3.107 17.473 -17.641 1.00 21.20 N ATOM 894 CA CYS A 101 -2.883 16.061 -17.339 1.00 24.07 C ATOM 895 C CYS A 101 -2.806 15.239 -18.616 1.00 23.51 C ATOM 896 O CYS A 101 -1.964 14.339 -18.744 1.00 22.62 O ATOM 897 CB CYS A 101 -4.001 15.557 -16.432 1.00 24.50 C ATOM 898 SG CYS A 101 -3.935 16.307 -14.789 1.00 26.35 S ATOM 899 H CYS A 101 -3.993 17.926 -17.339 1.00 0.00 H ATOM 900 N TRP A 102 -3.695 15.527 -19.570 1.00 21.78 N ATOM 901 CA TRP A 102 -3.681 14.811 -20.834 1.00 20.34 C ATOM 902 C TRP A 102 -2.350 15.024 -21.557 1.00 21.71 C ATOM 903 O TRP A 102 -1.742 14.072 -22.059 1.00 21.30 O ATOM 904 CB TRP A 102 -4.880 15.252 -21.698 1.00 16.90 C ATOM 905 CG TRP A 102 -4.882 14.587 -23.033 1.00 18.61 C ATOM 906 CD1 TRP A 102 -5.103 13.257 -23.288 1.00 19.56 C ATOM 907 CD2 TRP A 102 -4.582 15.196 -24.294 1.00 21.36 C ATOM 908 NE1 TRP A 102 -4.982 13.013 -24.644 1.00 19.70 N ATOM 909 CE2 TRP A 102 -4.676 14.190 -25.280 1.00 18.94 C ATOM 910 CE3 TRP A 102 -4.262 16.509 -24.688 1.00 20.54 C ATOM 911 CZ2 TRP A 102 -4.446 14.442 -26.636 1.00 17.92 C ATOM 912 CZ3 TRP A 102 -4.049 16.762 -26.069 1.00 21.65 C ATOM 913 CH2 TRP A 102 -4.154 15.737 -27.005 1.00 20.09 C ATOM 914 HE1 TRP A 102 -5.103 12.089 -25.106 1.00 0.00 H ATOM 915 H TRP A 102 -4.404 16.270 -19.407 1.00 0.00 H ATOM 916 N LEU A 103 -1.863 16.273 -21.600 1.00 18.69 N ATOM 917 CA LEU A 103 -0.617 16.543 -22.301 1.00 20.35 C ATOM 918 C LEU A 103 0.532 15.761 -21.677 1.00 21.81 C ATOM 919 O LEU A 103 1.369 15.197 -22.389 1.00 22.19 O ATOM 920 CB LEU A 103 -0.308 18.044 -22.270 1.00 20.89 C ATOM 921 CG LEU A 103 -1.149 18.979 -23.133 1.00 24.54 C ATOM 922 CD1 LEU A 103 -0.879 20.437 -22.759 1.00 25.54 C ATOM 923 CD2 LEU A 103 -0.841 18.782 -24.630 1.00 23.86 C ATOM 924 H LEU A 103 -2.376 17.048 -21.133 1.00 0.00 H ATOM 925 N LEU A 104 0.568 15.707 -20.344 1.00 21.55 N ATOM 926 CA LEU A 104 1.603 14.957 -19.649 1.00 22.08 C ATOM 927 C LEU A 104 1.470 13.472 -19.955 1.00 25.66 C ATOM 928 O LEU A 104 2.467 12.784 -20.214 1.00 24.01 O ATOM 929 CB LEU A 104 1.478 15.237 -18.143 1.00 21.92 C ATOM 930 CG LEU A 104 2.555 14.680 -17.236 1.00 26.91 C ATOM 931 CD1 LEU A 104 3.916 15.286 -17.601 1.00 22.96 C ATOM 932 CD2 LEU A 104 2.188 14.967 -15.757 1.00 32.59 C ATOM 933 H LEU A 104 -0.156 16.210 -19.792 1.00 0.00 H ATOM 934 N SER A 105 0.228 12.976 -19.987 1.00 21.24 N ATOM 935 CA SER A 105 -0.016 11.569 -20.276 1.00 21.69 C ATOM 936 C SER A 105 0.477 11.183 -21.678 1.00 21.47 C ATOM 937 O SER A 105 1.092 10.123 -21.866 1.00 25.48 O ATOM 938 CB SER A 105 -1.513 11.298 -20.132 1.00 27.80 C ATOM 939 OG SER A 105 -1.790 9.944 -20.376 1.00 31.90 O ATOM 940 HG SER A 105 -2.762 9.785 -20.279 1.00 0.00 H ATOM 941 H SER A 105 -0.578 13.606 -19.802 1.00 0.00 H ATOM 942 N VAL A 106 0.145 11.993 -22.681 1.00 18.68 N ATOM 943 CA VAL A 106 0.577 11.710 -24.059 1.00 21.61 C ATOM 944 C VAL A 106 2.101 11.648 -24.131 1.00 23.18 C ATOM 945 O VAL A 106 2.675 10.730 -24.733 1.00 23.99 O ATOM 946 CB VAL A 106 0.001 12.755 -25.033 1.00 21.23 C ATOM 947 CG1 VAL A 106 0.655 12.658 -26.432 1.00 19.78 C ATOM 948 CG2 VAL A 106 -1.544 12.593 -25.179 1.00 22.33 C ATOM 949 H VAL A 106 -0.428 12.839 -22.488 1.00 0.00 H ATOM 950 N SER A 107 2.776 12.637 -23.538 1.00 24.34 N ATOM 951 CA SER A 107 4.236 12.678 -23.613 1.00 25.77 C ATOM 952 C SER A 107 4.861 11.457 -22.949 1.00 26.06 C ATOM 953 O SER A 107 5.848 10.905 -23.446 1.00 24.80 O ATOM 954 CB SER A 107 4.767 13.952 -22.970 1.00 26.66 C ATOM 955 OG SER A 107 4.269 15.104 -23.622 1.00 31.40 O ATOM 956 HG SER A 107 3.281 15.112 -23.567 1.00 0.00 H ATOM 957 H SER A 107 2.262 13.379 -23.022 1.00 0.00 H ATOM 958 N PHE A 108 4.316 11.014 -21.821 1.00 22.04 N ATOM 959 CA PHE A 108 4.960 9.886 -21.176 1.00 21.44 C ATOM 960 C PHE A 108 4.475 8.548 -21.709 1.00 24.83 C ATOM 961 O PHE A 108 5.115 7.523 -21.436 1.00 25.36 O ATOM 962 CB PHE A 108 4.833 10.025 -19.646 1.00 24.59 C ATOM 963 CG PHE A 108 5.848 10.991 -19.091 1.00 25.39 C ATOM 964 CD1 PHE A 108 7.127 10.563 -18.771 1.00 31.26 C ATOM 965 CD2 PHE A 108 5.569 12.350 -19.027 1.00 25.67 C ATOM 966 CE1 PHE A 108 8.081 11.465 -18.319 1.00 30.64 C ATOM 967 CE2 PHE A 108 6.510 13.250 -18.587 1.00 24.55 C ATOM 968 CZ PHE A 108 7.774 12.814 -18.240 1.00 25.68 C ATOM 969 H PHE A 108 3.465 11.457 -21.419 1.00 0.00 H ATOM 970 N TYR A 109 3.430 8.556 -22.541 1.00 25.29 N ATOM 971 CA TYR A 109 3.114 7.416 -23.396 1.00 23.34 C ATOM 972 C TYR A 109 4.172 7.243 -24.486 1.00 21.79 C ATOM 973 O TYR A 109 4.709 6.137 -24.686 1.00 24.63 O ATOM 974 CB TYR A 109 1.722 7.607 -24.030 1.00 23.98 C ATOM 975 CG TYR A 109 1.425 6.555 -25.073 1.00 26.37 C ATOM 976 CD1 TYR A 109 0.975 5.291 -24.698 1.00 25.28 C ATOM 977 CD2 TYR A 109 1.651 6.802 -26.425 1.00 27.27 C ATOM 978 CE1 TYR A 109 0.750 4.307 -25.634 1.00 31.45 C ATOM 979 CE2 TYR A 109 1.427 5.820 -27.376 1.00 33.64 C ATOM 980 CZ TYR A 109 0.976 4.571 -26.970 1.00 37.03 C ATOM 981 OH TYR A 109 0.735 3.583 -27.903 1.00 42.04 O ATOM 982 HH TYR A 109 1.570 3.386 -28.396 1.00 0.00 H ATOM 983 H TYR A 109 2.823 9.400 -22.581 1.00 0.00 H ATOM 984 N PHE A 110 4.482 8.325 -25.199 1.00 21.31 N ATOM 985 CA PHE A 110 5.568 8.285 -26.191 1.00 21.84 C ATOM 986 C PHE A 110 6.893 7.967 -25.525 1.00 26.01 C ATOM 987 O PHE A 110 7.778 7.325 -26.136 1.00 26.80 O ATOM 988 CB PHE A 110 5.673 9.639 -26.921 1.00 22.88 C ATOM 989 CG PHE A 110 4.531 9.925 -27.874 1.00 27.49 C ATOM 990 CD1 PHE A 110 3.996 8.920 -28.670 1.00 27.15 C ATOM 991 CD2 PHE A 110 3.999 11.222 -27.974 1.00 26.81 C ATOM 992 CE1 PHE A 110 2.954 9.195 -29.559 1.00 25.66 C ATOM 993 CE2 PHE A 110 2.938 11.512 -28.841 1.00 24.97 C ATOM 994 CZ PHE A 110 2.412 10.500 -29.637 1.00 26.11 C ATOM 995 H PHE A 110 3.951 9.207 -25.053 1.00 0.00 H ATOM 996 N GLY A 111 7.052 8.405 -24.285 1.00 25.85 N ATOM 997 CA GLY A 111 8.298 8.228 -23.549 1.00 27.47 C ATOM 998 C GLY A 111 8.404 6.971 -22.701 1.00 25.78 C ATOM 999 O GLY A 111 9.269 6.884 -21.821 1.00 23.80 O ATOM 1000 H GLY A 111 6.260 8.893 -23.820 1.00 0.00 H ATOM 1001 N ALA A 112 7.536 5.990 -22.949 1.00 25.03 N ATOM 1002 CA ALA A 112 7.551 4.762 -22.156 1.00 24.89 C ATOM 1003 C ALA A 112 8.934 4.110 -22.143 1.00 31.03 C ATOM 1004 O ALA A 112 9.359 3.551 -21.120 1.00 29.43 O ATOM 1005 CB ALA A 112 6.518 3.782 -22.706 1.00 26.22 C ATOM 1006 H ALA A 112 6.841 6.099 -23.715 1.00 0.00 H ATOM 1007 N ARG A 113 9.656 4.184 -23.265 1.00 34.81 N ATOM 1008 CA ARG A 113 10.946 3.518 -23.385 1.00 34.99 C ATOM 1009 C ARG A 113 12.108 4.341 -22.852 1.00 40.24 C ATOM 1010 O ARG A 113 13.230 3.834 -22.827 1.00 43.83 O ATOM 1011 CB ARG A 113 11.213 3.155 -24.847 1.00 31.80 C ATOM 1012 CG ARG A 113 10.645 1.814 -25.235 1.00 40.39 C ATOM 1013 CD ARG A 113 10.324 1.747 -26.712 1.00 49.52 C ATOM 1014 NE ARG A 113 9.205 0.848 -26.951 1.00 59.23 N ATOM 1015 CZ ARG A 113 7.964 1.252 -27.202 1.00 66.84 C ATOM 1016 NH1 ARG A 113 7.685 2.552 -27.252 1.00 66.84 N ATOM 1017 NH2 ARG A 113 6.999 0.357 -27.396 1.00 69.39 N ATOM 1018 HE ARG A 113 9.388 -0.175 -26.924 1.00 0.00 H ATOM 1019 HH12 ARG A 113 6.714 2.868 -27.448 1.00 0.00 H ATOM 1020 HH11 ARG A 113 8.438 3.252 -27.095 1.00 0.00 H ATOM 1021 HH22 ARG A 113 6.028 0.674 -27.592 1.00 0.00 H ATOM 1022 HH21 ARG A 113 7.216 -0.659 -27.351 1.00 0.00 H ATOM 1023 H ARG A 113 9.289 4.729 -24.071 1.00 0.00 H ATOM 1024 N LEU A 114 11.876 5.584 -22.439 1.00 33.73 N ATOM 1025 CA LEU A 114 12.936 6.394 -21.858 1.00 34.53 C ATOM 1026 C LEU A 114 13.376 5.829 -20.515 1.00 33.43 C ATOM 1027 O LEU A 114 12.567 5.293 -19.744 1.00 34.47 O ATOM 1028 CB LEU A 114 12.458 7.842 -21.680 1.00 32.02 C ATOM 1029 CG LEU A 114 12.097 8.624 -22.934 1.00 32.93 C ATOM 1030 CD1 LEU A 114 11.535 9.979 -22.529 1.00 30.35 C ATOM 1031 CD2 LEU A 114 13.341 8.784 -23.828 1.00 29.94 C ATOM 1032 H LEU A 114 10.921 5.984 -22.533 1.00 0.00 H ATOM 1033 N ASN A 115 14.668 5.981 -20.209 1.00 32.47 N ATOM 1034 CA ASN A 115 15.146 5.588 -18.893 1.00 31.51 C ATOM 1035 C ASN A 115 14.846 6.669 -17.851 1.00 34.77 C ATOM 1036 O ASN A 115 14.323 7.746 -18.160 1.00 35.00 O ATOM 1037 CB ASN A 115 16.643 5.254 -18.934 1.00 33.22 C ATOM 1038 CG ASN A 115 17.499 6.411 -19.389 1.00 34.67 C ATOM 1039 OD1 ASN A 115 17.336 7.549 -18.948 1.00 35.07 O ATOM 1040 ND2 ASN A 115 18.444 6.120 -20.266 1.00 39.13 N ATOM 1041 HD22 ASN A 115 18.548 5.145 -20.614 1.00 0.00 H ATOM 1042 HD21 ASN A 115 19.083 6.866 -20.608 1.00 0.00 H ATOM 1043 H ASN A 115 15.328 6.378 -20.908 1.00 0.00 H ATOM 1044 N ARG A 116 15.205 6.370 -16.593 1.00 35.07 N ATOM 1045 CA ARG A 116 14.868 7.238 -15.462 1.00 37.29 C ATOM 1046 C ARG A 116 15.411 8.650 -15.651 1.00 34.86 C ATOM 1047 O ARG A 116 14.720 9.642 -15.385 1.00 32.16 O ATOM 1048 CB ARG A 116 15.419 6.640 -14.162 1.00 46.04 C ATOM 1049 CG ARG A 116 14.963 7.370 -12.909 1.00 52.64 C ATOM 1050 CD ARG A 116 15.904 7.193 -11.706 1.00 56.41 C ATOM 1051 NE ARG A 116 15.369 7.891 -10.531 1.00 60.90 N ATOM 1052 CZ ARG A 116 15.520 9.193 -10.286 1.00 61.39 C ATOM 1053 NH1 ARG A 116 16.211 9.961 -11.126 1.00 60.31 N ATOM 1054 NH2 ARG A 116 14.977 9.732 -9.198 1.00 62.20 N ATOM 1055 HE ARG A 116 14.833 7.329 -9.839 1.00 0.00 H ATOM 1056 HH12 ARG A 116 16.325 10.976 -10.929 1.00 0.00 H ATOM 1057 HH11 ARG A 116 16.637 9.546 -11.979 1.00 0.00 H ATOM 1058 HH22 ARG A 116 15.095 10.747 -9.007 1.00 0.00 H ATOM 1059 HH21 ARG A 116 14.435 9.138 -8.539 1.00 0.00 H ATOM 1060 H ARG A 116 15.739 5.495 -16.416 1.00 0.00 H ATOM 1061 N ASN A 117 16.666 8.761 -16.088 1.00 32.56 N ATOM 1062 CA ASN A 117 17.270 10.079 -16.246 1.00 31.67 C ATOM 1063 C ASN A 117 16.643 10.831 -17.420 1.00 29.70 C ATOM 1064 O ASN A 117 16.453 12.051 -17.358 1.00 27.34 O ATOM 1065 CB ASN A 117 18.782 9.925 -16.418 1.00 37.51 C ATOM 1066 CG ASN A 117 19.511 11.247 -16.379 1.00 44.85 C ATOM 1067 OD1 ASN A 117 19.729 11.810 -15.310 1.00 47.51 O ATOM 1068 ND2 ASN A 117 19.907 11.745 -17.546 1.00 48.72 N ATOM 1069 HD22 ASN A 117 19.700 11.233 -18.427 1.00 0.00 H ATOM 1070 HD21 ASN A 117 20.424 12.647 -17.578 1.00 0.00 H ATOM 1071 H ASN A 117 17.214 7.907 -16.316 1.00 0.00 H ATOM 1072 N GLU A 118 16.310 10.122 -18.492 1.00 27.47 N ATOM 1073 CA GLU A 118 15.649 10.771 -19.614 1.00 26.06 C ATOM 1074 C GLU A 118 14.241 11.232 -19.244 1.00 26.82 C ATOM 1075 O GLU A 118 13.779 12.282 -19.717 1.00 25.63 O ATOM 1076 CB GLU A 118 15.586 9.831 -20.802 1.00 26.63 C ATOM 1077 CG GLU A 118 16.924 9.655 -21.493 1.00 29.18 C ATOM 1078 CD GLU A 118 16.913 8.510 -22.471 1.00 37.54 C ATOM 1079 OE1 GLU A 118 16.238 7.483 -22.192 1.00 36.32 O ATOM 1080 OE2 GLU A 118 17.586 8.643 -23.516 1.00 40.05 O ATOM 1081 H GLU A 118 16.521 9.104 -18.530 1.00 0.00 H ATOM 1082 N ARG A 119 13.544 10.458 -18.417 1.00 27.89 N ATOM 1083 CA ARG A 119 12.219 10.883 -17.965 1.00 30.36 C ATOM 1084 C ARG A 119 12.337 12.136 -17.107 1.00 29.32 C ATOM 1085 O ARG A 119 11.549 13.081 -17.250 1.00 26.23 O ATOM 1086 CB ARG A 119 11.529 9.717 -17.218 1.00 32.41 C ATOM 1087 CG ARG A 119 11.350 8.462 -18.129 1.00 37.30 C ATOM 1088 CD ARG A 119 10.421 7.351 -17.629 1.00 45.84 C ATOM 1089 NE ARG A 119 10.913 6.608 -16.468 1.00 50.11 N ATOM 1090 CZ ARG A 119 11.288 5.323 -16.467 1.00 48.68 C ATOM 1091 NH1 ARG A 119 11.268 4.592 -17.584 1.00 41.25 N ATOM 1092 NH2 ARG A 119 11.690 4.764 -15.325 1.00 47.09 N ATOM 1093 HE ARG A 119 10.977 7.123 -15.566 1.00 0.00 H ATOM 1094 HH12 ARG A 119 11.564 3.595 -17.559 1.00 0.00 H ATOM 1095 HH11 ARG A 119 10.956 5.019 -18.480 1.00 0.00 H ATOM 1096 HH22 ARG A 119 11.984 3.767 -15.310 1.00 0.00 H ATOM 1097 HH21 ARG A 119 11.709 5.325 -14.450 1.00 0.00 H ATOM 1098 H ARG A 119 13.940 9.553 -18.092 1.00 0.00 H ATOM 1099 N LYS A 120 13.369 12.201 -16.265 1.00 26.04 N ATOM 1100 CA LYS A 120 13.580 13.396 -15.457 1.00 24.51 C ATOM 1101 C LYS A 120 13.851 14.618 -16.325 1.00 25.03 C ATOM 1102 O LYS A 120 13.395 15.725 -16.008 1.00 26.04 O ATOM 1103 CB LYS A 120 14.744 13.172 -14.485 1.00 31.70 C ATOM 1104 CG LYS A 120 15.041 14.387 -13.600 1.00 38.71 C ATOM 1105 CD LYS A 120 16.507 14.445 -13.166 1.00 48.27 C ATOM 1106 CE LYS A 120 17.459 14.363 -14.368 1.00 55.13 C ATOM 1107 NZ LYS A 120 17.068 15.264 -15.500 1.00 58.49 N ATOM 1108 HZ1 LYS A 120 16.118 15.005 -15.835 1.00 0.00 H ATOM 1109 HZ2 LYS A 120 17.064 16.251 -15.171 1.00 0.00 H ATOM 1110 HZ3 LYS A 120 17.751 15.159 -16.277 1.00 0.00 H ATOM 1111 H LYS A 120 14.025 11.398 -16.185 1.00 0.00 H ATOM 1112 N ARG A 121 14.665 14.452 -17.377 1.00 27.45 N ATOM 1113 CA ARG A 121 14.951 15.553 -18.296 1.00 26.89 C ATOM 1114 C ARG A 121 13.698 16.005 -19.027 1.00 24.99 C ATOM 1115 O ARG A 121 13.472 17.213 -19.185 1.00 24.29 O ATOM 1116 CB ARG A 121 15.994 15.139 -19.327 1.00 27.74 C ATOM 1117 CG ARG A 121 17.370 14.825 -18.763 1.00 34.04 C ATOM 1118 CD ARG A 121 18.240 14.269 -19.894 1.00 41.64 C ATOM 1119 NE ARG A 121 17.926 14.919 -21.170 1.00 42.61 N ATOM 1120 CZ ARG A 121 17.842 14.275 -22.328 1.00 41.42 C ATOM 1121 NH1 ARG A 121 18.051 12.966 -22.364 1.00 40.71 N ATOM 1122 NH2 ARG A 121 17.566 14.935 -23.446 1.00 44.80 N ATOM 1123 HE ARG A 121 17.759 15.946 -21.168 1.00 0.00 H ATOM 1124 HH12 ARG A 121 17.987 12.454 -23.267 1.00 0.00 H ATOM 1125 HH11 ARG A 121 18.279 12.452 -21.489 1.00 0.00 H ATOM 1126 HH22 ARG A 121 17.502 14.424 -24.349 1.00 0.00 H ATOM 1127 HH21 ARG A 121 17.414 15.963 -23.419 1.00 0.00 H ATOM 1128 H ARG A 121 15.101 13.523 -17.543 1.00 0.00 H ATOM 1129 N LEU A 122 12.914 15.049 -19.526 1.00 21.19 N ATOM 1130 CA LEU A 122 11.666 15.389 -20.215 1.00 25.64 C ATOM 1131 C LEU A 122 10.740 16.195 -19.312 1.00 24.29 C ATOM 1132 O LEU A 122 10.210 17.240 -19.718 1.00 27.92 O ATOM 1133 CB LEU A 122 10.967 14.125 -20.706 1.00 24.89 C ATOM 1134 CG LEU A 122 9.594 14.361 -21.377 1.00 25.45 C ATOM 1135 CD1 LEU A 122 9.703 15.333 -22.536 1.00 25.92 C ATOM 1136 CD2 LEU A 122 8.963 13.038 -21.798 1.00 25.71 C ATOM 1137 H LEU A 122 13.191 14.052 -19.425 1.00 0.00 H ATOM 1138 N PHE A 123 10.535 15.738 -18.078 1.00 27.24 N ATOM 1139 CA PHE A 123 9.664 16.499 -17.181 1.00 25.23 C ATOM 1140 C PHE A 123 10.222 17.897 -16.916 1.00 27.00 C ATOM 1141 O PHE A 123 9.469 18.870 -16.866 1.00 22.08 O ATOM 1142 CB PHE A 123 9.466 15.766 -15.854 1.00 23.60 C ATOM 1143 CG PHE A 123 8.441 16.424 -14.984 1.00 21.21 C ATOM 1144 CD1 PHE A 123 7.093 16.274 -15.269 1.00 25.49 C ATOM 1145 CD2 PHE A 123 8.823 17.279 -13.970 1.00 26.28 C ATOM 1146 CE1 PHE A 123 6.118 16.926 -14.487 1.00 31.91 C ATOM 1147 CE2 PHE A 123 7.866 17.941 -13.199 1.00 27.80 C ATOM 1148 CZ PHE A 123 6.504 17.749 -13.455 1.00 29.27 C ATOM 1149 H PHE A 123 10.985 14.857 -17.758 1.00 0.00 H ATOM 1150 N SER A 124 11.542 18.015 -16.713 1.00 25.93 N ATOM 1151 CA SER A 124 12.124 19.326 -16.446 1.00 28.34 C ATOM 1152 C SER A 124 11.847 20.310 -17.583 1.00 28.86 C ATOM 1153 O SER A 124 11.588 21.499 -17.340 1.00 28.64 O ATOM 1154 CB SER A 124 13.627 19.184 -16.205 1.00 34.79 C ATOM 1155 OG SER A 124 14.181 20.394 -15.727 1.00 39.74 O ATOM 1156 HG SER A 124 14.032 21.110 -16.394 1.00 0.00 H ATOM 1157 H SER A 124 12.151 17.172 -16.746 1.00 0.00 H ATOM 1158 N LEU A 125 11.910 19.843 -18.834 1.00 27.86 N ATOM 1159 CA LEU A 125 11.588 20.716 -19.962 1.00 26.29 C ATOM 1160 C LEU A 125 10.119 21.130 -19.933 1.00 26.19 C ATOM 1161 O LEU A 125 9.780 22.302 -20.157 1.00 22.48 O ATOM 1162 CB LEU A 125 11.916 20.011 -21.285 1.00 24.52 C ATOM 1163 CG LEU A 125 13.388 19.731 -21.541 1.00 25.09 C ATOM 1164 CD1 LEU A 125 13.561 18.717 -22.663 1.00 27.43 C ATOM 1165 CD2 LEU A 125 14.029 21.042 -21.890 1.00 30.24 C ATOM 1166 H LEU A 125 12.189 18.856 -19.005 1.00 0.00 H ATOM 1167 N ILE A 126 9.243 20.168 -19.673 1.00 23.39 N ATOM 1168 CA ILE A 126 7.806 20.439 -19.568 1.00 27.83 C ATOM 1169 C ILE A 126 7.518 21.379 -18.402 1.00 31.29 C ATOM 1170 O ILE A 126 6.696 22.302 -18.510 1.00 27.55 O ATOM 1171 CB ILE A 126 7.045 19.112 -19.412 1.00 24.06 C ATOM 1172 CG1 ILE A 126 6.967 18.385 -20.756 1.00 25.40 C ATOM 1173 CG2 ILE A 126 5.639 19.358 -18.798 1.00 22.97 C ATOM 1174 CD1 ILE A 126 6.637 16.903 -20.619 1.00 26.35 C ATOM 1175 H ILE A 126 9.585 19.195 -19.540 1.00 0.00 H ATOM 1176 N ASN A 127 8.215 21.178 -17.276 1.00 27.41 N ATOM 1177 CA ASN A 127 7.960 21.929 -16.056 1.00 26.50 C ATOM 1178 C ASN A 127 8.443 23.363 -16.167 1.00 26.10 C ATOM 1179 O ASN A 127 8.079 24.194 -15.332 1.00 26.75 O ATOM 1180 CB ASN A 127 8.621 21.209 -14.864 1.00 28.60 C ATOM 1181 CG ASN A 127 8.091 21.676 -13.520 1.00 33.37 C ATOM 1182 OD1 ASN A 127 6.887 21.792 -13.316 1.00 33.63 O ATOM 1183 ND2 ASN A 127 8.995 21.958 -12.605 1.00 33.33 N ATOM 1184 HD22 ASN A 127 10.006 21.845 -12.821 1.00 0.00 H ATOM 1185 HD21 ASN A 127 8.698 22.294 -11.667 1.00 0.00 H ATOM 1186 H ASN A 127 8.966 20.459 -17.274 1.00 0.00 H ATOM 1187 N ASP A 128 9.227 23.680 -17.195 1.00 27.88 N ATOM 1188 CA ASP A 128 9.676 25.048 -17.416 1.00 30.35 C ATOM 1189 C ASP A 128 8.642 25.882 -18.155 1.00 31.78 C ATOM 1190 O ASP A 128 8.861 27.082 -18.347 1.00 37.77 O ATOM 1191 CB ASP A 128 10.997 25.061 -18.211 1.00 31.06 C ATOM 1192 CG ASP A 128 12.226 24.829 -17.335 1.00 37.61 C ATOM 1193 OD1 ASP A 128 12.108 24.963 -16.093 1.00 36.75 O ATOM 1194 OD2 ASP A 128 13.316 24.527 -17.894 1.00 35.72 O ATOM 1195 H ASP A 128 9.526 22.934 -17.855 1.00 0.00 H ATOM 1196 N LEU A 129 7.538 25.271 -18.602 1.00 26.38 N ATOM 1197 CA LEU A 129 6.414 25.944 -19.253 1.00 29.11 C ATOM 1198 C LEU A 129 5.290 26.125 -18.253 1.00 29.34 C ATOM 1199 O LEU A 129 4.956 25.170 -17.536 1.00 30.45 O ATOM 1200 CB LEU A 129 5.913 25.133 -20.446 1.00 29.61 C ATOM 1201 CG LEU A 129 6.872 25.066 -21.643 1.00 31.62 C ATOM 1202 CD1 LEU A 129 6.404 24.064 -22.678 1.00 31.93 C ATOM 1203 CD2 LEU A 129 7.075 26.436 -22.273 1.00 33.77 C ATOM 1204 H LEU A 129 7.475 24.240 -18.477 1.00 0.00 H ATOM 1205 N PRO A 130 4.709 27.317 -18.127 1.00 28.15 N ATOM 1206 CA PRO A 130 3.579 27.474 -17.210 1.00 29.50 C ATOM 1207 C PRO A 130 2.436 26.559 -17.618 1.00 28.26 C ATOM 1208 O PRO A 130 2.200 26.332 -18.809 1.00 31.37 O ATOM 1209 CB PRO A 130 3.189 28.953 -17.361 1.00 34.98 C ATOM 1210 CG PRO A 130 3.884 29.437 -18.575 1.00 35.81 C ATOM 1211 CD PRO A 130 5.093 28.585 -18.778 1.00 33.17 C ATOM 1212 N THR A 131 1.712 26.046 -16.620 1.00 24.01 N ATOM 1213 CA THR A 131 0.635 25.116 -16.938 1.00 23.21 C ATOM 1214 C THR A 131 -0.566 25.862 -17.495 1.00 24.08 C ATOM 1215 O THR A 131 -0.724 27.064 -17.286 1.00 26.49 O ATOM 1216 CB THR A 131 0.224 24.310 -15.712 1.00 24.46 C ATOM 1217 OG1 THR A 131 -0.446 25.162 -14.778 1.00 22.67 O ATOM 1218 CG2 THR A 131 1.451 23.696 -15.053 1.00 26.84 C ATOM 1219 HG1 THR A 131 -0.711 24.635 -13.983 1.00 0.00 H ATOM 1220 H THR A 131 1.913 26.305 -15.633 1.00 0.00 H ATOM 1221 N LEU A 132 -1.402 25.136 -18.244 1.00 23.17 N ATOM 1222 CA LEU A 132 -2.639 25.747 -18.722 1.00 24.21 C ATOM 1223 C LEU A 132 -3.486 26.218 -17.541 1.00 23.47 C ATOM 1224 O LEU A 132 -4.071 27.307 -17.570 1.00 27.16 O ATOM 1225 CB LEU A 132 -3.412 24.755 -19.587 1.00 24.38 C ATOM 1226 CG LEU A 132 -2.718 24.254 -20.868 1.00 28.40 C ATOM 1227 CD1 LEU A 132 -3.457 23.084 -21.511 1.00 26.24 C ATOM 1228 CD2 LEU A 132 -2.536 25.381 -21.904 1.00 28.54 C ATOM 1229 H LEU A 132 -1.174 24.150 -18.483 1.00 0.00 H ATOM 1230 N PHE A 133 -3.532 25.420 -16.481 1.00 22.11 N ATOM 1231 CA PHE A 133 -4.291 25.812 -15.286 1.00 23.83 C ATOM 1232 C PHE A 133 -3.803 27.146 -14.732 1.00 28.19 C ATOM 1233 O PHE A 133 -4.602 28.045 -14.430 1.00 28.07 O ATOM 1234 CB PHE A 133 -4.164 24.712 -14.244 1.00 26.58 C ATOM 1235 CG PHE A 133 -4.842 25.010 -12.937 1.00 25.78 C ATOM 1236 CD1 PHE A 133 -6.227 25.042 -12.843 1.00 27.48 C ATOM 1237 CD2 PHE A 133 -4.092 25.247 -11.808 1.00 25.48 C ATOM 1238 CE1 PHE A 133 -6.859 25.266 -11.633 1.00 30.21 C ATOM 1239 CE2 PHE A 133 -4.713 25.496 -10.583 1.00 30.50 C ATOM 1240 CZ PHE A 133 -6.096 25.507 -10.495 1.00 34.63 C ATOM 1241 H PHE A 133 -3.027 24.511 -16.497 1.00 0.00 H ATOM 1242 N ASP A 134 -2.485 27.297 -14.597 1.00 26.61 N ATOM 1243 CA ASP A 134 -1.945 28.546 -14.075 1.00 32.11 C ATOM 1244 C ASP A 134 -2.258 29.731 -14.980 1.00 31.49 C ATOM 1245 O ASP A 134 -2.622 30.810 -14.492 1.00 30.23 O ATOM 1246 CB ASP A 134 -0.441 28.402 -13.874 1.00 34.13 C ATOM 1247 CG ASP A 134 -0.118 27.593 -12.633 1.00 38.18 C ATOM 1248 OD1 ASP A 134 -1.054 27.282 -11.849 1.00 37.73 O ATOM 1249 OD2 ASP A 134 1.059 27.278 -12.435 1.00 39.72 O ATOM 1250 H ASP A 134 -1.843 26.524 -14.864 1.00 0.00 H ATOM 1251 N VAL A 135 -2.100 29.566 -16.298 1.00 29.62 N ATOM 1252 CA VAL A 135 -2.440 30.646 -17.214 1.00 29.62 C ATOM 1253 C VAL A 135 -3.915 31.003 -17.085 1.00 32.82 C ATOM 1254 O VAL A 135 -4.275 32.182 -16.972 1.00 32.24 O ATOM 1255 CB VAL A 135 -2.083 30.276 -18.666 1.00 28.50 C ATOM 1256 CG1 VAL A 135 -2.605 31.366 -19.618 1.00 31.21 C ATOM 1257 CG2 VAL A 135 -0.568 30.080 -18.840 1.00 28.57 C ATOM 1258 H VAL A 135 -1.734 28.666 -16.669 1.00 0.00 H ATOM 1259 N VAL A 136 -4.792 29.993 -17.085 1.00 29.11 N ATOM 1260 CA VAL A 136 -6.233 30.272 -17.065 1.00 30.65 C ATOM 1261 C VAL A 136 -6.657 30.893 -15.739 1.00 37.69 C ATOM 1262 O VAL A 136 -7.487 31.813 -15.714 1.00 35.81 O ATOM 1263 CB VAL A 136 -7.028 28.990 -17.361 1.00 31.15 C ATOM 1264 CG1 VAL A 136 -8.484 29.147 -16.989 1.00 35.39 C ATOM 1265 CG2 VAL A 136 -6.900 28.640 -18.797 1.00 28.67 C ATOM 1266 H VAL A 136 -4.453 29.010 -17.099 1.00 0.00 H ATOM 1267 N THR A 137 -6.123 30.391 -14.613 1.00 31.61 N ATOM 1268 CA THR A 137 -6.474 30.929 -13.299 1.00 34.36 C ATOM 1269 C THR A 137 -5.696 32.186 -12.933 1.00 39.77 C ATOM 1270 O THR A 137 -6.008 32.804 -11.912 1.00 44.67 O ATOM 1271 CB THR A 137 -6.256 29.889 -12.188 1.00 33.07 C ATOM 1272 OG1 THR A 137 -4.877 29.501 -12.147 1.00 31.12 O ATOM 1273 CG2 THR A 137 -7.131 28.669 -12.377 1.00 35.08 C ATOM 1274 HG1 THR A 137 -4.620 29.108 -13.018 1.00 0.00 H ATOM 1275 H THR A 137 -5.446 29.604 -14.677 1.00 0.00 H ATOM 1276 N GLY A 138 -4.685 32.565 -13.711 1.00 39.80 N ATOM 1277 CA GLY A 138 -3.901 33.744 -13.404 1.00 38.71 C ATOM 1278 C GLY A 138 -2.793 33.548 -12.389 1.00 41.13 C ATOM 1279 O GLY A 138 -2.286 34.540 -11.859 1.00 42.49 O ATOM 1280 H GLY A 138 -4.453 32.004 -14.556 1.00 0.00 H ATOM 1281 N ARG A 139 -2.406 32.304 -12.096 1.00 39.37 N ATOM 1282 CA ARG A 139 -1.308 32.029 -11.176 1.00 45.88 C ATOM 1283 C ARG A 139 0.031 32.249 -11.863 1.00 52.42 C ATOM 1284 O ARG A 139 0.166 32.071 -13.079 1.00 54.60 O ATOM 1285 CB ARG A 139 -1.363 30.585 -10.672 1.00 48.73 C ATOM 1286 CG ARG A 139 -2.402 30.286 -9.604 1.00 52.96 C ATOM 1287 CD ARG A 139 -2.341 28.802 -9.214 1.00 54.65 C ATOM 1288 NE ARG A 139 -3.202 28.464 -8.081 1.00 57.84 N ATOM 1289 CZ ARG A 139 -4.528 28.373 -8.152 1.00 58.58 C ATOM 1290 NH1 ARG A 139 -5.145 28.602 -9.300 1.00 55.51 N ATOM 1291 NH2 ARG A 139 -5.239 28.051 -7.076 1.00 58.54 N ATOM 1292 HE ARG A 139 -2.750 28.283 -7.162 1.00 0.00 H ATOM 1293 HH12 ARG A 139 -6.181 28.531 -9.357 1.00 0.00 H ATOM 1294 HH11 ARG A 139 -4.594 28.853 -10.146 1.00 0.00 H ATOM 1295 HH22 ARG A 139 -6.275 27.982 -7.139 1.00 0.00 H ATOM 1296 HH21 ARG A 139 -4.759 27.868 -6.171 1.00 0.00 H ATOM 1297 H ARG A 139 -2.904 31.505 -12.538 1.00 0.00 H ATOM 1298 N LYS A 140 1.033 32.621 -11.074 1.00 56.13 N ATOM 1299 CA LYS A 140 2.391 32.758 -11.611 1.00 57.83 C ATOM 1300 C LYS A 140 3.397 32.040 -10.722 1.00 59.38 C ATOM 1301 O LYS A 140 3.417 30.809 -10.674 1.00 59.86 O ATOM 1302 CB LYS A 140 2.770 34.234 -11.772 1.00 58.87 C ATOM 1303 CG LYS A 140 3.670 34.796 -10.686 1.00 61.28 C ATOM 1304 CD LYS A 140 3.867 36.302 -10.873 1.00 62.96 C ATOM 1305 CE LYS A 140 5.174 36.792 -10.257 1.00 64.18 C ATOM 1306 NZ LYS A 140 5.491 36.092 -8.980 1.00 65.56 N ATOM 1307 HZ1 LYS A 140 4.727 36.260 -8.295 1.00 0.00 H ATOM 1308 HZ2 LYS A 140 5.580 35.071 -9.158 1.00 0.00 H ATOM 1309 HZ3 LYS A 140 6.387 36.458 -8.599 1.00 0.00 H ATOM 1310 H LYS A 140 0.853 32.816 -10.068 1.00 0.00 H TER 1311 LYS A 140 ATOM 1312 N SER B -1 -8.951 14.990 -0.706 1.00 44.95 N ATOM 1313 CA SER B -1 -8.000 14.642 -1.745 1.00 42.00 C ATOM 1314 C SER B -1 -6.587 14.948 -1.297 1.00 37.85 C ATOM 1315 O SER B -1 -6.379 15.850 -0.508 1.00 36.70 O ATOM 1316 CB SER B -1 -8.310 15.399 -3.037 1.00 43.76 C ATOM 1317 OG SER B -1 -9.536 14.966 -3.606 1.00 46.11 O ATOM 1318 HG SER B -1 -9.709 15.473 -4.439 1.00 0.00 H ATOM 1319 HN3 SER B -1 -8.876 16.006 -0.495 1.00 0.00 H ATOM 1320 HN2 SER B -1 -8.742 14.440 0.152 1.00 0.00 H ATOM 1321 HN1 SER B -1 -9.914 14.773 -1.032 1.00 0.00 H ATOM 1322 N PRO B 10 -5.620 14.191 -1.810 1.00 32.08 N ATOM 1323 CA PRO B 10 -4.208 14.521 -1.563 1.00 31.87 C ATOM 1324 C PRO B 10 -3.852 15.909 -2.088 1.00 32.17 C ATOM 1325 O PRO B 10 -4.264 16.302 -3.185 1.00 30.90 O ATOM 1326 CB PRO B 10 -3.453 13.430 -2.332 1.00 31.67 C ATOM 1327 CG PRO B 10 -4.413 12.296 -2.466 1.00 32.06 C ATOM 1328 CD PRO B 10 -5.785 12.927 -2.557 1.00 33.66 C ATOM 1329 N ARG B 11 -3.051 16.646 -1.305 1.00 32.46 N ATOM 1330 CA ARG B 11 -2.683 18.011 -1.681 1.00 31.69 C ATOM 1331 C ARG B 11 -1.185 18.276 -1.598 1.00 31.98 C ATOM 1332 O ARG B 11 -0.612 18.923 -2.485 1.00 33.62 O ATOM 1333 CB ARG B 11 -3.423 19.022 -0.801 1.00 38.38 C ATOM 1334 CG ARG B 11 -4.854 19.286 -1.214 1.00 43.79 C ATOM 1335 CD ARG B 11 -4.940 19.784 -2.655 1.00 54.83 C ATOM 1336 NE ARG B 11 -5.906 20.873 -2.823 1.00 62.57 N ATOM 1337 CZ ARG B 11 -7.028 20.779 -3.532 1.00 65.88 C ATOM 1338 NH1 ARG B 11 -7.339 19.640 -4.140 1.00 67.11 N ATOM 1339 NH2 ARG B 11 -7.839 21.827 -3.635 1.00 66.93 N ATOM 1340 HE ARG B 11 -5.701 21.780 -2.357 1.00 0.00 H ATOM 1341 HH12 ARG B 11 -8.217 19.569 -4.694 1.00 0.00 H ATOM 1342 HH11 ARG B 11 -6.705 18.819 -4.062 1.00 0.00 H ATOM 1343 HH22 ARG B 11 -8.716 21.753 -4.189 1.00 0.00 H ATOM 1344 HH21 ARG B 11 -7.597 22.721 -3.161 1.00 0.00 H ATOM 1345 H ARG B 11 -2.687 16.242 -0.419 1.00 0.00 H ATOM 1346 N THR B 12 -0.539 17.810 -0.537 1.00 29.97 N ATOM 1347 CA THR B 12 0.898 18.018 -0.455 1.00 30.63 C ATOM 1348 C THR B 12 1.642 17.007 -1.322 1.00 30.32 C ATOM 1349 O THR B 12 1.100 15.979 -1.728 1.00 29.08 O ATOM 1350 CB THR B 12 1.375 17.903 0.988 1.00 32.08 C ATOM 1351 OG1 THR B 12 1.289 16.529 1.416 1.00 30.60 O ATOM 1352 CG2 THR B 12 0.494 18.788 1.902 1.00 29.91 C ATOM 1353 HG1 THR B 12 1.599 16.457 2.353 1.00 0.00 H ATOM 1354 H THR B 12 -1.048 17.308 0.218 1.00 0.00 H ATOM 1355 N VAL B 13 2.930 17.296 -1.553 1.00 32.65 N ATOM 1356 CA VAL B 13 3.799 16.383 -2.293 1.00 34.50 C ATOM 1357 C VAL B 13 3.783 14.985 -1.669 1.00 34.20 C ATOM 1358 O VAL B 13 3.648 13.978 -2.371 1.00 30.64 O ATOM 1359 CB VAL B 13 5.229 16.949 -2.366 1.00 33.03 C ATOM 1360 CG1 VAL B 13 6.156 15.925 -2.917 1.00 34.39 C ATOM 1361 CG2 VAL B 13 5.276 18.214 -3.221 1.00 30.28 C ATOM 1362 H VAL B 13 3.321 18.192 -1.197 1.00 0.00 H ATOM 1363 N GLU B 14 3.897 14.896 -0.334 1.00 31.83 N ATOM 1364 CA GLU B 14 3.919 13.575 0.303 1.00 33.10 C ATOM 1365 C GLU B 14 2.569 12.869 0.213 1.00 31.92 C ATOM 1366 O GLU B 14 2.510 11.643 0.048 1.00 34.56 O ATOM 1367 CB GLU B 14 4.325 13.692 1.773 1.00 37.32 C ATOM 1368 CG GLU B 14 5.778 14.047 1.973 1.00 39.26 C ATOM 1369 CD GLU B 14 6.034 15.532 1.778 1.00 40.31 C ATOM 1370 OE1 GLU B 14 5.041 16.306 1.822 1.00 34.74 O ATOM 1371 OE2 GLU B 14 7.219 15.905 1.583 1.00 42.83 O ATOM 1372 H GLU B 14 3.969 15.758 0.244 1.00 0.00 H ATOM 1373 N GLU B 15 1.483 13.606 0.416 1.00 26.04 N ATOM 1374 CA GLU B 15 0.151 13.020 0.286 1.00 30.35 C ATOM 1375 C GLU B 15 -0.069 12.471 -1.117 1.00 26.20 C ATOM 1376 O GLU B 15 -0.579 11.351 -1.289 1.00 23.45 O ATOM 1377 CB GLU B 15 -0.904 14.067 0.617 1.00 28.80 C ATOM 1378 CG GLU B 15 -0.907 14.425 2.105 1.00 33.97 C ATOM 1379 CD GLU B 15 -1.832 15.572 2.449 1.00 39.38 C ATOM 1380 OE1 GLU B 15 -2.315 16.260 1.516 1.00 34.21 O ATOM 1381 OE2 GLU B 15 -2.071 15.778 3.667 1.00 42.59 O ATOM 1382 H GLU B 15 1.582 14.610 0.670 1.00 0.00 H ATOM 1383 N ILE B 16 0.361 13.224 -2.123 1.00 23.39 N ATOM 1384 CA ILE B 16 0.127 12.803 -3.503 1.00 24.40 C ATOM 1385 C ILE B 16 0.978 11.588 -3.824 1.00 25.41 C ATOM 1386 O ILE B 16 0.517 10.648 -4.478 1.00 23.76 O ATOM 1387 CB ILE B 16 0.397 13.967 -4.469 1.00 25.39 C ATOM 1388 CG1 ILE B 16 -0.566 15.108 -4.199 1.00 26.31 C ATOM 1389 CG2 ILE B 16 0.302 13.488 -5.945 1.00 23.64 C ATOM 1390 CD1 ILE B 16 -0.222 16.414 -4.934 1.00 24.02 C ATOM 1391 H ILE B 16 0.864 14.113 -1.929 1.00 0.00 H ATOM 1392 N PHE B 17 2.228 11.567 -3.345 1.00 26.81 N ATOM 1393 CA PHE B 17 3.074 10.396 -3.580 1.00 25.79 C ATOM 1394 C PHE B 17 2.568 9.165 -2.826 1.00 23.71 C ATOM 1395 O PHE B 17 2.715 8.035 -3.312 1.00 28.73 O ATOM 1396 CB PHE B 17 4.531 10.695 -3.203 1.00 27.87 C ATOM 1397 CG PHE B 17 5.449 9.527 -3.426 1.00 28.44 C ATOM 1398 CD1 PHE B 17 5.846 9.183 -4.706 1.00 28.86 C ATOM 1399 CD2 PHE B 17 5.862 8.736 -2.363 1.00 30.47 C ATOM 1400 CE1 PHE B 17 6.665 8.089 -4.938 1.00 27.87 C ATOM 1401 CE2 PHE B 17 6.696 7.626 -2.585 1.00 32.99 C ATOM 1402 CZ PHE B 17 7.101 7.320 -3.893 1.00 29.66 C ATOM 1403 H PHE B 17 2.596 12.379 -2.809 1.00 0.00 H ATOM 1404 N LYS B 18 2.019 9.338 -1.624 1.00 25.01 N ATOM 1405 CA LYS B 18 1.444 8.188 -0.925 1.00 28.71 C ATOM 1406 C LYS B 18 0.312 7.569 -1.737 1.00 26.04 C ATOM 1407 O LYS B 18 0.213 6.339 -1.863 1.00 24.31 O ATOM 1408 CB LYS B 18 0.918 8.603 0.450 1.00 29.95 C ATOM 1409 CG LYS B 18 0.308 7.454 1.255 1.00 33.32 C ATOM 1410 CD LYS B 18 -0.225 7.960 2.605 1.00 35.72 C ATOM 1411 CE LYS B 18 -0.617 6.807 3.531 1.00 42.56 C ATOM 1412 NZ LYS B 18 -1.946 6.244 3.219 1.00 41.39 N ATOM 1413 HZ1 LYS B 18 -2.667 6.987 3.315 1.00 0.00 H ATOM 1414 HZ2 LYS B 18 -1.948 5.882 2.244 1.00 0.00 H ATOM 1415 HZ3 LYS B 18 -2.156 5.468 3.879 1.00 0.00 H ATOM 1416 H LYS B 18 1.999 10.281 -1.187 1.00 0.00 H ATOM 1417 N ASP B 19 -0.556 8.417 -2.274 1.00 22.48 N ATOM 1418 CA ASP B 19 -1.657 7.980 -3.141 1.00 23.11 C ATOM 1419 C ASP B 19 -1.139 7.303 -4.412 1.00 22.58 C ATOM 1420 O ASP B 19 -1.567 6.189 -4.760 1.00 22.50 O ATOM 1421 CB ASP B 19 -2.507 9.204 -3.475 1.00 22.12 C ATOM 1422 CG ASP B 19 -3.637 8.909 -4.449 1.00 24.27 C ATOM 1423 OD1 ASP B 19 -3.400 8.902 -5.675 1.00 24.84 O ATOM 1424 OD2 ASP B 19 -4.775 8.741 -3.974 1.00 26.49 O ATOM 1425 H ASP B 19 -0.452 9.432 -2.073 1.00 0.00 H ATOM 1426 N TYR B 20 -0.189 7.954 -5.095 1.00 23.13 N ATOM 1427 CA TYR B 20 0.473 7.360 -6.264 1.00 23.07 C ATOM 1428 C TYR B 20 1.050 5.986 -5.951 1.00 24.25 C ATOM 1429 O TYR B 20 0.811 5.018 -6.682 1.00 23.00 O ATOM 1430 CB TYR B 20 1.573 8.292 -6.776 1.00 23.27 C ATOM 1431 CG TYR B 20 2.393 7.706 -7.924 1.00 27.12 C ATOM 1432 CD1 TYR B 20 3.535 6.953 -7.691 1.00 29.76 C ATOM 1433 CD2 TYR B 20 1.996 7.903 -9.243 1.00 28.42 C ATOM 1434 CE1 TYR B 20 4.266 6.395 -8.767 1.00 28.94 C ATOM 1435 CE2 TYR B 20 2.705 7.375 -10.305 1.00 32.39 C ATOM 1436 CZ TYR B 20 3.837 6.612 -10.065 1.00 35.03 C ATOM 1437 OH TYR B 20 4.546 6.090 -11.141 1.00 37.57 O ATOM 1438 HH TYR B 20 5.321 5.574 -10.805 1.00 0.00 H ATOM 1439 H TYR B 20 0.088 8.908 -4.789 1.00 0.00 H ATOM 1440 N SER B 21 1.830 5.878 -4.860 1.00 24.75 N ATOM 1441 CA SER B 21 2.480 4.617 -4.539 1.00 25.20 C ATOM 1442 C SER B 21 1.472 3.503 -4.316 1.00 24.35 C ATOM 1443 O SER B 21 1.723 2.355 -4.704 1.00 28.75 O ATOM 1444 CB SER B 21 3.374 4.769 -3.289 1.00 28.26 C ATOM 1445 OG SER B 21 4.345 5.765 -3.511 1.00 39.02 O ATOM 1446 HG SER B 21 3.895 6.627 -3.698 1.00 0.00 H ATOM 1447 H SER B 21 1.969 6.702 -4.242 1.00 0.00 H ATOM 1448 N ALA B 22 0.356 3.800 -3.634 1.00 23.24 N ATOM 1449 CA ALA B 22 -0.631 2.762 -3.350 1.00 24.68 C ATOM 1450 C ALA B 22 -1.356 2.323 -4.616 1.00 24.07 C ATOM 1451 O ALA B 22 -1.583 1.119 -4.824 1.00 21.08 O ATOM 1452 CB ALA B 22 -1.650 3.260 -2.319 1.00 25.22 C ATOM 1453 H ALA B 22 0.193 4.773 -3.306 1.00 0.00 H ATOM 1454 N ARG B 23 -1.749 3.287 -5.450 1.00 21.50 N ATOM 1455 CA ARG B 23 -2.388 2.950 -6.734 1.00 23.11 C ATOM 1456 C ARG B 23 -1.446 2.153 -7.627 1.00 24.43 C ATOM 1457 O ARG B 23 -1.861 1.198 -8.300 1.00 26.00 O ATOM 1458 CB ARG B 23 -2.841 4.218 -7.463 1.00 21.87 C ATOM 1459 CG ARG B 23 -3.944 5.023 -6.804 1.00 21.89 C ATOM 1460 CD ARG B 23 -4.359 6.225 -7.700 1.00 23.94 C ATOM 1461 NE ARG B 23 -5.153 7.171 -6.935 1.00 21.53 N ATOM 1462 CZ ARG B 23 -6.474 7.093 -6.781 1.00 24.45 C ATOM 1463 NH1 ARG B 23 -7.162 6.122 -7.371 1.00 22.63 N ATOM 1464 NH2 ARG B 23 -7.112 7.996 -6.046 1.00 25.14 N ATOM 1465 HE ARG B 23 -4.657 7.962 -6.477 1.00 0.00 H ATOM 1466 HH12 ARG B 23 -8.193 6.066 -7.247 1.00 0.00 H ATOM 1467 HH11 ARG B 23 -6.670 5.418 -7.957 1.00 0.00 H ATOM 1468 HH22 ARG B 23 -8.143 7.934 -5.926 1.00 0.00 H ATOM 1469 HH21 ARG B 23 -6.581 8.765 -5.590 1.00 0.00 H ATOM 1470 H ARG B 23 -1.603 4.284 -5.192 1.00 0.00 H ATOM 1471 N ARG B 24 -0.163 2.514 -7.625 1.00 25.27 N ATOM 1472 CA ARG B 24 0.800 1.779 -8.426 1.00 24.58 C ATOM 1473 C ARG B 24 0.960 0.353 -7.917 1.00 26.53 C ATOM 1474 O ARG B 24 1.061 -0.582 -8.713 1.00 25.33 O ATOM 1475 CB ARG B 24 2.140 2.504 -8.425 1.00 25.82 C ATOM 1476 CG ARG B 24 3.234 1.777 -9.181 1.00 29.70 C ATOM 1477 CD ARG B 24 4.599 2.414 -8.863 1.00 31.56 C ATOM 1478 NE ARG B 24 5.729 1.635 -9.364 1.00 31.83 N ATOM 1479 CZ ARG B 24 6.209 0.538 -8.777 1.00 31.12 C ATOM 1480 NH1 ARG B 24 5.662 0.073 -7.647 1.00 31.74 N ATOM 1481 NH2 ARG B 24 7.235 -0.099 -9.320 1.00 31.09 N ATOM 1482 HE ARG B 24 6.191 1.958 -10.238 1.00 0.00 H ATOM 1483 HH12 ARG B 24 6.045 -0.783 -7.198 1.00 0.00 H ATOM 1484 HH11 ARG B 24 4.854 0.568 -7.218 1.00 0.00 H ATOM 1485 HH22 ARG B 24 7.614 -0.955 -8.867 1.00 0.00 H ATOM 1486 HH21 ARG B 24 7.662 0.257 -10.199 1.00 0.00 H ATOM 1487 H ARG B 24 0.149 3.322 -7.050 1.00 0.00 H ATOM 1488 N ALA B 25 0.984 0.170 -6.594 1.00 24.62 N ATOM 1489 CA ALA B 25 1.124 -1.172 -6.038 1.00 27.33 C ATOM 1490 C ALA B 25 -0.046 -2.063 -6.445 1.00 24.81 C ATOM 1491 O ALA B 25 0.144 -3.254 -6.740 1.00 28.19 O ATOM 1492 CB ALA B 25 1.246 -1.087 -4.511 1.00 27.84 C ATOM 1493 H ALA B 25 0.903 0.988 -5.957 1.00 0.00 H ATOM 1494 N ALA B 26 -1.264 -1.519 -6.407 1.00 25.59 N ATOM 1495 CA ALA B 26 -2.445 -2.206 -6.933 1.00 25.23 C ATOM 1496 C ALA B 26 -2.238 -2.651 -8.380 1.00 26.88 C ATOM 1497 O ALA B 26 -2.411 -3.828 -8.719 1.00 25.30 O ATOM 1498 CB ALA B 26 -3.655 -1.281 -6.855 1.00 24.28 C ATOM 1499 H ALA B 26 -1.378 -0.574 -5.989 1.00 0.00 H ATOM 1500 N LEU B 27 -1.898 -1.707 -9.250 1.00 23.71 N ATOM 1501 CA LEU B 27 -1.751 -2.024 -10.672 1.00 24.80 C ATOM 1502 C LEU B 27 -0.618 -3.015 -10.906 1.00 28.17 C ATOM 1503 O LEU B 27 -0.730 -3.916 -11.747 1.00 27.53 O ATOM 1504 CB LEU B 27 -1.513 -0.741 -11.464 1.00 24.66 C ATOM 1505 CG LEU B 27 -2.624 0.301 -11.346 1.00 26.49 C ATOM 1506 CD1 LEU B 27 -2.214 1.588 -12.047 1.00 23.86 C ATOM 1507 CD2 LEU B 27 -3.921 -0.244 -11.942 1.00 29.03 C ATOM 1508 H LEU B 27 -1.735 -0.735 -8.919 1.00 0.00 H ATOM 1509 N LEU B 28 0.497 -2.857 -10.189 1.00 26.76 N ATOM 1510 CA LEU B 28 1.579 -3.817 -10.335 1.00 27.81 C ATOM 1511 C LEU B 28 1.108 -5.221 -9.982 1.00 28.12 C ATOM 1512 O LEU B 28 1.429 -6.184 -10.685 1.00 28.03 O ATOM 1513 CB LEU B 28 2.757 -3.404 -9.464 1.00 28.88 C ATOM 1514 CG LEU B 28 3.988 -4.301 -9.422 1.00 34.60 C ATOM 1515 CD1 LEU B 28 4.697 -4.294 -10.752 1.00 36.92 C ATOM 1516 CD2 LEU B 28 4.882 -3.859 -8.257 1.00 36.55 C ATOM 1517 H LEU B 28 0.591 -2.056 -9.533 1.00 0.00 H ATOM 1518 N ARG B 29 0.309 -5.349 -8.914 1.00 25.55 N ATOM 1519 CA ARG B 29 -0.185 -6.666 -8.532 1.00 30.24 C ATOM 1520 C ARG B 29 -1.107 -7.230 -9.603 1.00 30.66 C ATOM 1521 O ARG B 29 -1.068 -8.431 -9.895 1.00 32.82 O ATOM 1522 CB ARG B 29 -0.907 -6.587 -7.177 1.00 33.06 C ATOM 1523 CG ARG B 29 -1.253 -7.961 -6.611 1.00 37.61 C ATOM 1524 CD ARG B 29 -1.749 -7.880 -5.177 1.00 45.12 C ATOM 1525 NE ARG B 29 -3.067 -7.269 -5.099 1.00 49.64 N ATOM 1526 CZ ARG B 29 -3.305 -6.096 -4.522 1.00 53.52 C ATOM 1527 NH1 ARG B 29 -2.305 -5.414 -3.970 1.00 56.02 N ATOM 1528 NH2 ARG B 29 -4.539 -5.608 -4.499 1.00 53.15 N ATOM 1529 HE ARG B 29 -3.869 -7.780 -5.519 1.00 0.00 H ATOM 1530 HH12 ARG B 29 -2.489 -4.496 -3.518 1.00 0.00 H ATOM 1531 HH11 ARG B 29 -1.339 -5.799 -3.991 1.00 0.00 H ATOM 1532 HH22 ARG B 29 -4.727 -4.690 -4.048 1.00 0.00 H ATOM 1533 HH21 ARG B 29 -5.318 -6.144 -4.932 1.00 0.00 H ATOM 1534 H ARG B 29 0.042 -4.511 -8.359 1.00 0.00 H ATOM 1535 N ALA B 30 -1.944 -6.378 -10.199 1.00 28.03 N ATOM 1536 CA ALA B 30 -2.844 -6.841 -11.254 1.00 27.52 C ATOM 1537 C ALA B 30 -2.070 -7.363 -12.451 1.00 29.69 C ATOM 1538 O ALA B 30 -2.526 -8.284 -13.136 1.00 33.02 O ATOM 1539 CB ALA B 30 -3.771 -5.706 -11.700 1.00 28.47 C ATOM 1540 H ALA B 30 -1.956 -5.379 -9.911 1.00 0.00 H ATOM 1541 N LEU B 31 -0.897 -6.797 -12.714 1.00 24.03 N ATOM 1542 CA LEU B 31 -0.141 -7.135 -13.909 1.00 23.42 C ATOM 1543 C LEU B 31 0.910 -8.203 -13.659 1.00 29.49 C ATOM 1544 O LEU B 31 1.574 -8.634 -14.613 1.00 30.91 O ATOM 1545 CB LEU B 31 0.525 -5.876 -14.476 1.00 25.98 C ATOM 1546 CG LEU B 31 -0.448 -4.802 -15.006 1.00 30.62 C ATOM 1547 CD1 LEU B 31 0.277 -3.502 -15.339 1.00 30.59 C ATOM 1548 CD2 LEU B 31 -1.201 -5.312 -16.228 1.00 33.54 C ATOM 1549 H LEU B 31 -0.511 -6.096 -12.050 1.00 0.00 H ATOM 1550 N THR B 32 1.105 -8.609 -12.406 1.00 29.86 N ATOM 1551 CA THR B 32 2.092 -9.632 -12.103 1.00 31.65 C ATOM 1552 C THR B 32 1.481 -10.758 -11.276 1.00 30.27 C ATOM 1553 O THR B 32 1.102 -11.790 -11.843 1.00 31.73 O ATOM 1554 CB THR B 32 3.305 -9.011 -11.399 1.00 31.93 C ATOM 1555 OG1 THR B 32 2.897 -8.279 -10.239 1.00 30.46 O ATOM 1556 CG2 THR B 32 4.053 -8.075 -12.354 1.00 32.18 C ATOM 1557 HG1 THR B 32 2.277 -7.555 -10.508 1.00 0.00 H ATOM 1558 H THR B 32 0.545 -8.190 -11.636 1.00 0.00 H ATOM 1559 N LYS B 33 1.368 -10.576 -9.953 1.00 32.41 N ATOM 1560 CA LYS B 33 0.921 -11.667 -9.083 1.00 34.15 C ATOM 1561 C LYS B 33 -0.492 -12.131 -9.421 1.00 33.00 C ATOM 1562 O LYS B 33 -0.789 -13.333 -9.377 1.00 30.86 O ATOM 1563 CB LYS B 33 0.986 -11.239 -7.615 1.00 38.12 C ATOM 1564 CG LYS B 33 0.727 -12.387 -6.634 1.00 45.94 C ATOM 1565 CD LYS B 33 0.654 -11.932 -5.175 1.00 54.00 C ATOM 1566 CE LYS B 33 -0.728 -11.412 -4.802 1.00 59.01 C ATOM 1567 NZ LYS B 33 -0.827 -11.066 -3.352 1.00 61.24 N ATOM 1568 HZ1 LYS B 33 -0.635 -11.913 -2.781 1.00 0.00 H ATOM 1569 HZ2 LYS B 33 -0.131 -10.328 -3.125 1.00 0.00 H ATOM 1570 HZ3 LYS B 33 -1.784 -10.717 -3.145 1.00 0.00 H ATOM 1571 H LYS B 33 1.600 -9.650 -9.539 1.00 0.00 H ATOM 1572 N ASP B 34 -1.390 -11.192 -9.702 1.00 28.74 N ATOM 1573 CA ASP B 34 -2.792 -11.497 -9.963 1.00 27.91 C ATOM 1574 C ASP B 34 -3.124 -11.523 -11.457 1.00 26.25 C ATOM 1575 O ASP B 34 -4.295 -11.412 -11.821 1.00 29.69 O ATOM 1576 CB ASP B 34 -3.692 -10.481 -9.271 1.00 29.93 C ATOM 1577 CG ASP B 34 -3.605 -10.549 -7.742 1.00 38.18 C ATOM 1578 OD1 ASP B 34 -3.124 -11.572 -7.216 1.00 36.39 O ATOM 1579 OD2 ASP B 34 -4.036 -9.578 -7.087 1.00 34.33 O ATOM 1580 H ASP B 34 -1.080 -10.200 -9.737 1.00 0.00 H ATOM 1581 N VAL B 35 -2.130 -11.695 -12.325 1.00 31.31 N ATOM 1582 CA VAL B 35 -2.360 -11.428 -13.746 1.00 31.07 C ATOM 1583 C VAL B 35 -3.386 -12.377 -14.368 1.00 28.59 C ATOM 1584 O VAL B 35 -4.115 -11.982 -15.282 1.00 31.75 O ATOM 1585 CB VAL B 35 -1.027 -11.455 -14.519 1.00 30.25 C ATOM 1586 CG1 VAL B 35 -0.456 -12.889 -14.587 1.00 35.50 C ATOM 1587 CG2 VAL B 35 -1.222 -10.888 -15.934 1.00 28.59 C ATOM 1588 H VAL B 35 -1.197 -12.017 -11.996 1.00 0.00 H ATOM 1589 N ASP B 36 -3.454 -13.639 -13.926 1.00 28.24 N ATOM 1590 CA ASP B 36 -4.434 -14.538 -14.536 1.00 30.05 C ATOM 1591 C ASP B 36 -5.851 -14.124 -14.178 1.00 30.45 C ATOM 1592 O ASP B 36 -6.765 -14.236 -15.005 1.00 32.08 O ATOM 1593 CB ASP B 36 -4.196 -15.982 -14.101 1.00 33.66 C ATOM 1594 CG ASP B 36 -2.806 -16.471 -14.458 1.00 43.14 C ATOM 1595 OD1 ASP B 36 -2.334 -16.204 -15.577 1.00 45.59 O ATOM 1596 OD2 ASP B 36 -2.170 -17.110 -13.611 1.00 49.98 O ATOM 1597 H ASP B 36 -2.825 -13.972 -13.167 1.00 0.00 H ATOM 1598 N ASP B 37 -6.057 -13.698 -12.933 1.00 29.57 N ATOM 1599 CA ASP B 37 -7.348 -13.170 -12.510 1.00 32.05 C ATOM 1600 C ASP B 37 -7.682 -11.921 -13.310 1.00 29.49 C ATOM 1601 O ASP B 37 -8.784 -11.786 -13.852 1.00 31.47 O ATOM 1602 CB ASP B 37 -7.298 -12.873 -11.005 1.00 30.23 C ATOM 1603 CG ASP B 37 -8.644 -12.457 -10.406 1.00 40.58 C ATOM 1604 OD1 ASP B 37 -9.678 -12.399 -11.111 1.00 42.20 O ATOM 1605 OD2 ASP B 37 -8.661 -12.201 -9.177 1.00 42.88 O ATOM 1606 H ASP B 37 -5.278 -13.743 -12.246 1.00 0.00 H ATOM 1607 N PHE B 38 -6.713 -11.012 -13.415 1.00 28.67 N ATOM 1608 CA PHE B 38 -6.913 -9.765 -14.152 1.00 28.23 C ATOM 1609 C PHE B 38 -7.224 -10.050 -15.621 1.00 27.56 C ATOM 1610 O PHE B 38 -8.193 -9.526 -16.183 1.00 30.14 O ATOM 1611 CB PHE B 38 -5.661 -8.896 -14.010 1.00 28.08 C ATOM 1612 CG PHE B 38 -5.558 -7.814 -15.043 1.00 27.44 C ATOM 1613 CD1 PHE B 38 -6.439 -6.744 -15.030 1.00 25.88 C ATOM 1614 CD2 PHE B 38 -4.588 -7.870 -16.033 1.00 27.81 C ATOM 1615 CE1 PHE B 38 -6.361 -5.751 -16.009 1.00 28.30 C ATOM 1616 CE2 PHE B 38 -4.494 -6.866 -16.995 1.00 31.03 C ATOM 1617 CZ PHE B 38 -5.382 -5.818 -16.986 1.00 32.36 C ATOM 1618 H PHE B 38 -5.794 -11.194 -12.963 1.00 0.00 H ATOM 1619 N TYR B 39 -6.405 -10.891 -16.247 1.00 26.53 N ATOM 1620 CA TYR B 39 -6.603 -11.284 -17.642 1.00 28.52 C ATOM 1621 C TYR B 39 -8.019 -11.791 -17.878 1.00 30.78 C ATOM 1622 O TYR B 39 -8.696 -11.385 -18.837 1.00 31.21 O ATOM 1623 CB TYR B 39 -5.570 -12.359 -17.999 1.00 29.27 C ATOM 1624 CG TYR B 39 -5.453 -12.701 -19.490 1.00 31.60 C ATOM 1625 CD1 TYR B 39 -6.187 -13.749 -20.045 1.00 32.27 C ATOM 1626 CD2 TYR B 39 -4.602 -11.985 -20.321 1.00 36.02 C ATOM 1627 CE1 TYR B 39 -6.072 -14.069 -21.400 1.00 34.40 C ATOM 1628 CE2 TYR B 39 -4.472 -12.302 -21.672 1.00 38.89 C ATOM 1629 CZ TYR B 39 -5.215 -13.343 -22.199 1.00 37.04 C ATOM 1630 OH TYR B 39 -5.106 -13.639 -23.539 1.00 41.92 O ATOM 1631 HH TYR B 39 -4.168 -13.876 -23.748 1.00 0.00 H ATOM 1632 H TYR B 39 -5.595 -11.283 -15.726 1.00 0.00 H ATOM 1633 N SER B 40 -8.484 -12.679 -17.000 1.00 31.53 N ATOM 1634 CA SER B 40 -9.777 -13.328 -17.171 1.00 37.23 C ATOM 1635 C SER B 40 -10.927 -12.351 -16.986 1.00 34.30 C ATOM 1636 O SER B 40 -11.956 -12.476 -17.662 1.00 33.08 O ATOM 1637 CB SER B 40 -9.898 -14.492 -16.186 1.00 45.08 C ATOM 1638 OG SER B 40 -11.237 -14.944 -16.090 1.00 49.44 O ATOM 1639 HG SER B 40 -11.813 -14.202 -15.776 1.00 0.00 H ATOM 1640 H SER B 40 -7.907 -12.916 -16.168 1.00 0.00 H ATOM 1641 N GLN B 41 -10.765 -11.373 -16.093 1.00 30.02 N ATOM 1642 CA GLN B 41 -11.783 -10.339 -15.917 1.00 32.74 C ATOM 1643 C GLN B 41 -11.918 -9.422 -17.134 1.00 35.09 C ATOM 1644 O GLN B 41 -12.997 -8.848 -17.348 1.00 32.79 O ATOM 1645 CB GLN B 41 -11.470 -9.521 -14.669 1.00 28.95 C ATOM 1646 CG GLN B 41 -11.618 -10.330 -13.393 1.00 31.28 C ATOM 1647 CD GLN B 41 -11.619 -9.461 -12.163 1.00 33.46 C ATOM 1648 OE1 GLN B 41 -12.029 -8.291 -12.207 1.00 32.47 O ATOM 1649 NE2 GLN B 41 -11.146 -10.019 -11.049 1.00 35.97 N ATOM 1650 HE22 GLN B 41 -10.813 -11.004 -11.062 1.00 0.00 H ATOM 1651 HE21 GLN B 41 -11.110 -9.469 -10.167 1.00 0.00 H ATOM 1652 H GLN B 41 -9.902 -11.346 -15.514 1.00 0.00 H ATOM 1653 N CYS B 42 -10.854 -9.263 -17.933 1.00 32.85 N ATOM 1654 CA CYS B 42 -10.886 -8.432 -19.145 1.00 35.14 C ATOM 1655 C CYS B 42 -11.491 -9.232 -20.295 1.00 36.50 C ATOM 1656 O CYS B 42 -10.855 -9.519 -21.314 1.00 37.34 O ATOM 1657 CB CYS B 42 -9.494 -7.929 -19.505 1.00 33.67 C ATOM 1658 SG CYS B 42 -8.880 -6.737 -18.319 1.00 30.20 S ATOM 1659 H CYS B 42 -9.968 -9.748 -17.685 1.00 0.00 H ATOM 1660 N ASP B 43 -12.759 -9.565 -20.105 1.00 37.04 N ATOM 1661 CA ASP B 43 -13.522 -10.398 -21.024 1.00 39.11 C ATOM 1662 C ASP B 43 -13.892 -9.602 -22.267 1.00 35.53 C ATOM 1663 O ASP B 43 -14.662 -8.637 -22.161 1.00 36.73 O ATOM 1664 CB ASP B 43 -14.784 -10.886 -20.309 1.00 39.25 C ATOM 1665 CG ASP B 43 -15.580 -11.905 -21.110 1.00 44.97 C ATOM 1666 OD1 ASP B 43 -15.287 -12.122 -22.308 1.00 45.88 O ATOM 1667 OD2 ASP B 43 -16.520 -12.487 -20.521 1.00 46.68 O ATOM 1668 H ASP B 43 -13.237 -9.212 -19.251 1.00 0.00 H ATOM 1669 N PRO B 44 -13.390 -9.971 -23.449 1.00 39.78 N ATOM 1670 CA PRO B 44 -13.775 -9.256 -24.681 1.00 42.62 C ATOM 1671 C PRO B 44 -15.273 -9.246 -24.938 1.00 47.05 C ATOM 1672 O PRO B 44 -15.748 -8.407 -25.713 1.00 49.32 O ATOM 1673 CB PRO B 44 -13.032 -10.028 -25.781 1.00 41.33 C ATOM 1674 CG PRO B 44 -11.949 -10.766 -25.076 1.00 40.32 C ATOM 1675 CD PRO B 44 -12.489 -11.101 -23.725 1.00 39.22 C ATOM 1676 N GLU B 45 -16.026 -10.150 -24.311 1.00 45.12 N ATOM 1677 CA GLU B 45 -17.466 -10.251 -24.512 1.00 47.69 C ATOM 1678 C GLU B 45 -18.261 -9.201 -23.757 1.00 42.15 C ATOM 1679 O GLU B 45 -19.398 -8.927 -24.144 1.00 40.92 O ATOM 1680 CB GLU B 45 -17.966 -11.635 -24.085 1.00 54.91 C ATOM 1681 CG GLU B 45 -17.226 -12.771 -24.742 1.00 60.02 C ATOM 1682 CD GLU B 45 -17.405 -12.755 -26.238 1.00 66.77 C ATOM 1683 OE1 GLU B 45 -18.548 -12.536 -26.691 1.00 69.93 O ATOM 1684 OE2 GLU B 45 -16.405 -12.937 -26.960 1.00 69.36 O ATOM 1685 H GLU B 45 -15.567 -10.810 -23.651 1.00 0.00 H ATOM 1686 N LYS B 46 -17.711 -8.627 -22.685 1.00 36.51 N ATOM 1687 CA LYS B 46 -18.419 -7.616 -21.908 1.00 35.13 C ATOM 1688 C LYS B 46 -18.333 -6.268 -22.620 1.00 33.95 C ATOM 1689 O LYS B 46 -17.682 -6.132 -23.654 1.00 34.32 O ATOM 1690 CB LYS B 46 -17.830 -7.522 -20.500 1.00 38.41 C ATOM 1691 CG LYS B 46 -18.088 -8.747 -19.644 1.00 46.55 C ATOM 1692 CD LYS B 46 -17.157 -8.817 -18.442 1.00 51.60 C ATOM 1693 CE LYS B 46 -17.641 -9.858 -17.439 1.00 54.40 C ATOM 1694 NZ LYS B 46 -17.651 -9.301 -16.065 1.00 56.99 N ATOM 1695 HZ1 LYS B 46 -16.688 -9.006 -15.805 1.00 0.00 H ATOM 1696 HZ2 LYS B 46 -18.288 -8.479 -16.030 1.00 0.00 H ATOM 1697 HZ3 LYS B 46 -17.984 -10.028 -15.400 1.00 0.00 H ATOM 1698 H LYS B 46 -16.752 -8.908 -22.396 1.00 0.00 H ATOM 1699 N GLU B 47 -18.985 -5.252 -22.057 1.00 34.31 N ATOM 1700 CA GLU B 47 -18.805 -3.886 -22.543 1.00 36.67 C ATOM 1701 C GLU B 47 -17.370 -3.427 -22.272 1.00 33.99 C ATOM 1702 O GLU B 47 -16.559 -4.160 -21.691 1.00 35.76 O ATOM 1703 CB GLU B 47 -19.832 -2.964 -21.891 1.00 38.90 C ATOM 1704 CG GLU B 47 -21.259 -3.417 -22.172 1.00 46.83 C ATOM 1705 CD GLU B 47 -22.306 -2.502 -21.580 1.00 56.94 C ATOM 1706 OE1 GLU B 47 -22.419 -2.458 -20.335 1.00 58.92 O ATOM 1707 OE2 GLU B 47 -23.028 -1.843 -22.364 1.00 63.73 O ATOM 1708 H GLU B 47 -19.630 -5.433 -21.262 1.00 0.00 H ATOM 1709 N ASN B 48 -17.041 -2.193 -22.682 1.00 30.65 N ATOM 1710 CA ASN B 48 -15.659 -1.743 -22.553 1.00 30.01 C ATOM 1711 C ASN B 48 -15.276 -1.640 -21.080 1.00 29.06 C ATOM 1712 O ASN B 48 -16.043 -1.129 -20.252 1.00 27.98 O ATOM 1713 CB ASN B 48 -15.407 -0.414 -23.282 1.00 32.09 C ATOM 1714 CG ASN B 48 -16.526 0.602 -23.138 1.00 30.07 C ATOM 1715 OD1 ASN B 48 -16.755 1.386 -24.062 1.00 30.75 O ATOM 1716 ND2 ASN B 48 -17.199 0.632 -21.988 1.00 27.23 N ATOM 1717 HD22 ASN B 48 -16.973 -0.049 -21.235 1.00 0.00 H ATOM 1718 HD21 ASN B 48 -17.951 1.336 -21.844 1.00 0.00 H ATOM 1719 H ASN B 48 -17.763 -1.564 -23.087 1.00 0.00 H ATOM 1720 N LEU B 49 -14.089 -2.147 -20.763 1.00 29.55 N ATOM 1721 CA LEU B 49 -13.599 -2.253 -19.397 1.00 27.12 C ATOM 1722 C LEU B 49 -12.314 -1.462 -19.251 1.00 27.30 C ATOM 1723 O LEU B 49 -11.569 -1.282 -20.223 1.00 25.16 O ATOM 1724 CB LEU B 49 -13.333 -3.715 -19.020 1.00 30.03 C ATOM 1725 CG LEU B 49 -14.562 -4.620 -18.968 1.00 33.56 C ATOM 1726 CD1 LEU B 49 -14.112 -6.067 -18.784 1.00 37.14 C ATOM 1727 CD2 LEU B 49 -15.509 -4.183 -17.850 1.00 34.61 C ATOM 1728 H LEU B 49 -13.477 -2.486 -21.533 1.00 0.00 H ATOM 1729 N CYS B 50 -12.067 -0.989 -18.027 1.00 25.75 N ATOM 1730 CA CYS B 50 -10.811 -0.339 -17.664 1.00 27.01 C ATOM 1731 C CYS B 50 -10.221 -0.994 -16.426 1.00 23.14 C ATOM 1732 O CYS B 50 -10.930 -1.623 -15.630 1.00 25.78 O ATOM 1733 CB CYS B 50 -10.974 1.159 -17.354 1.00 29.91 C ATOM 1734 SG CYS B 50 -12.211 2.063 -18.324 1.00 33.33 S ATOM 1735 H CYS B 50 -12.803 -1.088 -17.299 1.00 0.00 H ATOM 1736 N LEU B 51 -8.908 -0.787 -16.254 1.00 25.68 N ATOM 1737 CA LEU B 51 -8.179 -1.211 -15.063 1.00 26.63 C ATOM 1738 C LEU B 51 -7.900 -0.004 -14.177 1.00 23.55 C ATOM 1739 O LEU B 51 -7.241 0.952 -14.604 1.00 21.41 O ATOM 1740 CB LEU B 51 -6.877 -1.904 -15.441 1.00 26.30 C ATOM 1741 CG LEU B 51 -5.924 -2.215 -14.269 1.00 26.56 C ATOM 1742 CD1 LEU B 51 -6.517 -3.266 -13.291 1.00 23.02 C ATOM 1743 CD2 LEU B 51 -4.577 -2.680 -14.828 1.00 28.04 C ATOM 1744 H LEU B 51 -8.382 -0.300 -17.007 1.00 0.00 H ATOM 1745 N TYR B 52 -8.406 -0.050 -12.942 1.00 23.60 N ATOM 1746 CA TYR B 52 -8.203 1.001 -11.958 1.00 21.86 C ATOM 1747 C TYR B 52 -7.263 0.526 -10.856 1.00 25.80 C ATOM 1748 O TYR B 52 -7.249 -0.652 -10.492 1.00 27.64 O ATOM 1749 CB TYR B 52 -9.523 1.412 -11.296 1.00 24.74 C ATOM 1750 CG TYR B 52 -10.532 2.018 -12.226 1.00 25.46 C ATOM 1751 CD1 TYR B 52 -11.414 1.215 -12.947 1.00 29.94 C ATOM 1752 CD2 TYR B 52 -10.628 3.402 -12.370 1.00 24.37 C ATOM 1753 CE1 TYR B 52 -12.362 1.770 -13.803 1.00 30.83 C ATOM 1754 CE2 TYR B 52 -11.559 3.959 -13.223 1.00 29.90 C ATOM 1755 CZ TYR B 52 -12.424 3.146 -13.935 1.00 31.71 C ATOM 1756 OH TYR B 52 -13.361 3.708 -14.768 1.00 35.74 O ATOM 1757 HH TYR B 52 -12.903 4.242 -15.465 1.00 0.00 H ATOM 1758 H TYR B 52 -8.973 -0.878 -12.671 1.00 0.00 H ATOM 1759 N GLY B 53 -6.481 1.456 -10.324 1.00 25.12 N ATOM 1760 CA GLY B 53 -5.790 1.210 -9.068 1.00 21.78 C ATOM 1761 C GLY B 53 -6.284 2.181 -8.010 1.00 25.22 C ATOM 1762 O GLY B 53 -6.384 3.381 -8.274 1.00 26.40 O ATOM 1763 H GLY B 53 -6.361 2.368 -10.809 1.00 0.00 H ATOM 1764 N HIS B 54 -6.552 1.694 -6.802 1.00 26.56 N ATOM 1765 CA HIS B 54 -7.172 2.491 -5.752 1.00 25.67 C ATOM 1766 C HIS B 54 -6.196 2.782 -4.613 1.00 28.23 C ATOM 1767 O HIS B 54 -5.204 2.065 -4.439 1.00 26.66 O ATOM 1768 CB HIS B 54 -8.400 1.754 -5.219 1.00 27.22 C ATOM 1769 CG HIS B 54 -9.515 1.662 -6.208 1.00 29.42 C ATOM 1770 ND1 HIS B 54 -10.114 2.779 -6.751 1.00 31.39 N ATOM 1771 CD2 HIS B 54 -10.138 0.594 -6.760 1.00 32.75 C ATOM 1772 CE1 HIS B 54 -11.058 2.403 -7.599 1.00 30.21 C ATOM 1773 NE2 HIS B 54 -11.101 1.083 -7.615 1.00 30.03 N ATOM 1774 H HIS B 54 -6.309 0.703 -6.598 1.00 0.00 H ATOM 1775 N PRO B 55 -6.422 3.847 -3.836 1.00 26.37 N ATOM 1776 CA PRO B 55 -5.447 4.222 -2.784 1.00 27.61 C ATOM 1777 C PRO B 55 -5.374 3.232 -1.620 1.00 28.61 C ATOM 1778 O PRO B 55 -4.471 3.361 -0.768 1.00 30.05 O ATOM 1779 CB PRO B 55 -5.956 5.593 -2.295 1.00 32.33 C ATOM 1780 CG PRO B 55 -6.960 6.038 -3.322 1.00 32.09 C ATOM 1781 CD PRO B 55 -7.546 4.794 -3.890 1.00 27.49 C ATOM 1782 N ASN B 56 -6.257 2.245 -1.554 1.00 29.53 N ATOM 1783 CA ASN B 56 -6.133 1.169 -0.560 1.00 27.28 C ATOM 1784 C ASN B 56 -5.354 -0.029 -1.095 1.00 29.36 C ATOM 1785 O ASN B 56 -5.413 -1.111 -0.504 1.00 27.59 O ATOM 1786 CB ASN B 56 -7.528 0.726 -0.083 1.00 26.20 C ATOM 1787 CG ASN B 56 -8.284 -0.056 -1.145 1.00 31.79 C ATOM 1788 OD1 ASN B 56 -7.921 -0.025 -2.327 1.00 31.07 O ATOM 1789 ND2 ASN B 56 -9.334 -0.756 -0.739 1.00 27.33 N ATOM 1790 HD22 ASN B 56 -9.604 -0.754 0.265 1.00 0.00 H ATOM 1791 HD21 ASN B 56 -9.888 -1.308 -1.425 1.00 0.00 H ATOM 1792 H ASN B 56 -7.055 2.232 -2.220 1.00 0.00 H ATOM 1793 N GLU B 57 -4.675 0.133 -2.238 1.00 26.21 N ATOM 1794 CA GLU B 57 -3.844 -0.870 -2.900 1.00 26.08 C ATOM 1795 C GLU B 57 -4.629 -2.005 -3.544 1.00 25.01 C ATOM 1796 O GLU B 57 -4.031 -3.014 -3.942 1.00 26.95 O ATOM 1797 CB GLU B 57 -2.777 -1.435 -1.951 1.00 28.61 C ATOM 1798 CG GLU B 57 -1.816 -0.351 -1.509 1.00 36.16 C ATOM 1799 CD GLU B 57 -0.481 -0.877 -0.982 1.00 47.57 C ATOM 1800 OE1 GLU B 57 -0.241 -2.103 -1.027 1.00 49.40 O ATOM 1801 OE2 GLU B 57 0.348 -0.044 -0.553 1.00 50.67 O ATOM 1802 H GLU B 57 -4.746 1.063 -2.699 1.00 0.00 H ATOM 1803 N SER B 58 -5.930 -1.852 -3.729 1.00 25.44 N ATOM 1804 CA SER B 58 -6.689 -2.842 -4.474 1.00 28.66 C ATOM 1805 C SER B 58 -6.855 -2.399 -5.927 1.00 25.14 C ATOM 1806 O SER B 58 -6.966 -1.202 -6.238 1.00 24.37 O ATOM 1807 CB SER B 58 -8.067 -3.068 -3.841 1.00 30.94 C ATOM 1808 OG SER B 58 -8.920 -1.989 -4.148 1.00 32.71 O ATOM 1809 HG SER B 58 -8.531 -1.151 -3.793 1.00 0.00 H ATOM 1810 H SER B 58 -6.413 -1.018 -3.339 1.00 0.00 H ATOM 1811 N TRP B 59 -6.868 -3.380 -6.819 1.00 24.59 N ATOM 1812 CA TRP B 59 -7.134 -3.108 -8.223 1.00 23.12 C ATOM 1813 C TRP B 59 -8.546 -3.570 -8.577 1.00 27.41 C ATOM 1814 O TRP B 59 -9.157 -4.382 -7.873 1.00 27.64 O ATOM 1815 CB TRP B 59 -6.093 -3.787 -9.114 1.00 21.17 C ATOM 1816 CG TRP B 59 -6.034 -5.302 -9.043 1.00 23.27 C ATOM 1817 CD1 TRP B 59 -5.162 -6.061 -8.297 1.00 23.30 C ATOM 1818 CD2 TRP B 59 -6.831 -6.235 -9.800 1.00 24.26 C ATOM 1819 NE1 TRP B 59 -5.380 -7.406 -8.538 1.00 25.81 N ATOM 1820 CE2 TRP B 59 -6.400 -7.534 -9.453 1.00 28.46 C ATOM 1821 CE3 TRP B 59 -7.871 -6.090 -10.740 1.00 24.07 C ATOM 1822 CZ2 TRP B 59 -6.967 -8.680 -10.011 1.00 29.29 C ATOM 1823 CZ3 TRP B 59 -8.436 -7.218 -11.277 1.00 24.15 C ATOM 1824 CH2 TRP B 59 -7.975 -8.506 -10.923 1.00 26.36 C ATOM 1825 HE1 TRP B 59 -4.858 -8.192 -8.099 1.00 0.00 H ATOM 1826 H TRP B 59 -6.686 -4.356 -6.511 1.00 0.00 H ATOM 1827 N GLU B 60 -9.072 -3.021 -9.673 1.00 24.84 N ATOM 1828 CA GLU B 60 -10.459 -3.267 -10.060 1.00 26.16 C ATOM 1829 C GLU B 60 -10.568 -3.182 -11.574 1.00 24.66 C ATOM 1830 O GLU B 60 -10.045 -2.246 -12.175 1.00 24.98 O ATOM 1831 CB GLU B 60 -11.396 -2.240 -9.405 1.00 25.55 C ATOM 1832 CG GLU B 60 -12.880 -2.357 -9.809 1.00 29.82 C ATOM 1833 CD GLU B 60 -13.757 -1.218 -9.273 1.00 33.42 C ATOM 1834 OE1 GLU B 60 -13.223 -0.194 -8.801 1.00 34.29 O ATOM 1835 OE2 GLU B 60 -14.991 -1.351 -9.340 1.00 32.49 O ATOM 1836 H GLU B 60 -8.481 -2.404 -10.266 1.00 0.00 H ATOM 1837 N VAL B 61 -11.247 -4.147 -12.180 1.00 25.63 N ATOM 1838 CA VAL B 61 -11.647 -4.067 -13.584 1.00 22.37 C ATOM 1839 C VAL B 61 -13.118 -3.708 -13.607 1.00 27.95 C ATOM 1840 O VAL B 61 -13.924 -4.357 -12.928 1.00 31.29 O ATOM 1841 CB VAL B 61 -11.370 -5.397 -14.313 1.00 23.53 C ATOM 1842 CG1 VAL B 61 -12.059 -5.448 -15.738 1.00 21.69 C ATOM 1843 CG2 VAL B 61 -9.891 -5.618 -14.390 1.00 23.78 C ATOM 1844 H VAL B 61 -11.505 -4.994 -11.635 1.00 0.00 H ATOM 1845 N ASN B 62 -13.472 -2.638 -14.317 1.00 25.69 N ATOM 1846 CA ASN B 62 -14.863 -2.188 -14.293 1.00 30.08 C ATOM 1847 C ASN B 62 -15.179 -1.331 -15.511 1.00 31.09 C ATOM 1848 O ASN B 62 -14.291 -0.941 -16.283 1.00 28.50 O ATOM 1849 CB ASN B 62 -15.173 -1.415 -13.006 1.00 31.04 C ATOM 1850 CG ASN B 62 -16.638 -1.502 -12.616 1.00 33.53 C ATOM 1851 OD1 ASN B 62 -17.499 -1.742 -13.468 1.00 31.22 O ATOM 1852 ND2 ASN B 62 -16.929 -1.316 -11.329 1.00 34.63 N ATOM 1853 HD22 ASN B 62 -16.169 -1.116 -10.648 1.00 0.00 H ATOM 1854 HD21 ASN B 62 -17.916 -1.371 -11.006 1.00 0.00 H ATOM 1855 H ASN B 62 -12.765 -2.127 -14.883 1.00 0.00 H ATOM 1856 N LEU B 63 -16.487 -1.077 -15.692 1.00 27.39 N ATOM 1857 CA LEU B 63 -16.946 -0.098 -16.652 1.00 31.91 C ATOM 1858 C LEU B 63 -16.408 1.276 -16.280 1.00 30.69 C ATOM 1859 O LEU B 63 -16.152 1.551 -15.106 1.00 34.00 O ATOM 1860 CB LEU B 63 -18.475 -0.061 -16.678 1.00 32.31 C ATOM 1861 CG LEU B 63 -19.032 -1.435 -17.029 1.00 37.08 C ATOM 1862 CD1 LEU B 63 -20.516 -1.519 -16.686 1.00 42.38 C ATOM 1863 CD2 LEU B 63 -18.783 -1.705 -18.490 1.00 38.47 C ATOM 1864 H LEU B 63 -17.187 -1.598 -15.127 1.00 0.00 H ATOM 1865 N PRO B 64 -16.269 2.170 -17.256 1.00 30.38 N ATOM 1866 CA PRO B 64 -15.888 3.549 -16.934 1.00 34.62 C ATOM 1867 C PRO B 64 -16.895 4.193 -15.991 1.00 35.70 C ATOM 1868 O PRO B 64 -18.026 3.730 -15.840 1.00 34.67 O ATOM 1869 CB PRO B 64 -15.869 4.248 -18.297 1.00 37.39 C ATOM 1870 CG PRO B 64 -16.706 3.384 -19.177 1.00 38.35 C ATOM 1871 CD PRO B 64 -16.475 1.979 -18.700 1.00 33.13 C ATOM 1872 N ALA B 65 -16.465 5.291 -15.370 1.00 36.41 N ATOM 1873 CA ALA B 65 -17.237 5.942 -14.316 1.00 37.04 C ATOM 1874 C ALA B 65 -18.586 6.437 -14.821 1.00 42.00 C ATOM 1875 O ALA B 65 -18.711 6.903 -15.957 1.00 37.87 O ATOM 1876 CB ALA B 65 -16.444 7.120 -13.742 1.00 38.06 C ATOM 1877 H ALA B 65 -15.548 5.698 -15.646 1.00 0.00 H ATOM 1878 N GLU B 66 -19.591 6.345 -13.943 1.00 44.60 N ATOM 1879 CA GLU B 66 -20.934 6.860 -14.217 1.00 47.39 C ATOM 1880 C GLU B 66 -20.925 8.350 -14.535 1.00 43.70 C ATOM 1881 O GLU B 66 -21.608 8.801 -15.464 1.00 49.28 O ATOM 1882 CB GLU B 66 -21.851 6.612 -13.005 1.00 53.67 C ATOM 1883 CG GLU B 66 -23.294 7.136 -13.151 1.00 64.01 C ATOM 1884 CD GLU B 66 -23.780 7.945 -11.933 1.00 71.36 C ATOM 1885 OE1 GLU B 66 -23.288 7.696 -10.811 1.00 72.69 O ATOM 1886 OE2 GLU B 66 -24.676 8.810 -12.092 1.00 73.42 O ATOM 1887 H GLU B 66 -19.411 5.888 -13.026 1.00 0.00 H ATOM 1888 N GLU B 67 -20.208 9.135 -13.746 1.00 41.95 N ATOM 1889 CA GLU B 67 -20.294 10.581 -13.858 1.00 43.86 C ATOM 1890 C GLU B 67 -19.412 11.079 -14.997 1.00 39.37 C ATOM 1891 O GLU B 67 -18.243 10.698 -15.113 1.00 35.57 O ATOM 1892 CB GLU B 67 -19.913 11.242 -12.531 1.00 51.68 C ATOM 1893 CG GLU B 67 -19.284 12.614 -12.668 1.00 60.68 C ATOM 1894 CD GLU B 67 -20.305 13.679 -13.020 1.00 69.37 C ATOM 1895 OE1 GLU B 67 -21.521 13.383 -12.929 1.00 73.78 O ATOM 1896 OE2 GLU B 67 -19.892 14.798 -13.415 1.00 69.40 O ATOM 1897 H GLU B 67 -19.576 8.711 -13.037 1.00 0.00 H ATOM 1898 N VAL B 68 -19.986 11.927 -15.859 1.00 33.58 N ATOM 1899 CA VAL B 68 -19.299 12.437 -17.022 1.00 33.32 C ATOM 1900 C VAL B 68 -19.472 13.964 -17.038 1.00 33.02 C ATOM 1901 O VAL B 68 -20.598 14.445 -17.170 1.00 36.02 O ATOM 1902 CB VAL B 68 -19.858 11.835 -18.333 1.00 38.55 C ATOM 1903 CG1 VAL B 68 -19.045 12.323 -19.552 1.00 39.31 C ATOM 1904 CG2 VAL B 68 -19.844 10.324 -18.239 1.00 41.71 C ATOM 1905 H VAL B 68 -20.965 12.230 -15.684 1.00 0.00 H ATOM 1906 N PRO B 69 -18.396 14.744 -16.946 1.00 29.04 N ATOM 1907 CA PRO B 69 -16.990 14.331 -16.944 1.00 36.36 C ATOM 1908 C PRO B 69 -16.567 13.795 -15.583 1.00 40.38 C ATOM 1909 O PRO B 69 -17.140 14.193 -14.574 1.00 31.69 O ATOM 1910 CB PRO B 69 -16.234 15.626 -17.294 1.00 35.47 C ATOM 1911 CG PRO B 69 -17.127 16.719 -16.835 1.00 35.91 C ATOM 1912 CD PRO B 69 -18.544 16.213 -17.015 1.00 29.68 C ATOM 1913 N PRO B 70 -15.579 12.902 -15.558 1.00 45.01 N ATOM 1914 CA PRO B 70 -15.199 12.260 -14.292 1.00 45.64 C ATOM 1915 C PRO B 70 -14.480 13.235 -13.374 1.00 36.53 C ATOM 1916 O PRO B 70 -13.842 14.178 -13.825 1.00 32.08 O ATOM 1917 CB PRO B 70 -14.253 11.146 -14.743 1.00 49.59 C ATOM 1918 CG PRO B 70 -13.574 11.753 -15.966 1.00 46.94 C ATOM 1919 CD PRO B 70 -14.677 12.533 -16.670 1.00 46.04 C ATOM 1920 N GLU B 71 -14.578 13.011 -12.066 1.00 37.77 N ATOM 1921 CA GLU B 71 -13.764 13.829 -11.181 1.00 40.05 C ATOM 1922 C GLU B 71 -12.285 13.539 -11.434 1.00 35.89 C ATOM 1923 O GLU B 71 -11.505 14.448 -11.705 1.00 38.63 O ATOM 1924 CB GLU B 71 -14.160 13.586 -9.727 1.00 51.51 C ATOM 1925 CG GLU B 71 -14.308 12.082 -9.361 1.00 61.94 C ATOM 1926 CD GLU B 71 -15.681 11.535 -9.695 1.00 69.31 C ATOM 1927 OE1 GLU B 71 -15.911 11.170 -10.839 1.00 71.14 O ATOM 1928 OE2 GLU B 71 -16.449 11.328 -8.751 1.00 71.83 O ATOM 1929 H GLU B 71 -15.213 12.278 -11.691 1.00 0.00 H ATOM 1930 N LEU B 72 -11.903 12.274 -11.446 1.00 30.68 N ATOM 1931 CA LEU B 72 -10.496 11.955 -11.700 1.00 30.33 C ATOM 1932 C LEU B 72 -10.291 11.633 -13.168 1.00 26.21 C ATOM 1933 O LEU B 72 -11.220 11.173 -13.841 1.00 23.74 O ATOM 1934 CB LEU B 72 -10.032 10.741 -10.880 1.00 35.63 C ATOM 1935 CG LEU B 72 -9.857 10.853 -9.375 1.00 40.76 C ATOM 1936 CD1 LEU B 72 -8.930 9.738 -8.871 1.00 38.31 C ATOM 1937 CD2 LEU B 72 -9.349 12.231 -9.001 1.00 46.38 C ATOM 1938 H LEU B 72 -12.593 11.514 -11.277 1.00 0.00 H ATOM 1939 N PRO B 73 -9.092 11.880 -13.687 1.00 26.19 N ATOM 1940 CA PRO B 73 -8.733 11.315 -14.982 1.00 28.58 C ATOM 1941 C PRO B 73 -9.053 9.827 -15.001 1.00 28.65 C ATOM 1942 O PRO B 73 -8.974 9.134 -13.975 1.00 25.77 O ATOM 1943 CB PRO B 73 -7.227 11.580 -15.073 1.00 29.21 C ATOM 1944 CG PRO B 73 -7.037 12.815 -14.247 1.00 27.73 C ATOM 1945 CD PRO B 73 -8.012 12.712 -13.127 1.00 26.93 C ATOM 1946 N GLU B 74 -9.476 9.355 -16.181 1.00 25.37 N ATOM 1947 CA GLU B 74 -9.922 7.984 -16.305 1.00 25.04 C ATOM 1948 C GLU B 74 -8.884 7.148 -17.034 1.00 24.80 C ATOM 1949 O GLU B 74 -8.150 7.655 -17.895 1.00 22.34 O ATOM 1950 CB GLU B 74 -11.240 7.924 -17.075 1.00 31.51 C ATOM 1951 CG GLU B 74 -12.391 8.486 -16.305 1.00 38.59 C ATOM 1952 CD GLU B 74 -13.464 7.462 -16.068 1.00 49.16 C ATOM 1953 OE1 GLU B 74 -14.520 7.572 -16.711 1.00 53.18 O ATOM 1954 OE2 GLU B 74 -13.273 6.565 -15.219 1.00 50.25 O ATOM 1955 H GLU B 74 -9.484 9.978 -17.014 1.00 0.00 H ATOM 1956 N PRO B 75 -8.831 5.865 -16.741 1.00 22.97 N ATOM 1957 CA PRO B 75 -7.889 4.991 -17.440 1.00 22.54 C ATOM 1958 C PRO B 75 -8.380 4.620 -18.829 1.00 24.65 C ATOM 1959 O PRO B 75 -9.517 4.908 -19.233 1.00 23.84 O ATOM 1960 CB PRO B 75 -7.796 3.758 -16.520 1.00 27.27 C ATOM 1961 CG PRO B 75 -9.026 3.774 -15.722 1.00 29.27 C ATOM 1962 CD PRO B 75 -9.519 5.183 -15.630 1.00 24.93 C ATOM 1963 N ALA B 76 -7.465 3.993 -19.578 1.00 21.61 N ATOM 1964 CA ALA B 76 -7.765 3.585 -20.941 1.00 25.90 C ATOM 1965 C ALA B 76 -9.012 2.710 -20.974 1.00 27.33 C ATOM 1966 O ALA B 76 -9.173 1.784 -20.168 1.00 28.77 O ATOM 1967 CB ALA B 76 -6.569 2.852 -21.547 1.00 24.64 C ATOM 1968 H ALA B 76 -6.525 3.795 -19.179 1.00 0.00 H ATOM 1969 N LEU B 77 -9.900 3.040 -21.904 1.00 25.02 N ATOM 1970 CA LEU B 77 -11.197 2.406 -22.076 1.00 24.61 C ATOM 1971 C LEU B 77 -11.121 1.231 -23.049 1.00 23.61 C ATOM 1972 O LEU B 77 -10.520 1.352 -24.120 1.00 27.15 O ATOM 1973 CB LEU B 77 -12.162 3.446 -22.624 1.00 27.40 C ATOM 1974 CG LEU B 77 -13.564 2.935 -22.877 1.00 30.90 C ATOM 1975 CD1 LEU B 77 -14.075 2.462 -21.509 1.00 32.61 C ATOM 1976 CD2 LEU B 77 -14.403 4.069 -23.458 1.00 27.80 C ATOM 1977 H LEU B 77 -9.649 3.809 -22.558 1.00 0.00 H ATOM 1978 N GLY B 78 -11.732 0.104 -22.684 1.00 25.86 N ATOM 1979 CA GLY B 78 -11.874 -1.009 -23.613 1.00 30.25 C ATOM 1980 C GLY B 78 -10.687 -1.929 -23.802 1.00 29.77 C ATOM 1981 O GLY B 78 -10.582 -2.583 -24.849 1.00 27.77 O ATOM 1982 H GLY B 78 -12.114 0.018 -21.720 1.00 0.00 H ATOM 1983 N ILE B 79 -9.804 -2.044 -22.802 1.00 28.41 N ATOM 1984 CA ILE B 79 -8.615 -2.867 -22.960 1.00 27.47 C ATOM 1985 C ILE B 79 -8.991 -4.326 -23.182 1.00 27.23 C ATOM 1986 O ILE B 79 -8.228 -5.069 -23.810 1.00 29.63 O ATOM 1987 CB ILE B 79 -7.664 -2.687 -21.750 1.00 26.52 C ATOM 1988 CG1 ILE B 79 -8.359 -3.008 -20.425 1.00 26.53 C ATOM 1989 CG2 ILE B 79 -7.133 -1.238 -21.715 1.00 26.72 C ATOM 1990 CD1 ILE B 79 -7.373 -3.020 -19.199 1.00 23.69 C ATOM 1991 H ILE B 79 -9.969 -1.542 -21.907 1.00 0.00 H ATOM 1992 N ASN B 80 -10.183 -4.737 -22.739 1.00 26.90 N ATOM 1993 CA ASN B 80 -10.639 -6.102 -22.984 1.00 27.82 C ATOM 1994 C ASN B 80 -10.909 -6.350 -24.460 1.00 32.14 C ATOM 1995 O ASN B 80 -10.907 -7.508 -24.889 1.00 30.86 O ATOM 1996 CB ASN B 80 -11.904 -6.411 -22.180 1.00 28.63 C ATOM 1997 CG ASN B 80 -13.000 -5.384 -22.388 1.00 29.40 C ATOM 1998 OD1 ASN B 80 -12.752 -4.169 -22.441 1.00 28.60 O ATOM 1999 ND2 ASN B 80 -14.225 -5.864 -22.513 1.00 30.67 N ATOM 2000 HD22 ASN B 80 -14.389 -6.890 -22.462 1.00 0.00 H ATOM 2001 HD21 ASN B 80 -15.025 -5.216 -22.662 1.00 0.00 H ATOM 2002 H ASN B 80 -10.792 -4.077 -22.214 1.00 0.00 H ATOM 2003 N PHE B 81 -11.140 -5.290 -25.239 1.00 29.09 N ATOM 2004 CA PHE B 81 -11.415 -5.483 -26.656 1.00 32.33 C ATOM 2005 C PHE B 81 -10.166 -5.884 -27.421 1.00 30.49 C ATOM 2006 O PHE B 81 -10.283 -6.475 -28.500 1.00 35.97 O ATOM 2007 CB PHE B 81 -12.039 -4.215 -27.270 1.00 30.82 C ATOM 2008 CG PHE B 81 -13.448 -3.924 -26.792 1.00 32.20 C ATOM 2009 CD1 PHE B 81 -14.130 -4.817 -25.984 1.00 34.19 C ATOM 2010 CD2 PHE B 81 -14.080 -2.735 -27.137 1.00 34.36 C ATOM 2011 CE1 PHE B 81 -15.429 -4.526 -25.528 1.00 35.87 C ATOM 2012 CE2 PHE B 81 -15.371 -2.446 -26.703 1.00 36.54 C ATOM 2013 CZ PHE B 81 -16.044 -3.341 -25.888 1.00 35.75 C ATOM 2014 H PHE B 81 -11.124 -4.332 -24.836 1.00 0.00 H ATOM 2015 N ALA B 82 -8.976 -5.595 -26.901 1.00 30.38 N ATOM 2016 CA ALA B 82 -7.745 -5.918 -27.612 1.00 36.61 C ATOM 2017 C ALA B 82 -7.030 -7.146 -27.062 1.00 37.44 C ATOM 2018 O ALA B 82 -5.968 -7.513 -27.584 1.00 34.29 O ATOM 2019 CB ALA B 82 -6.791 -4.722 -27.581 1.00 37.58 C ATOM 2020 H ALA B 82 -8.923 -5.131 -25.972 1.00 0.00 H ATOM 2021 N ARG B 83 -7.579 -7.785 -26.024 1.00 33.50 N ATOM 2022 CA ARG B 83 -6.825 -8.802 -25.291 1.00 36.11 C ATOM 2023 C ARG B 83 -6.437 -9.989 -26.178 1.00 38.45 C ATOM 2024 O ARG B 83 -5.298 -10.478 -26.125 1.00 37.87 O ATOM 2025 CB ARG B 83 -7.648 -9.274 -24.087 1.00 33.22 C ATOM 2026 CG ARG B 83 -6.928 -10.281 -23.217 1.00 32.71 C ATOM 2027 CD ARG B 83 -7.887 -11.011 -22.293 1.00 36.47 C ATOM 2028 NE ARG B 83 -8.670 -12.021 -23.001 1.00 38.49 N ATOM 2029 CZ ARG B 83 -9.620 -12.758 -22.436 1.00 41.71 C ATOM 2030 NH1 ARG B 83 -9.911 -12.602 -21.155 1.00 39.73 N ATOM 2031 NH2 ARG B 83 -10.285 -13.658 -23.150 1.00 44.93 N ATOM 2032 HE ARG B 83 -8.471 -12.173 -24.011 1.00 0.00 H ATOM 2033 HH12 ARG B 83 -10.655 -13.181 -20.717 1.00 0.00 H ATOM 2034 HH11 ARG B 83 -9.395 -11.900 -20.586 1.00 0.00 H ATOM 2035 HH22 ARG B 83 -11.028 -14.232 -22.702 1.00 0.00 H ATOM 2036 HH21 ARG B 83 -10.063 -13.789 -24.158 1.00 0.00 H ATOM 2037 H ARG B 83 -8.552 -7.557 -25.735 1.00 0.00 H ATOM 2038 N ASP B 84 -7.365 -10.466 -26.992 1.00 37.13 N ATOM 2039 CA ASP B 84 -7.169 -11.719 -27.701 1.00 41.62 C ATOM 2040 C ASP B 84 -6.504 -11.535 -29.057 1.00 44.24 C ATOM 2041 O ASP B 84 -6.155 -12.533 -29.695 1.00 50.08 O ATOM 2042 CB ASP B 84 -8.516 -12.439 -27.865 1.00 41.31 C ATOM 2043 CG ASP B 84 -9.023 -13.031 -26.558 1.00 45.82 C ATOM 2044 OD1 ASP B 84 -8.214 -13.139 -25.610 1.00 45.98 O ATOM 2045 OD2 ASP B 84 -10.225 -13.378 -26.470 1.00 44.40 O ATOM 2046 H ASP B 84 -8.249 -9.935 -27.126 1.00 0.00 H ATOM 2047 N GLY B 85 -6.300 -10.300 -29.507 1.00 40.61 N ATOM 2048 CA GLY B 85 -5.760 -10.092 -30.838 1.00 41.52 C ATOM 2049 C GLY B 85 -4.294 -9.722 -30.891 1.00 43.84 C ATOM 2050 O GLY B 85 -3.834 -9.151 -31.887 1.00 48.39 O ATOM 2051 H GLY B 85 -6.528 -9.483 -28.905 1.00 0.00 H ATOM 2052 N MET B 86 -3.536 -10.050 -29.848 1.00 39.15 N ATOM 2053 CA MET B 86 -2.108 -9.746 -29.846 1.00 38.13 C ATOM 2054 C MET B 86 -1.404 -10.685 -28.881 1.00 36.20 C ATOM 2055 O MET B 86 -2.043 -11.430 -28.135 1.00 44.14 O ATOM 2056 CB MET B 86 -1.860 -8.283 -29.465 1.00 32.59 C ATOM 2057 CG MET B 86 -2.516 -7.914 -28.143 1.00 30.78 C ATOM 2058 SD MET B 86 -2.672 -6.122 -27.951 1.00 32.34 S ATOM 2059 CE MET B 86 -0.947 -5.641 -27.986 1.00 32.47 C ATOM 2060 H MET B 86 -3.964 -10.526 -29.028 1.00 0.00 H ATOM 2061 N GLN B 87 -0.073 -10.628 -28.895 1.00 36.39 N ATOM 2062 CA GLN B 87 0.706 -11.414 -27.947 1.00 34.36 C ATOM 2063 C GLN B 87 0.387 -10.964 -26.531 1.00 31.12 C ATOM 2064 O GLN B 87 0.188 -9.771 -26.270 1.00 31.39 O ATOM 2065 CB GLN B 87 2.209 -11.276 -28.216 1.00 34.03 C ATOM 2066 CG GLN B 87 2.667 -11.966 -29.506 1.00 36.99 C ATOM 2067 CD GLN B 87 4.155 -11.818 -29.776 1.00 39.85 C ATOM 2068 OE1 GLN B 87 4.987 -11.846 -28.856 1.00 42.62 O ATOM 2069 NE2 GLN B 87 4.499 -11.648 -31.044 1.00 43.27 N ATOM 2070 HE22 GLN B 87 3.768 -11.631 -31.783 1.00 0.00 H ATOM 2071 HE21 GLN B 87 5.500 -11.532 -31.300 1.00 0.00 H ATOM 2072 H GLN B 87 0.412 -10.020 -29.585 1.00 0.00 H ATOM 2073 N ARG B 88 0.349 -11.927 -25.616 1.00 28.30 N ATOM 2074 CA ARG B 88 -0.090 -11.622 -24.256 1.00 30.82 C ATOM 2075 C ARG B 88 0.877 -10.663 -23.579 1.00 34.81 C ATOM 2076 O ARG B 88 0.447 -9.730 -22.882 1.00 29.84 O ATOM 2077 CB ARG B 88 -0.243 -12.908 -23.442 1.00 32.74 C ATOM 2078 CG ARG B 88 -0.605 -12.653 -21.953 1.00 33.79 C ATOM 2079 CD ARG B 88 -0.234 -13.820 -21.044 1.00 43.16 C ATOM 2080 NE ARG B 88 -1.252 -14.189 -20.065 1.00 42.67 N ATOM 2081 CZ ARG B 88 -1.058 -14.199 -18.746 1.00 49.72 C ATOM 2082 NH1 ARG B 88 0.116 -13.834 -18.236 1.00 54.82 N ATOM 2083 NH2 ARG B 88 -2.035 -14.581 -17.928 1.00 46.86 N ATOM 2084 HE ARG B 88 -2.191 -14.462 -20.420 1.00 0.00 H ATOM 2085 HH12 ARG B 88 0.261 -13.844 -17.206 1.00 0.00 H ATOM 2086 HH11 ARG B 88 0.888 -13.539 -18.867 1.00 0.00 H ATOM 2087 HH22 ARG B 88 -1.880 -14.587 -16.900 1.00 0.00 H ATOM 2088 HH21 ARG B 88 -2.954 -14.873 -18.317 1.00 0.00 H ATOM 2089 H ARG B 88 0.631 -12.896 -25.867 1.00 0.00 H ATOM 2090 N LYS B 89 2.188 -10.855 -23.789 1.00 36.01 N ATOM 2091 CA LYS B 89 3.166 -9.942 -23.202 1.00 38.43 C ATOM 2092 C LYS B 89 3.026 -8.538 -23.778 1.00 35.72 C ATOM 2093 O LYS B 89 3.339 -7.551 -23.096 1.00 32.70 O ATOM 2094 CB LYS B 89 4.592 -10.458 -23.425 1.00 41.22 C ATOM 2095 CG LYS B 89 5.085 -10.336 -24.868 1.00 45.09 C ATOM 2096 CD LYS B 89 6.587 -10.590 -24.990 1.00 49.97 C ATOM 2097 CE LYS B 89 7.078 -10.546 -26.434 1.00 51.39 C ATOM 2098 NZ LYS B 89 7.132 -9.160 -27.016 1.00 51.39 N ATOM 2099 HZ1 LYS B 89 6.180 -8.741 -27.000 1.00 0.00 H ATOM 2100 HZ2 LYS B 89 7.779 -8.573 -26.452 1.00 0.00 H ATOM 2101 HZ3 LYS B 89 7.474 -9.210 -27.997 1.00 0.00 H ATOM 2102 H LYS B 89 2.509 -11.655 -24.371 1.00 0.00 H ATOM 2103 N ASP B 90 2.593 -8.427 -25.036 1.00 35.98 N ATOM 2104 CA ASP B 90 2.425 -7.108 -25.640 1.00 32.76 C ATOM 2105 C ASP B 90 1.170 -6.423 -25.121 1.00 30.74 C ATOM 2106 O ASP B 90 1.175 -5.210 -24.881 1.00 28.41 O ATOM 2107 CB ASP B 90 2.348 -7.211 -27.158 1.00 29.17 C ATOM 2108 CG ASP B 90 3.666 -7.647 -27.796 1.00 31.59 C ATOM 2109 OD1 ASP B 90 4.745 -7.533 -27.170 1.00 33.56 O ATOM 2110 OD2 ASP B 90 3.604 -8.097 -28.942 1.00 34.48 O ATOM 2111 H ASP B 90 2.375 -9.282 -25.587 1.00 0.00 H ATOM 2112 N TRP B 91 0.063 -7.163 -25.019 1.00 29.99 N ATOM 2113 CA TRP B 91 -1.135 -6.588 -24.414 1.00 31.37 C ATOM 2114 C TRP B 91 -0.842 -6.133 -22.994 1.00 31.17 C ATOM 2115 O TRP B 91 -1.217 -5.022 -22.604 1.00 28.87 O ATOM 2116 CB TRP B 91 -2.285 -7.599 -24.446 1.00 31.10 C ATOM 2117 CG TRP B 91 -3.584 -7.104 -23.892 1.00 30.27 C ATOM 2118 CD1 TRP B 91 -4.514 -6.322 -24.518 1.00 29.07 C ATOM 2119 CD2 TRP B 91 -4.106 -7.372 -22.581 1.00 28.66 C ATOM 2120 NE1 TRP B 91 -5.583 -6.083 -23.671 1.00 28.94 N ATOM 2121 CE2 TRP B 91 -5.358 -6.715 -22.480 1.00 29.38 C ATOM 2122 CE3 TRP B 91 -3.646 -8.112 -21.504 1.00 22.80 C ATOM 2123 CZ2 TRP B 91 -6.157 -6.774 -21.320 1.00 27.78 C ATOM 2124 CZ3 TRP B 91 -4.442 -8.158 -20.321 1.00 24.57 C ATOM 2125 CH2 TRP B 91 -5.681 -7.502 -20.261 1.00 27.49 C ATOM 2126 HE1 TRP B 91 -6.422 -5.514 -23.904 1.00 0.00 H ATOM 2127 H TRP B 91 0.054 -8.143 -25.368 1.00 0.00 H ATOM 2128 N LEU B 92 -0.115 -6.948 -22.225 1.00 27.60 N ATOM 2129 CA LEU B 92 0.227 -6.540 -20.865 1.00 26.89 C ATOM 2130 C LEU B 92 1.140 -5.322 -20.876 1.00 30.66 C ATOM 2131 O LEU B 92 0.970 -4.411 -20.062 1.00 25.47 O ATOM 2132 CB LEU B 92 0.871 -7.703 -20.105 1.00 28.22 C ATOM 2133 CG LEU B 92 -0.046 -8.865 -19.722 1.00 28.86 C ATOM 2134 CD1 LEU B 92 0.797 -10.066 -19.230 1.00 30.57 C ATOM 2135 CD2 LEU B 92 -1.088 -8.434 -18.657 1.00 27.00 C ATOM 2136 H LEU B 92 0.205 -7.867 -22.592 1.00 0.00 H ATOM 2137 N SER B 93 2.094 -5.268 -21.823 1.00 27.87 N ATOM 2138 CA SER B 93 2.997 -4.123 -21.900 1.00 28.08 C ATOM 2139 C SER B 93 2.241 -2.833 -22.200 1.00 25.57 C ATOM 2140 O SER B 93 2.580 -1.763 -21.670 1.00 28.80 O ATOM 2141 CB SER B 93 4.056 -4.369 -22.979 1.00 35.60 C ATOM 2142 OG SER B 93 4.948 -5.401 -22.578 1.00 42.92 O ATOM 2143 HG SER B 93 5.624 -5.545 -23.287 1.00 0.00 H ATOM 2144 H SER B 93 2.189 -6.047 -22.505 1.00 0.00 H ATOM 2145 N LEU B 94 1.234 -2.903 -23.074 1.00 24.36 N ATOM 2146 CA LEU B 94 0.472 -1.702 -23.413 1.00 26.43 C ATOM 2147 C LEU B 94 -0.514 -1.333 -22.315 1.00 22.32 C ATOM 2148 O LEU B 94 -0.756 -0.141 -22.092 1.00 20.49 O ATOM 2149 CB LEU B 94 -0.293 -1.883 -24.718 1.00 30.26 C ATOM 2150 CG LEU B 94 0.448 -1.463 -25.986 1.00 35.26 C ATOM 2151 CD1 LEU B 94 -0.449 -1.696 -27.178 1.00 36.64 C ATOM 2152 CD2 LEU B 94 0.814 0.015 -25.888 1.00 34.52 C ATOM 2153 H LEU B 94 0.991 -3.813 -23.514 1.00 0.00 H ATOM 2154 N VAL B 95 -1.098 -2.322 -21.645 1.00 22.77 N ATOM 2155 CA VAL B 95 -1.865 -2.015 -20.431 1.00 23.69 C ATOM 2156 C VAL B 95 -0.971 -1.321 -19.414 1.00 24.66 C ATOM 2157 O VAL B 95 -1.379 -0.335 -18.766 1.00 25.53 O ATOM 2158 CB VAL B 95 -2.519 -3.280 -19.847 1.00 20.82 C ATOM 2159 CG1 VAL B 95 -3.191 -2.960 -18.472 1.00 21.06 C ATOM 2160 CG2 VAL B 95 -3.578 -3.829 -20.794 1.00 25.64 C ATOM 2161 H VAL B 95 -1.012 -3.304 -21.978 1.00 0.00 H ATOM 2162 N ALA B 96 0.275 -1.786 -19.285 1.00 25.54 N ATOM 2163 CA ALA B 96 1.181 -1.180 -18.316 1.00 25.10 C ATOM 2164 C ALA B 96 1.488 0.266 -18.670 1.00 23.45 C ATOM 2165 O ALA B 96 1.476 1.124 -17.787 1.00 24.12 O ATOM 2166 CB ALA B 96 2.485 -1.982 -18.190 1.00 27.93 C ATOM 2167 H ALA B 96 0.598 -2.579 -19.875 1.00 0.00 H ATOM 2168 N VAL B 97 1.762 0.572 -19.957 1.00 24.39 N ATOM 2169 CA VAL B 97 2.121 1.952 -20.295 1.00 25.21 C ATOM 2170 C VAL B 97 0.929 2.882 -20.094 1.00 21.98 C ATOM 2171 O VAL B 97 1.071 3.990 -19.549 1.00 22.39 O ATOM 2172 CB VAL B 97 2.698 2.067 -21.728 1.00 31.13 C ATOM 2173 CG1 VAL B 97 1.815 1.446 -22.735 1.00 32.95 C ATOM 2174 CG2 VAL B 97 2.908 3.564 -22.122 1.00 27.56 C ATOM 2175 H VAL B 97 1.719 -0.159 -20.695 1.00 0.00 H ATOM 2176 N HIS B 98 -0.256 2.478 -20.573 1.00 21.91 N ATOM 2177 CA HIS B 98 -1.445 3.279 -20.318 1.00 22.46 C ATOM 2178 C HIS B 98 -1.705 3.424 -18.824 1.00 22.72 C ATOM 2179 O HIS B 98 -2.171 4.484 -18.383 1.00 20.65 O ATOM 2180 CB HIS B 98 -2.658 2.670 -21.032 1.00 21.66 C ATOM 2181 CG HIS B 98 -2.671 2.939 -22.514 1.00 23.60 C ATOM 2182 ND1 HIS B 98 -3.140 4.120 -23.044 1.00 24.63 N ATOM 2183 CD2 HIS B 98 -2.255 2.191 -23.564 1.00 27.33 C ATOM 2184 CE1 HIS B 98 -3.017 4.089 -24.361 1.00 29.30 C ATOM 2185 NE2 HIS B 98 -2.483 2.929 -24.704 1.00 29.29 N ATOM 2186 H HIS B 98 -0.326 1.598 -21.123 1.00 0.00 H ATOM 2187 N SER B 99 -1.413 2.386 -18.038 1.00 20.74 N ATOM 2188 CA SER B 99 -1.621 2.480 -16.589 1.00 20.73 C ATOM 2189 C SER B 99 -0.607 3.428 -15.940 1.00 22.95 C ATOM 2190 O SER B 99 -0.962 4.199 -15.034 1.00 23.94 O ATOM 2191 CB SER B 99 -1.554 1.085 -15.956 1.00 22.81 C ATOM 2192 OG SER B 99 -2.600 0.274 -16.466 1.00 22.59 O ATOM 2193 HG SER B 99 -2.504 0.193 -17.448 1.00 0.00 H ATOM 2194 H SER B 99 -1.038 1.509 -18.453 1.00 0.00 H ATOM 2195 N ASP B 100 0.656 3.394 -16.401 1.00 20.64 N ATOM 2196 CA ASP B 100 1.663 4.369 -15.974 1.00 22.15 C ATOM 2197 C ASP B 100 1.207 5.796 -16.259 1.00 23.44 C ATOM 2198 O ASP B 100 1.414 6.700 -15.437 1.00 24.47 O ATOM 2199 CB ASP B 100 3.006 4.134 -16.706 1.00 22.88 C ATOM 2200 CG ASP B 100 3.761 2.916 -16.175 1.00 28.46 C ATOM 2201 OD1 ASP B 100 3.683 2.685 -14.948 1.00 29.01 O ATOM 2202 OD2 ASP B 100 4.439 2.211 -16.971 1.00 25.60 O ATOM 2203 H ASP B 100 0.926 2.654 -17.080 1.00 0.00 H ATOM 2204 N CYS B 101 0.655 6.022 -17.455 1.00 23.88 N ATOM 2205 CA CYS B 101 0.193 7.350 -17.840 1.00 21.72 C ATOM 2206 C CYS B 101 -0.952 7.776 -16.952 1.00 21.32 C ATOM 2207 O CYS B 101 -1.088 8.958 -16.618 1.00 21.57 O ATOM 2208 CB CYS B 101 -0.284 7.345 -19.288 1.00 20.57 C ATOM 2209 SG CYS B 101 1.092 7.064 -20.458 1.00 28.54 S ATOM 2210 H CYS B 101 0.553 5.234 -18.125 1.00 0.00 H ATOM 2211 N TRP B 102 -1.837 6.833 -16.650 1.00 21.89 N ATOM 2212 CA TRP B 102 -2.992 7.158 -15.813 1.00 21.75 C ATOM 2213 C TRP B 102 -2.546 7.557 -14.415 1.00 22.11 C ATOM 2214 O TRP B 102 -3.047 8.542 -13.854 1.00 24.93 O ATOM 2215 CB TRP B 102 -3.947 5.979 -15.747 1.00 21.56 C ATOM 2216 CG TRP B 102 -5.108 6.242 -14.829 1.00 20.11 C ATOM 2217 CD1 TRP B 102 -6.147 7.093 -15.047 1.00 21.95 C ATOM 2218 CD2 TRP B 102 -5.342 5.628 -13.550 1.00 21.32 C ATOM 2219 NE1 TRP B 102 -7.029 7.054 -13.973 1.00 20.79 N ATOM 2220 CE2 TRP B 102 -6.541 6.168 -13.041 1.00 22.16 C ATOM 2221 CE3 TRP B 102 -4.627 4.702 -12.773 1.00 19.42 C ATOM 2222 CZ2 TRP B 102 -7.070 5.788 -11.798 1.00 23.60 C ATOM 2223 CZ3 TRP B 102 -5.162 4.324 -11.526 1.00 23.12 C ATOM 2224 CH2 TRP B 102 -6.375 4.868 -11.066 1.00 23.79 C ATOM 2225 HE1 TRP B 102 -7.909 7.602 -13.889 1.00 0.00 H ATOM 2226 H TRP B 102 -1.709 5.865 -17.008 1.00 0.00 H ATOM 2227 N LEU B 103 -1.578 6.820 -13.848 1.00 20.84 N ATOM 2228 CA LEU B 103 -1.045 7.174 -12.528 1.00 23.59 C ATOM 2229 C LEU B 103 -0.514 8.600 -12.523 1.00 23.67 C ATOM 2230 O LEU B 103 -0.817 9.385 -11.620 1.00 22.93 O ATOM 2231 CB LEU B 103 0.061 6.189 -12.113 1.00 21.17 C ATOM 2232 CG LEU B 103 -0.344 4.750 -11.748 1.00 21.02 C ATOM 2233 CD1 LEU B 103 0.912 3.876 -11.594 1.00 24.65 C ATOM 2234 CD2 LEU B 103 -1.180 4.744 -10.430 1.00 21.93 C ATOM 2235 H LEU B 103 -1.202 5.990 -14.349 1.00 0.00 H ATOM 2236 N LEU B 104 0.317 8.935 -13.516 1.00 23.70 N ATOM 2237 CA LEU B 104 0.880 10.274 -13.630 1.00 24.25 C ATOM 2238 C LEU B 104 -0.211 11.326 -13.781 1.00 22.73 C ATOM 2239 O LEU B 104 -0.130 12.413 -13.201 1.00 26.47 O ATOM 2240 CB LEU B 104 1.825 10.322 -14.840 1.00 24.98 C ATOM 2241 CG LEU B 104 2.843 11.449 -14.917 1.00 28.88 C ATOM 2242 CD1 LEU B 104 3.798 11.316 -13.757 1.00 29.98 C ATOM 2243 CD2 LEU B 104 3.617 11.385 -16.276 1.00 31.58 C ATOM 2244 H LEU B 104 0.569 8.219 -14.227 1.00 0.00 H ATOM 2245 N SER B 105 -1.225 11.039 -14.592 1.00 20.25 N ATOM 2246 CA SER B 105 -2.322 11.982 -14.756 1.00 19.55 C ATOM 2247 C SER B 105 -3.040 12.214 -13.426 1.00 19.10 C ATOM 2248 O SER B 105 -3.340 13.361 -13.057 1.00 22.72 O ATOM 2249 CB SER B 105 -3.288 11.465 -15.828 1.00 22.68 C ATOM 2250 OG SER B 105 -4.275 12.431 -16.143 1.00 24.12 O ATOM 2251 HG SER B 105 -4.881 12.068 -16.836 1.00 0.00 H ATOM 2252 H SER B 105 -1.234 10.138 -15.111 1.00 0.00 H ATOM 2253 N VAL B 106 -3.346 11.145 -12.714 1.00 16.31 N ATOM 2254 CA VAL B 106 -4.042 11.287 -11.423 1.00 22.39 C ATOM 2255 C VAL B 106 -3.223 12.156 -10.464 1.00 22.88 C ATOM 2256 O VAL B 106 -3.749 13.088 -9.830 1.00 23.31 O ATOM 2257 CB VAL B 106 -4.331 9.898 -10.824 1.00 21.24 C ATOM 2258 CG1 VAL B 106 -4.922 10.004 -9.406 1.00 20.79 C ATOM 2259 CG2 VAL B 106 -5.325 9.143 -11.729 1.00 24.78 C ATOM 2260 H VAL B 106 -3.095 10.199 -13.066 1.00 0.00 H ATOM 2261 N SER B 107 -1.915 11.891 -10.376 1.00 22.92 N ATOM 2262 CA SER B 107 -1.082 12.610 -9.414 1.00 25.17 C ATOM 2263 C SER B 107 -0.998 14.095 -9.744 1.00 21.50 C ATOM 2264 O SER B 107 -1.079 14.940 -8.844 1.00 22.87 O ATOM 2265 CB SER B 107 0.318 12.006 -9.370 1.00 24.40 C ATOM 2266 OG SER B 107 0.274 10.698 -8.827 1.00 27.94 O ATOM 2267 HG SER B 107 -0.307 10.127 -9.390 1.00 0.00 H ATOM 2268 H SER B 107 -1.489 11.171 -10.994 1.00 0.00 H ATOM 2269 N PHE B 108 -0.804 14.440 -11.028 1.00 20.88 N ATOM 2270 CA PHE B 108 -0.721 15.856 -11.376 1.00 22.23 C ATOM 2271 C PHE B 108 -2.091 16.519 -11.529 1.00 24.25 C ATOM 2272 O PHE B 108 -2.162 17.752 -11.561 1.00 26.74 O ATOM 2273 CB PHE B 108 0.181 16.026 -12.618 1.00 25.69 C ATOM 2274 CG PHE B 108 1.627 15.866 -12.260 1.00 23.80 C ATOM 2275 CD1 PHE B 108 2.356 16.940 -11.800 1.00 27.70 C ATOM 2276 CD2 PHE B 108 2.204 14.604 -12.229 1.00 23.23 C ATOM 2277 CE1 PHE B 108 3.668 16.783 -11.402 1.00 31.23 C ATOM 2278 CE2 PHE B 108 3.512 14.436 -11.805 1.00 29.93 C ATOM 2279 CZ PHE B 108 4.243 15.533 -11.398 1.00 32.23 C ATOM 2280 H PHE B 108 -0.714 13.710 -11.763 1.00 0.00 H ATOM 2281 N TYR B 109 -3.174 15.739 -11.550 1.00 24.26 N ATOM 2282 CA TYR B 109 -4.498 16.285 -11.279 1.00 24.77 C ATOM 2283 C TYR B 109 -4.603 16.768 -9.829 1.00 24.79 C ATOM 2284 O TYR B 109 -4.992 17.919 -9.571 1.00 21.98 O ATOM 2285 CB TYR B 109 -5.568 15.238 -11.571 1.00 24.29 C ATOM 2286 CG TYR B 109 -6.942 15.705 -11.144 1.00 27.47 C ATOM 2287 CD1 TYR B 109 -7.650 16.632 -11.895 1.00 32.02 C ATOM 2288 CD2 TYR B 109 -7.516 15.235 -9.973 1.00 30.68 C ATOM 2289 CE1 TYR B 109 -8.901 17.073 -11.483 1.00 34.88 C ATOM 2290 CE2 TYR B 109 -8.754 15.669 -9.559 1.00 33.71 C ATOM 2291 CZ TYR B 109 -9.442 16.583 -10.312 1.00 38.68 C ATOM 2292 OH TYR B 109 -10.684 16.998 -9.875 1.00 39.93 O ATOM 2293 HH TYR B 109 -11.056 17.654 -10.517 1.00 0.00 H ATOM 2294 H TYR B 109 -3.072 14.726 -11.763 1.00 0.00 H ATOM 2295 N PHE B 110 -4.250 15.900 -8.869 1.00 25.36 N ATOM 2296 CA PHE B 110 -4.206 16.317 -7.467 1.00 28.62 C ATOM 2297 C PHE B 110 -3.203 17.440 -7.267 1.00 28.47 C ATOM 2298 O PHE B 110 -3.402 18.310 -6.408 1.00 26.10 O ATOM 2299 CB PHE B 110 -3.827 15.141 -6.553 1.00 26.70 C ATOM 2300 CG PHE B 110 -4.876 14.060 -6.448 1.00 25.10 C ATOM 2301 CD1 PHE B 110 -6.219 14.364 -6.354 1.00 28.23 C ATOM 2302 CD2 PHE B 110 -4.492 12.718 -6.433 1.00 24.83 C ATOM 2303 CE1 PHE B 110 -7.170 13.357 -6.248 1.00 29.51 C ATOM 2304 CE2 PHE B 110 -5.427 11.707 -6.310 1.00 23.04 C ATOM 2305 CZ PHE B 110 -6.769 12.020 -6.225 1.00 26.52 C ATOM 2306 H PHE B 110 -4.005 14.922 -9.123 1.00 0.00 H ATOM 2307 N GLY B 111 -2.116 17.430 -8.039 1.00 24.31 N ATOM 2308 CA GLY B 111 -1.076 18.427 -7.899 1.00 26.17 C ATOM 2309 C GLY B 111 -1.250 19.694 -8.715 1.00 24.95 C ATOM 2310 O GLY B 111 -0.291 20.456 -8.865 1.00 28.32 O ATOM 2311 H GLY B 111 -2.013 16.687 -8.760 1.00 0.00 H ATOM 2312 N ALA B 112 -2.458 19.940 -9.232 1.00 23.57 N ATOM 2313 CA ALA B 112 -2.707 21.121 -10.058 1.00 25.79 C ATOM 2314 C ALA B 112 -2.292 22.414 -9.359 1.00 26.91 C ATOM 2315 O ALA B 112 -1.812 23.349 -10.009 1.00 30.05 O ATOM 2316 CB ALA B 112 -4.193 21.183 -10.444 1.00 26.92 C ATOM 2317 H ALA B 112 -3.237 19.278 -9.043 1.00 0.00 H ATOM 2318 N ARG B 113 -2.469 22.487 -8.039 1.00 26.42 N ATOM 2319 CA ARG B 113 -2.204 23.713 -7.287 1.00 23.28 C ATOM 2320 C ARG B 113 -0.768 23.799 -6.790 1.00 27.96 C ATOM 2321 O ARG B 113 -0.398 24.798 -6.167 1.00 31.65 O ATOM 2322 CB ARG B 113 -3.177 23.806 -6.103 1.00 30.22 C ATOM 2323 CG ARG B 113 -4.606 23.972 -6.610 1.00 33.74 C ATOM 2324 CD ARG B 113 -5.609 24.264 -5.514 1.00 42.61 C ATOM 2325 NE ARG B 113 -6.694 25.046 -6.084 1.00 51.93 N ATOM 2326 CZ ARG B 113 -7.596 24.562 -6.935 1.00 57.45 C ATOM 2327 NH1 ARG B 113 -7.560 23.280 -7.292 1.00 60.77 N ATOM 2328 NH2 ARG B 113 -8.549 25.357 -7.415 1.00 53.96 N ATOM 2329 HE ARG B 113 -6.770 26.046 -5.810 1.00 0.00 H ATOM 2330 HH12 ARG B 113 -8.266 22.905 -7.957 1.00 0.00 H ATOM 2331 HH11 ARG B 113 -6.826 22.653 -6.906 1.00 0.00 H ATOM 2332 HH22 ARG B 113 -9.254 24.980 -8.080 1.00 0.00 H ATOM 2333 HH21 ARG B 113 -8.588 26.355 -7.125 1.00 0.00 H ATOM 2334 H ARG B 113 -2.806 21.646 -7.529 1.00 0.00 H ATOM 2335 N LEU B 114 0.043 22.779 -7.041 1.00 26.38 N ATOM 2336 CA LEU B 114 1.460 22.850 -6.679 1.00 26.36 C ATOM 2337 C LEU B 114 2.185 23.848 -7.566 1.00 29.57 C ATOM 2338 O LEU B 114 1.844 24.027 -8.737 1.00 30.44 O ATOM 2339 CB LEU B 114 2.134 21.485 -6.837 1.00 24.32 C ATOM 2340 CG LEU B 114 1.620 20.436 -5.861 1.00 28.60 C ATOM 2341 CD1 LEU B 114 2.215 19.101 -6.256 1.00 29.49 C ATOM 2342 CD2 LEU B 114 1.983 20.818 -4.455 1.00 29.35 C ATOM 2343 H LEU B 114 -0.331 21.923 -7.498 1.00 0.00 H ATOM 2344 N ASN B 115 3.212 24.490 -7.012 1.00 30.99 N ATOM 2345 CA ASN B 115 4.001 25.381 -7.842 1.00 29.61 C ATOM 2346 C ASN B 115 5.063 24.577 -8.580 1.00 29.46 C ATOM 2347 O ASN B 115 5.158 23.349 -8.466 1.00 26.40 O ATOM 2348 CB ASN B 115 4.592 26.526 -7.013 1.00 33.61 C ATOM 2349 CG ASN B 115 5.624 26.065 -5.977 1.00 37.72 C ATOM 2350 OD1 ASN B 115 6.337 25.077 -6.160 1.00 37.31 O ATOM 2351 ND2 ASN B 115 5.721 26.815 -4.892 1.00 40.03 N ATOM 2352 HD22 ASN B 115 5.101 27.642 -4.774 1.00 0.00 H ATOM 2353 HD21 ASN B 115 6.417 26.578 -4.157 1.00 0.00 H ATOM 2354 H ASN B 115 3.443 24.356 -6.007 1.00 0.00 H ATOM 2355 N ARG B 116 5.876 25.291 -9.353 1.00 34.30 N ATOM 2356 CA ARG B 116 6.821 24.646 -10.256 1.00 34.67 C ATOM 2357 C ARG B 116 7.887 23.852 -9.501 1.00 34.65 C ATOM 2358 O ARG B 116 8.278 22.758 -9.933 1.00 33.36 O ATOM 2359 CB ARG B 116 7.469 25.709 -11.141 1.00 37.59 C ATOM 2360 CG ARG B 116 8.565 25.187 -12.040 1.00 40.37 C ATOM 2361 CD ARG B 116 9.183 26.337 -12.816 1.00 47.49 C ATOM 2362 NE ARG B 116 10.510 26.080 -13.392 1.00 57.01 N ATOM 2363 CZ ARG B 116 11.539 25.469 -12.794 1.00 62.41 C ATOM 2364 NH1 ARG B 116 11.472 25.031 -11.537 1.00 62.81 N ATOM 2365 NH2 ARG B 116 12.674 25.319 -13.464 1.00 63.02 N ATOM 2366 HE ARG B 116 10.666 26.407 -14.367 1.00 0.00 H ATOM 2367 HH12 ARG B 116 12.293 24.560 -11.106 1.00 0.00 H ATOM 2368 HH11 ARG B 116 10.599 25.160 -10.987 1.00 0.00 H ATOM 2369 HH22 ARG B 116 13.484 24.846 -13.015 1.00 0.00 H ATOM 2370 HH21 ARG B 116 12.754 25.674 -14.438 1.00 0.00 H ATOM 2371 H ARG B 116 5.837 26.329 -9.312 1.00 0.00 H ATOM 2372 N ASN B 117 8.385 24.387 -8.384 1.00 32.89 N ATOM 2373 CA ASN B 117 9.359 23.632 -7.596 1.00 33.75 C ATOM 2374 C ASN B 117 8.723 22.403 -6.953 1.00 31.53 C ATOM 2375 O ASN B 117 9.348 21.332 -6.885 1.00 30.67 O ATOM 2376 CB ASN B 117 9.975 24.512 -6.511 1.00 42.37 C ATOM 2377 CG ASN B 117 10.886 23.724 -5.595 1.00 50.59 C ATOM 2378 OD1 ASN B 117 10.581 23.509 -4.414 1.00 54.10 O ATOM 2379 ND2 ASN B 117 11.997 23.251 -6.146 1.00 51.61 N ATOM 2380 HD22 ASN B 117 12.212 23.457 -7.142 1.00 0.00 H ATOM 2381 HD21 ASN B 117 12.653 22.674 -5.581 1.00 0.00 H ATOM 2382 H ASN B 117 8.083 25.333 -8.076 1.00 0.00 H ATOM 2383 N GLU B 118 7.494 22.551 -6.447 1.00 29.67 N ATOM 2384 CA GLU B 118 6.789 21.425 -5.846 1.00 31.92 C ATOM 2385 C GLU B 118 6.496 20.338 -6.878 1.00 32.23 C ATOM 2386 O GLU B 118 6.571 19.141 -6.566 1.00 27.21 O ATOM 2387 CB GLU B 118 5.497 21.913 -5.185 1.00 31.13 C ATOM 2388 CG GLU B 118 5.722 22.688 -3.879 1.00 36.80 C ATOM 2389 CD GLU B 118 4.472 23.406 -3.373 1.00 38.15 C ATOM 2390 OE1 GLU B 118 3.658 23.855 -4.208 1.00 36.43 O ATOM 2391 OE2 GLU B 118 4.308 23.536 -2.136 1.00 40.34 O ATOM 2392 H GLU B 118 7.034 23.483 -6.483 1.00 0.00 H ATOM 2393 N ARG B 119 6.145 20.733 -8.112 1.00 29.26 N ATOM 2394 CA ARG B 119 5.877 19.740 -9.151 1.00 28.63 C ATOM 2395 C ARG B 119 7.133 18.946 -9.498 1.00 28.43 C ATOM 2396 O ARG B 119 7.080 17.716 -9.663 1.00 26.77 O ATOM 2397 CB ARG B 119 5.287 20.431 -10.387 1.00 31.44 C ATOM 2398 CG ARG B 119 3.823 20.839 -10.166 1.00 35.69 C ATOM 2399 CD ARG B 119 3.285 21.755 -11.265 1.00 43.79 C ATOM 2400 NE ARG B 119 2.998 21.041 -12.513 1.00 48.53 N ATOM 2401 CZ ARG B 119 1.866 20.391 -12.784 1.00 48.34 C ATOM 2402 NH1 ARG B 119 0.882 20.349 -11.893 1.00 47.64 N ATOM 2403 NH2 ARG B 119 1.718 19.783 -13.960 1.00 48.24 N ATOM 2404 HE ARG B 119 3.736 21.042 -13.245 1.00 0.00 H ATOM 2405 HH12 ARG B 119 0.002 19.840 -12.113 1.00 0.00 H ATOM 2406 HH11 ARG B 119 0.991 20.826 -10.975 1.00 0.00 H ATOM 2407 HH22 ARG B 119 0.837 19.275 -14.175 1.00 0.00 H ATOM 2408 HH21 ARG B 119 2.484 19.816 -14.663 1.00 0.00 H ATOM 2409 H ARG B 119 6.064 21.747 -8.329 1.00 0.00 H ATOM 2410 N LYS B 120 8.273 19.629 -9.600 1.00 25.20 N ATOM 2411 CA LYS B 120 9.548 18.934 -9.790 1.00 29.69 C ATOM 2412 C LYS B 120 9.807 17.943 -8.661 1.00 26.76 C ATOM 2413 O LYS B 120 10.211 16.797 -8.912 1.00 28.34 O ATOM 2414 CB LYS B 120 10.678 19.958 -9.900 1.00 31.40 C ATOM 2415 CG LYS B 120 11.886 19.478 -10.699 1.00 42.28 C ATOM 2416 CD LYS B 120 13.093 20.385 -10.497 1.00 49.20 C ATOM 2417 CE LYS B 120 14.395 19.699 -10.921 1.00 53.13 C ATOM 2418 NZ LYS B 120 14.654 18.449 -10.145 1.00 55.30 N ATOM 2419 HZ1 LYS B 120 14.724 18.679 -9.133 1.00 0.00 H ATOM 2420 HZ2 LYS B 120 13.872 17.780 -10.296 1.00 0.00 H ATOM 2421 HZ3 LYS B 120 15.545 18.021 -10.467 1.00 0.00 H ATOM 2422 H LYS B 120 8.257 20.667 -9.544 1.00 0.00 H ATOM 2423 N ARG B 121 9.523 18.352 -7.416 1.00 23.98 N ATOM 2424 CA ARG B 121 9.735 17.476 -6.269 1.00 25.14 C ATOM 2425 C ARG B 121 8.869 16.229 -6.344 1.00 28.62 C ATOM 2426 O ARG B 121 9.342 15.115 -6.076 1.00 29.35 O ATOM 2427 CB ARG B 121 9.443 18.227 -4.976 1.00 28.89 C ATOM 2428 CG ARG B 121 10.553 19.151 -4.533 1.00 31.60 C ATOM 2429 CD ARG B 121 10.328 19.440 -3.064 1.00 39.41 C ATOM 2430 NE ARG B 121 9.748 20.744 -2.876 1.00 45.41 N ATOM 2431 CZ ARG B 121 8.771 21.019 -2.030 1.00 43.40 C ATOM 2432 NH1 ARG B 121 8.235 20.068 -1.267 1.00 42.77 N ATOM 2433 NH2 ARG B 121 8.338 22.264 -1.958 1.00 45.31 N ATOM 2434 HE ARG B 121 10.125 21.527 -3.448 1.00 0.00 H ATOM 2435 HH12 ARG B 121 7.467 20.303 -0.607 1.00 0.00 H ATOM 2436 HH11 ARG B 121 8.585 19.091 -1.332 1.00 0.00 H ATOM 2437 HH22 ARG B 121 7.570 22.510 -1.301 1.00 0.00 H ATOM 2438 HH21 ARG B 121 8.765 22.998 -2.558 1.00 0.00 H ATOM 2439 H ARG B 121 9.145 19.309 -7.266 1.00 0.00 H ATOM 2440 N LEU B 122 7.588 16.401 -6.691 1.00 27.97 N ATOM 2441 CA LEU B 122 6.701 15.259 -6.855 1.00 26.95 C ATOM 2442 C LEU B 122 7.192 14.330 -7.962 1.00 25.11 C ATOM 2443 O LEU B 122 7.231 13.099 -7.793 1.00 24.97 O ATOM 2444 CB LEU B 122 5.282 15.758 -7.142 1.00 23.70 C ATOM 2445 CG LEU B 122 4.225 14.695 -7.437 1.00 26.64 C ATOM 2446 CD1 LEU B 122 4.017 13.752 -6.258 1.00 23.67 C ATOM 2447 CD2 LEU B 122 2.891 15.371 -7.838 1.00 26.08 C ATOM 2448 H LEU B 122 7.222 17.362 -6.845 1.00 0.00 H ATOM 2449 N PHE B 123 7.541 14.884 -9.117 1.00 22.37 N ATOM 2450 CA PHE B 123 7.995 13.992 -10.181 1.00 21.80 C ATOM 2451 C PHE B 123 9.250 13.227 -9.762 1.00 25.29 C ATOM 2452 O PHE B 123 9.389 12.031 -10.063 1.00 26.85 O ATOM 2453 CB PHE B 123 8.250 14.743 -11.481 1.00 23.54 C ATOM 2454 CG PHE B 123 8.482 13.806 -12.638 1.00 29.21 C ATOM 2455 CD1 PHE B 123 7.402 13.284 -13.356 1.00 30.95 C ATOM 2456 CD2 PHE B 123 9.760 13.369 -12.943 1.00 27.35 C ATOM 2457 CE1 PHE B 123 7.616 12.375 -14.389 1.00 30.30 C ATOM 2458 CE2 PHE B 123 9.993 12.466 -13.975 1.00 23.52 C ATOM 2459 CZ PHE B 123 8.928 11.976 -14.703 1.00 25.49 C ATOM 2460 H PHE B 123 7.493 15.913 -9.259 1.00 0.00 H ATOM 2461 N SER B 124 10.169 13.884 -9.046 1.00 29.49 N ATOM 2462 CA SER B 124 11.390 13.176 -8.672 1.00 30.78 C ATOM 2463 C SER B 124 11.065 11.976 -7.785 1.00 26.50 C ATOM 2464 O SER B 124 11.654 10.901 -7.942 1.00 29.07 O ATOM 2465 CB SER B 124 12.377 14.128 -7.991 1.00 40.28 C ATOM 2466 OG SER B 124 12.094 14.281 -6.613 1.00 49.63 O ATOM 2467 HG SER B 124 11.181 14.648 -6.504 1.00 0.00 H ATOM 2468 H SER B 124 10.018 14.873 -8.763 1.00 0.00 H ATOM 2469 N LEU B 125 10.067 12.119 -6.897 1.00 27.58 N ATOM 2470 CA LEU B 125 9.631 10.997 -6.069 1.00 25.99 C ATOM 2471 C LEU B 125 9.028 9.878 -6.907 1.00 27.62 C ATOM 2472 O LEU B 125 9.362 8.704 -6.723 1.00 31.57 O ATOM 2473 CB LEU B 125 8.637 11.479 -5.019 1.00 25.79 C ATOM 2474 CG LEU B 125 9.214 12.447 -3.986 1.00 26.12 C ATOM 2475 CD1 LEU B 125 8.079 12.871 -3.042 1.00 26.45 C ATOM 2476 CD2 LEU B 125 10.355 11.810 -3.204 1.00 26.48 C ATOM 2477 H LEU B 125 9.598 13.042 -6.798 1.00 0.00 H ATOM 2478 N ILE B 126 8.094 10.222 -7.799 1.00 28.39 N ATOM 2479 CA ILE B 126 7.515 9.240 -8.712 1.00 27.40 C ATOM 2480 C ILE B 126 8.602 8.587 -9.542 1.00 30.03 C ATOM 2481 O ILE B 126 8.596 7.368 -9.775 1.00 27.42 O ATOM 2482 CB ILE B 126 6.468 9.939 -9.597 1.00 22.88 C ATOM 2483 CG1 ILE B 126 5.231 10.277 -8.766 1.00 24.37 C ATOM 2484 CG2 ILE B 126 6.134 9.118 -10.837 1.00 26.09 C ATOM 2485 CD1 ILE B 126 4.257 11.181 -9.509 1.00 23.89 C ATOM 2486 H ILE B 126 7.773 11.210 -7.844 1.00 0.00 H ATOM 2487 N ASN B 127 9.577 9.379 -9.960 1.00 24.19 N ATOM 2488 CA ASN B 127 10.640 8.848 -10.791 1.00 28.98 C ATOM 2489 C ASN B 127 11.634 7.991 -10.002 1.00 31.51 C ATOM 2490 O ASN B 127 12.520 7.393 -10.614 1.00 32.36 O ATOM 2491 CB ASN B 127 11.341 10.014 -11.496 1.00 30.59 C ATOM 2492 CG ASN B 127 12.031 9.590 -12.762 1.00 31.53 C ATOM 2493 OD1 ASN B 127 11.553 8.718 -13.480 1.00 36.93 O ATOM 2494 ND2 ASN B 127 13.188 10.162 -13.009 1.00 30.35 N ATOM 2495 HD22 ASN B 127 13.552 10.897 -12.370 1.00 0.00 H ATOM 2496 HD21 ASN B 127 13.740 9.879 -13.844 1.00 0.00 H ATOM 2497 H ASN B 127 9.581 10.384 -9.692 1.00 0.00 H ATOM 2498 N ASP B 128 11.492 7.900 -8.670 1.00 33.00 N ATOM 2499 CA ASP B 128 12.272 6.988 -7.833 1.00 39.73 C ATOM 2500 C ASP B 128 11.764 5.550 -7.885 1.00 40.17 C ATOM 2501 O ASP B 128 12.441 4.652 -7.374 1.00 41.37 O ATOM 2502 CB ASP B 128 12.247 7.438 -6.358 1.00 40.62 C ATOM 2503 CG ASP B 128 13.094 8.670 -6.090 1.00 39.21 C ATOM 2504 OD1 ASP B 128 14.023 8.946 -6.868 1.00 40.59 O ATOM 2505 OD2 ASP B 128 12.829 9.355 -5.076 1.00 39.13 O ATOM 2506 H ASP B 128 10.789 8.511 -8.208 1.00 0.00 H ATOM 2507 N LEU B 129 10.560 5.315 -8.427 1.00 33.78 N ATOM 2508 CA LEU B 129 10.058 3.956 -8.533 1.00 35.15 C ATOM 2509 C LEU B 129 10.118 3.503 -9.986 1.00 32.73 C ATOM 2510 O LEU B 129 9.936 4.329 -10.882 1.00 34.24 O ATOM 2511 CB LEU B 129 8.612 3.874 -8.030 1.00 35.71 C ATOM 2512 CG LEU B 129 8.401 4.367 -6.598 1.00 41.42 C ATOM 2513 CD1 LEU B 129 6.926 4.324 -6.217 1.00 39.59 C ATOM 2514 CD2 LEU B 129 9.224 3.546 -5.631 1.00 46.18 C ATOM 2515 H LEU B 129 9.984 6.109 -8.773 1.00 0.00 H ATOM 2516 N PRO B 130 10.401 2.227 -10.259 1.00 31.17 N ATOM 2517 CA PRO B 130 10.354 1.746 -11.647 1.00 32.86 C ATOM 2518 C PRO B 130 8.925 1.837 -12.167 1.00 30.88 C ATOM 2519 O PRO B 130 7.968 1.714 -11.401 1.00 31.80 O ATOM 2520 CB PRO B 130 10.813 0.284 -11.543 1.00 36.04 C ATOM 2521 CG PRO B 130 11.270 0.097 -10.101 1.00 38.26 C ATOM 2522 CD PRO B 130 10.558 1.123 -9.296 1.00 35.26 C ATOM 2523 N THR B 131 8.779 2.060 -13.476 1.00 30.00 N ATOM 2524 CA THR B 131 7.423 2.105 -14.032 1.00 28.58 C ATOM 2525 C THR B 131 6.835 0.704 -14.196 1.00 26.63 C ATOM 2526 O THR B 131 7.547 -0.305 -14.225 1.00 27.34 O ATOM 2527 CB THR B 131 7.392 2.816 -15.382 1.00 31.58 C ATOM 2528 OG1 THR B 131 8.205 2.104 -16.329 1.00 28.78 O ATOM 2529 CG2 THR B 131 7.872 4.254 -15.237 1.00 31.15 C ATOM 2530 HG1 THR B 131 8.179 2.571 -17.201 1.00 0.00 H ATOM 2531 H THR B 131 9.609 2.199 -14.087 1.00 0.00 H ATOM 2532 N LEU B 132 5.500 0.651 -14.312 1.00 25.38 N ATOM 2533 CA LEU B 132 4.844 -0.622 -14.597 1.00 28.13 C ATOM 2534 C LEU B 132 5.364 -1.219 -15.895 1.00 26.15 C ATOM 2535 O LEU B 132 5.573 -2.437 -15.999 1.00 31.43 O ATOM 2536 CB LEU B 132 3.322 -0.431 -14.661 1.00 25.82 C ATOM 2537 CG LEU B 132 2.643 0.107 -13.400 1.00 26.36 C ATOM 2538 CD1 LEU B 132 1.170 0.493 -13.700 1.00 28.41 C ATOM 2539 CD2 LEU B 132 2.717 -0.934 -12.286 1.00 31.97 C ATOM 2540 H LEU B 132 4.933 1.515 -14.199 1.00 0.00 H ATOM 2541 N PHE B 133 5.613 -0.375 -16.884 1.00 25.69 N ATOM 2542 CA PHE B 133 6.131 -0.857 -18.164 1.00 29.15 C ATOM 2543 C PHE B 133 7.502 -1.499 -17.991 1.00 32.26 C ATOM 2544 O PHE B 133 7.763 -2.583 -18.526 1.00 31.48 O ATOM 2545 CB PHE B 133 6.178 0.312 -19.144 1.00 30.67 C ATOM 2546 CG PHE B 133 6.695 -0.027 -20.503 1.00 31.41 C ATOM 2547 CD1 PHE B 133 5.874 -0.622 -21.451 1.00 32.12 C ATOM 2548 CD2 PHE B 133 7.990 0.304 -20.852 1.00 32.45 C ATOM 2549 CE1 PHE B 133 6.344 -0.900 -22.726 1.00 40.09 C ATOM 2550 CE2 PHE B 133 8.469 0.024 -22.137 1.00 37.20 C ATOM 2551 CZ PHE B 133 7.639 -0.576 -23.067 1.00 36.26 C ATOM 2552 H PHE B 133 5.438 0.641 -16.749 1.00 0.00 H ATOM 2553 N ASP B 134 8.374 -0.876 -17.198 1.00 35.36 N ATOM 2554 CA ASP B 134 9.713 -1.432 -17.021 1.00 35.33 C ATOM 2555 C ASP B 134 9.679 -2.768 -16.281 1.00 34.31 C ATOM 2556 O ASP B 134 10.428 -3.694 -16.622 1.00 36.14 O ATOM 2557 CB ASP B 134 10.595 -0.426 -16.294 1.00 38.65 C ATOM 2558 CG ASP B 134 11.041 0.698 -17.204 1.00 42.00 C ATOM 2559 OD1 ASP B 134 10.748 0.623 -18.420 1.00 45.12 O ATOM 2560 OD2 ASP B 134 11.688 1.638 -16.711 1.00 46.18 O ATOM 2561 H ASP B 134 8.103 0.000 -16.708 1.00 0.00 H ATOM 2562 N VAL B 135 8.819 -2.897 -15.273 1.00 32.15 N ATOM 2563 CA VAL B 135 8.746 -4.157 -14.542 1.00 34.96 C ATOM 2564 C VAL B 135 8.157 -5.249 -15.427 1.00 37.76 C ATOM 2565 O VAL B 135 8.679 -6.370 -15.484 1.00 36.58 O ATOM 2566 CB VAL B 135 7.940 -3.986 -13.244 1.00 32.30 C ATOM 2567 CG1 VAL B 135 7.766 -5.351 -12.538 1.00 34.03 C ATOM 2568 CG2 VAL B 135 8.628 -2.997 -12.317 1.00 32.50 C ATOM 2569 H VAL B 135 8.202 -2.103 -15.008 1.00 0.00 H ATOM 2570 N VAL B 136 7.060 -4.931 -16.125 1.00 34.79 N ATOM 2571 CA VAL B 136 6.348 -5.910 -16.944 1.00 36.88 C ATOM 2572 C VAL B 136 7.211 -6.372 -18.119 1.00 40.75 C ATOM 2573 O VAL B 136 7.218 -7.558 -18.462 1.00 47.19 O ATOM 2574 CB VAL B 136 5.001 -5.317 -17.411 1.00 37.12 C ATOM 2575 CG1 VAL B 136 4.449 -6.063 -18.597 1.00 40.29 C ATOM 2576 CG2 VAL B 136 3.991 -5.311 -16.248 1.00 31.26 C ATOM 2577 H VAL B 136 6.703 -3.955 -16.083 1.00 0.00 H ATOM 2578 N THR B 137 7.943 -5.456 -18.759 1.00 37.32 N ATOM 2579 CA THR B 137 8.838 -5.852 -19.848 1.00 41.87 C ATOM 2580 C THR B 137 10.182 -6.350 -19.347 1.00 44.90 C ATOM 2581 O THR B 137 11.042 -6.697 -20.168 1.00 45.68 O ATOM 2582 CB THR B 137 9.083 -4.693 -20.831 1.00 41.36 C ATOM 2583 OG1 THR B 137 9.716 -3.599 -20.153 1.00 41.10 O ATOM 2584 CG2 THR B 137 7.780 -4.225 -21.471 1.00 35.43 C ATOM 2585 HG1 THR B 137 9.132 -3.285 -19.418 1.00 0.00 H ATOM 2586 H THR B 137 7.877 -4.456 -18.482 1.00 0.00 H ATOM 2587 N GLY B 138 10.384 -6.379 -18.033 1.00 47.01 N ATOM 2588 CA GLY B 138 11.647 -6.823 -17.464 1.00 51.63 C ATOM 2589 C GLY B 138 12.823 -5.922 -17.773 1.00 55.12 C ATOM 2590 O GLY B 138 13.966 -6.390 -17.767 1.00 55.78 O ATOM 2591 H GLY B 138 9.620 -6.077 -17.396 1.00 0.00 H ATOM 2592 N ARG B 139 12.578 -4.643 -18.054 1.00 53.31 N ATOM 2593 CA ARG B 139 13.668 -3.701 -18.286 1.00 54.32 C ATOM 2594 C ARG B 139 14.239 -3.241 -16.947 1.00 58.83 C ATOM 2595 O ARG B 139 13.664 -3.518 -15.883 1.00 61.90 O ATOM 2596 CB ARG B 139 13.196 -2.495 -19.107 1.00 52.59 C ATOM 2597 CG ARG B 139 13.197 -2.708 -20.621 1.00 57.29 C ATOM 2598 CD ARG B 139 12.170 -1.806 -21.335 1.00 60.03 C ATOM 2599 NE ARG B 139 11.640 -2.416 -22.554 1.00 62.60 N ATOM 2600 CZ ARG B 139 11.794 -1.908 -23.774 1.00 66.58 C ATOM 2601 NH1 ARG B 139 12.459 -0.776 -23.945 1.00 64.72 N ATOM 2602 NH2 ARG B 139 11.285 -2.535 -24.830 1.00 70.51 N ATOM 2603 HE ARG B 139 11.108 -3.305 -22.461 1.00 0.00 H ATOM 2604 HH12 ARG B 139 12.578 -0.382 -24.900 1.00 0.00 H ATOM 2605 HH11 ARG B 139 12.863 -0.281 -23.124 1.00 0.00 H ATOM 2606 HH22 ARG B 139 11.408 -2.134 -25.782 1.00 0.00 H ATOM 2607 HH21 ARG B 139 10.764 -3.426 -24.704 1.00 0.00 H ATOM 2608 H ARG B 139 11.594 -4.311 -18.109 1.00 0.00 H TER 2609 ARG B 139 HETATM 2610 O HOH 1 17.212 15.590 -30.690 1.00 28.76 O HETATM 2611 O HOH 2 -29.884 24.435 -25.100 1.00 64.11 O HETATM 2612 O HOH 3 2.465 27.320 -14.055 1.00 33.40 O HETATM 2613 O HOH 4 13.505 24.717 -20.082 1.00 34.96 O HETATM 2614 O HOH 5 -19.331 7.962 -24.823 1.00 41.33 O HETATM 2615 O HOH 6 -18.239 27.263 -10.284 1.00 33.10 O HETATM 2616 O HOH 7 -17.498 8.307 -30.317 1.00 37.91 O HETATM 2617 O HOH 8 0.834 28.282 -33.981 1.00 41.74 O HETATM 2618 O HOH 9 4.232 14.242 -33.169 1.00 37.14 O HETATM 2619 O HOH 10 -13.820 36.482 -24.711 1.00 36.64 O HETATM 2620 O HOH 11 -13.860 33.574 -20.863 1.00 47.69 O HETATM 2621 O HOH 12 -2.089 27.399 -31.984 1.00 39.01 O HETATM 2622 O HOH 13 4.125 22.769 -17.643 1.00 40.80 O HETATM 2623 O HOH 14 -13.592 22.440 -32.863 1.00 24.25 O HETATM 2624 O HOH 15 -0.588 29.138 -28.491 1.00 43.24 O HETATM 2625 O HOH 16 1.400 19.354 -18.662 1.00 34.91 O HETATM 2626 O HOH 17 -9.236 36.714 -29.076 1.00 34.05 O HETATM 2627 O HOH 18 -2.539 34.134 -16.977 1.00 49.21 O HETATM 2628 O HOH 19 4.197 5.988 -19.509 1.00 42.55 O HETATM 2629 O HOH 20 -0.545 25.953 -9.635 1.00 38.38 O HETATM 2630 O HOH 21 -15.320 33.719 -33.701 1.00 40.28 O HETATM 2631 O HOH 22 19.791 11.034 -20.098 1.00 48.78 O HETATM 2632 O HOH 23 15.070 22.744 -17.011 1.00 40.10 O HETATM 2633 O HOH 24 5.007 2.111 -27.496 1.00 57.33 O HETATM 2634 O HOH 25 -8.391 18.387 -22.981 1.00 27.04 O HETATM 2635 O HOH 26 -4.318 25.718 -35.859 1.00 33.62 O HETATM 2636 O HOH 27 8.223 3.546 -18.711 1.00 33.58 O HETATM 2637 O HOH 28 9.289 5.012 -25.771 1.00 47.91 O HETATM 2638 O HOH 29 16.094 5.451 -23.927 1.00 53.01 O HETATM 2639 O HOH 30 3.962 25.244 -25.883 1.00 32.29 O HETATM 2640 O HOH 31 -2.474 21.635 -14.042 1.00 27.40 O HETATM 2641 O HOH 32 -1.613 2.288 -27.441 1.00 28.35 O HETATM 2642 O HOH 33 -27.437 10.610 -25.703 1.00 37.39 O HETATM 2643 O HOH 34 -9.469 5.815 -23.291 1.00 26.92 O HETATM 2644 O HOH 35 5.148 3.995 -26.318 1.00 45.03 O HETATM 2645 O HOH 36 -8.604 13.615 -17.653 1.00 34.36 O HETATM 2646 O HOH 37 -22.153 31.656 -20.420 1.00 50.95 O HETATM 2647 O HOH 38 -27.373 23.816 -21.098 1.00 32.98 O HETATM 2648 O HOH 39 -20.118 27.045 -31.938 1.00 42.24 O HETATM 2649 O HOH 40 -11.449 17.372 -22.829 1.00 21.57 O HETATM 2650 O HOH 41 5.474 24.662 -30.619 1.00 50.89 O HETATM 2651 O HOH 42 18.494 18.128 -33.086 1.00 46.65 O HETATM 2652 O HOH 43 -9.162 32.646 -20.753 1.00 40.00 O HETATM 2653 O HOH 44 -9.734 35.891 -25.152 1.00 39.00 O HETATM 2654 O HOH 45 5.386 24.359 -14.672 1.00 44.27 O HETATM 2655 O HOH 46 7.265 6.412 -29.192 1.00 57.85 O HETATM 2656 O HOH 47 8.123 15.857 -32.669 1.00 34.56 O HETATM 2657 O HOH 48 4.521 14.580 -26.423 1.00 24.44 O HETATM 2658 O HOH 49 2.939 30.226 -21.918 1.00 41.39 O HETATM 2659 O HOH 50 2.004 15.741 -25.142 1.00 34.69 O HETATM 2660 O HOH 51 -7.071 7.153 -22.458 1.00 32.59 O HETATM 2661 O HOH 52 -23.191 26.583 -27.117 1.00 38.80 O HETATM 2662 O HOH 53 -24.835 25.057 -30.354 1.00 52.44 O HETATM 2663 O HOH 54 -19.139 21.454 -31.201 1.00 40.34 O HETATM 2664 O HOH 55 -17.534 30.625 -32.237 1.00 49.58 O HETATM 2665 O HOH 56 6.786 22.413 -31.116 1.00 35.56 O HETATM 2666 O HOH 57 -8.273 16.379 -20.990 1.00 21.64 O HETATM 2667 O HOH 58 12.586 16.868 -13.551 1.00 33.84 O HETATM 2668 O HOH 59 -15.069 28.739 -7.217 1.00 55.76 O HETATM 2669 O HOH 60 3.436 2.776 -28.216 1.00 57.40 O HETATM 2670 O HOH 61 1.580 4.406 -30.486 1.00 42.61 O HETATM 2671 O HOH 62 15.760 13.903 -32.019 1.00 37.87 O HETATM 2672 O HOH 63 11.415 24.193 -21.508 1.00 31.78 O HETATM 2673 O HOH 64 -24.486 21.856 -18.319 1.00 37.24 O HETATM 2674 O HOH 65 -9.446 25.246 -34.403 1.00 32.20 O HETATM 2675 O HOH 66 -26.793 14.524 -27.650 1.00 38.93 O HETATM 2676 O HOH 67 -7.371 5.725 -30.980 1.00 51.65 O HETATM 2677 O HOH 68 -11.043 28.369 -10.731 1.00 49.60 O HETATM 2678 O HOH 69 -12.367 34.096 -28.138 1.00 28.78 O HETATM 2679 O HOH 70 19.843 10.445 -23.285 1.00 38.17 O HETATM 2680 O HOH 71 -5.760 7.879 -29.925 1.00 41.64 O HETATM 2681 O HOH 72 16.008 3.595 -16.138 1.00 47.22 O HETATM 2682 O HOH 73 -6.306 10.408 -28.036 1.00 32.95 O HETATM 2683 O HOH 74 -22.469 10.921 -25.674 1.00 41.02 O HETATM 2684 O HOH 75 -20.365 32.983 -21.776 1.00 39.18 O HETATM 2685 O HOH 76 -9.038 4.270 -32.146 1.00 52.89 O HETATM 2686 O HOH 77 -9.799 13.723 -32.573 1.00 54.71 O HETATM 2687 O HOH 78 8.561 4.141 -29.580 1.00 54.73 O HETATM 2688 O HOH 79 -11.647 4.999 -33.837 1.00 50.86 O HETATM 2689 O HOH 80 8.737 24.834 -25.934 1.00 35.90 O HETATM 2690 O HOH 81 -2.404 32.882 -26.067 1.00 47.03 O HETATM 2691 O HOH 82 0.985 23.583 -38.668 1.00 40.96 O HETATM 2692 O HOH 83 2.615 27.820 -9.961 1.00 65.10 O HETATM 2693 O HOH 84 -20.927 21.595 -13.592 1.00 52.98 O HETATM 2694 O HOH 85 -12.088 11.094 -24.676 1.00 36.32 O HETATM 2695 O HOH 86 -12.733 11.076 -19.197 1.00 40.89 O HETATM 2696 O HOH 87 3.572 29.468 -24.784 1.00 41.13 O HETATM 2697 O HOH 88 -7.895 -0.754 -30.972 1.00 40.17 O HETATM 2698 O HOH 89 -26.835 28.072 -22.328 1.00 53.19 O HETATM 2699 O HOH 90 -3.125 13.915 -34.717 1.00 59.10 O HETATM 2700 O HOH 91 -22.288 29.834 -16.232 1.00 50.76 O HETATM 2701 O HOH 92 -23.499 15.750 -30.934 1.00 30.19 O HETATM 2702 O HOH 93 18.691 6.389 -16.341 1.00 40.54 O HETATM 2703 O HOH 94 -5.846 11.853 -19.769 1.00 47.32 O HETATM 2704 O HOH 95 -19.177 8.708 -28.281 1.00 35.89 O HETATM 2705 O HOH 96 -25.213 28.142 -25.727 1.00 51.32 O HETATM 2706 O HOH 97 16.067 19.071 -19.209 1.00 37.44 O HETATM 2707 O HOH 98 -25.912 18.564 -17.115 1.00 62.55 O HETATM 2708 O HOH 99 -27.766 23.435 -23.776 1.00 54.27 O HETATM 2709 O HOH 100 -0.760 36.064 -31.092 1.00 65.09 O HETATM 2710 O HOH 101 -2.250 13.215 -32.735 1.00 48.68 O HETATM 2711 O HOH 102 -1.470 16.874 -36.309 1.00 38.08 O HETATM 2712 O HOH 103 -13.093 35.405 -22.001 1.00 52.80 O HETATM 2713 O HOH 104 15.948 7.882 -26.432 1.00 59.01 O HETATM 2714 O HOH 105 6.587 29.957 -9.466 1.00 61.02 O HETATM 2715 O HOH 106 -22.613 30.449 -13.398 1.00 47.04 O HETATM 2716 O HOH 107 6.061 12.309 -34.664 1.00 50.08 O HETATM 2717 O HOH 108 -20.710 25.133 -32.510 1.00 44.42 O HETATM 2718 O HOH 109 9.722 23.746 -28.445 1.00 58.92 O HETATM 2719 O HOH 110 0.304 12.010 -33.642 1.00 59.86 O HETATM 2720 O HOH 111 -3.420 16.377 -36.464 1.00 44.26 O HETATM 2721 O HOH 112 -16.164 30.312 -35.587 1.00 46.52 O HETATM 2722 O HOH 113 8.564 12.679 -34.187 1.00 42.37 O HETATM 2723 O HOH 114 0.711 9.436 -32.917 1.00 52.51 O HETATM 2724 O HOH 115 14.849 4.077 -26.269 1.00 53.21 O HETATM 2725 O HOH 116 -16.943 16.259 -37.137 1.00 55.71 O HETATM 2726 O HOH 117 -2.401 31.575 -28.442 1.00 54.50 O HETATM 2727 O HOH 118 5.607 16.822 -33.409 1.00 45.13 O HETATM 2728 O HOH 119 -9.819 35.978 -22.716 1.00 55.41 O HETATM 2729 O HOH 120 1.386 16.607 -37.404 1.00 49.76 O HETATM 2730 O HOH 121 -7.897 12.720 -32.354 1.00 60.30 O HETATM 2731 O HOH 122 6.398 26.346 -26.224 1.00 33.83 O HETATM 2732 O HOH 123 -4.343 11.637 -32.793 1.00 57.94 O HETATM 2733 O HOH 124 15.136 6.028 -26.209 1.00 65.58 O HETATM 2734 O HOH 125 4.177 28.548 -29.716 1.00 64.98 O HETATM 2735 O HOH 126 6.259 26.413 -29.069 1.00 51.42 O HETATM 2736 O HOH 127 16.685 21.611 -19.170 1.00 42.67 O HETATM 2737 O HOH 128 6.202 29.026 -25.431 1.00 55.84 O HETATM 2738 O HOH 129 -6.231 12.108 -34.645 1.00 40.85 O HETATM 2739 O HOH 130 -33.012 25.313 -23.983 1.00 41.91 O HETATM 2740 O HOH 131 -5.367 12.365 -29.941 1.00 35.66 O HETATM 2741 O HOH 132 -22.325 7.945 -17.005 1.00 42.50 O HETATM 2742 O HOH 133 -25.291 10.583 -12.641 1.00 58.77 O HETATM 2743 O HOH 134 14.794 16.457 -9.788 1.00 45.47 O HETATM 2744 O HOH 135 4.165 21.493 -14.139 1.00 60.48 O HETATM 2745 O HOH 136 -3.335 -13.554 -25.027 1.00 59.30 O HETATM 2746 O HOH 137 11.629 1.894 -20.173 1.00 42.63 O HETATM 2747 O HOH 138 1.636 -8.617 -30.137 1.00 31.55 O HETATM 2748 O HOH 139 -6.799 -12.337 -7.646 1.00 49.54 O HETATM 2749 O HOH 140 -22.751 15.150 -16.215 1.00 45.93 O HETATM 2750 O HOH 141 -10.033 5.256 -6.727 1.00 39.82 O HETATM 2751 O HOH 142 -0.401 14.868 5.300 1.00 51.30 O HETATM 2752 O HOH 143 -12.280 -6.353 -10.560 1.00 33.05 O HETATM 2753 O HOH 144 -3.834 20.824 -6.178 1.00 44.65 O HETATM 2754 O HOH 145 -1.633 10.536 -6.561 1.00 29.40 O HETATM 2755 O HOH 146 2.763 20.328 -16.240 1.00 49.23 O HETATM 2756 O HOH 147 -15.177 -8.662 -15.717 1.00 44.91 O HETATM 2757 O HOH 148 -5.523 8.980 -1.511 1.00 35.24 O HETATM 2758 O HOH 149 3.255 16.595 3.705 1.00 45.38 O HETATM 2759 O HOH 150 -11.219 -2.377 -5.357 1.00 41.57 O HETATM 2760 O HOH 151 5.340 3.664 -18.966 1.00 35.58 O HETATM 2761 O HOH 152 -5.959 -3.683 -0.650 1.00 31.92 O HETATM 2762 O HOH 153 6.278 4.103 -11.250 1.00 47.27 O HETATM 2763 O HOH 154 -6.644 -16.154 -16.859 1.00 37.58 O HETATM 2764 O HOH 155 -15.767 -3.908 -9.288 1.00 42.89 O HETATM 2765 O HOH 156 6.064 -6.078 -24.911 1.00 51.66 O HETATM 2766 O HOH 157 0.567 -15.356 -8.232 1.00 44.16 O HETATM 2767 O HOH 158 -12.468 16.914 -12.225 1.00 31.64 O HETATM 2768 O HOH 159 0.305 -16.483 -14.535 1.00 35.01 O HETATM 2769 O HOH 160 2.006 24.722 -11.368 1.00 33.96 O HETATM 2770 O HOH 161 -1.836 20.475 -4.370 1.00 47.67 O HETATM 2771 O HOH 162 4.244 1.603 -5.440 1.00 25.41 O HETATM 2772 O HOH 163 13.538 12.025 -4.910 1.00 31.40 O HETATM 2773 O HOH 164 -0.667 23.486 -12.527 1.00 28.45 O HETATM 2774 O HOH 165 2.357 -4.604 -5.741 1.00 37.95 O HETATM 2775 O HOH 166 -5.256 1.339 -16.526 1.00 25.21 O HETATM 2776 O HOH 167 1.976 -14.440 -11.834 1.00 49.30 O HETATM 2777 O HOH 168 -4.727 5.926 -21.615 1.00 28.98 O HETATM 2778 O HOH 169 -18.389 -6.849 -26.266 1.00 53.83 O HETATM 2779 O HOH 170 -2.089 -14.790 -11.383 1.00 36.34 O HETATM 2780 O HOH 171 -2.470 10.443 0.589 1.00 30.75 O HETATM 2781 O HOH 172 -7.101 19.344 -8.352 1.00 43.70 O HETATM 2782 O HOH 173 -7.180 -6.116 -5.364 1.00 33.96 O HETATM 2783 O HOH 174 -14.500 0.591 -6.399 1.00 38.52 O HETATM 2784 O HOH 175 -7.433 0.493 -18.334 1.00 24.14 O HETATM 2785 O HOH 176 -1.232 19.233 -13.798 1.00 38.77 O HETATM 2786 O HOH 177 -3.108 5.733 0.047 1.00 37.52 O HETATM 2787 O HOH 178 5.526 19.080 1.336 1.00 43.77 O HETATM 2788 O HOH 179 -20.624 3.241 -16.944 1.00 48.07 O HETATM 2789 O HOH 180 -1.579 8.308 -9.038 1.00 30.01 O HETATM 2790 O HOH 181 -4.933 3.428 -18.272 1.00 26.69 O HETATM 2791 O HOH 182 1.732 -15.315 -16.326 1.00 39.19 O HETATM 2792 O HOH 183 3.738 19.957 -0.672 1.00 32.83 O HETATM 2793 O HOH 184 3.339 -10.059 -16.480 1.00 54.88 O HETATM 2794 O HOH 185 -17.485 2.251 -12.571 1.00 50.87 O HETATM 2795 O HOH 186 -12.422 8.507 -13.168 1.00 52.82 O HETATM 2796 O HOH 187 -4.454 -16.767 -17.587 1.00 42.20 O HETATM 2797 O HOH 188 -4.733 -14.022 -7.816 1.00 40.35 O HETATM 2798 O HOH 189 -14.653 -7.325 -13.278 1.00 44.60 O HETATM 2799 O HOH 190 -10.535 7.158 -12.353 1.00 42.16 O HETATM 2800 O HOH 191 -10.007 11.361 -18.344 1.00 32.70 O HETATM 2801 O HOH 192 -5.806 20.936 -6.527 1.00 70.43 O HETATM 2802 O HOH 193 -12.431 -14.365 -19.999 1.00 42.51 O HETATM 2803 O HOH 194 8.372 27.383 -7.804 1.00 42.21 O HETATM 2804 O HOH 195 -13.262 9.613 -10.801 1.00 48.74 O HETATM 2805 O HOH 196 -20.486 -5.394 -19.381 1.00 41.16 O HETATM 2806 O HOH 197 -10.092 7.442 -5.546 1.00 50.40 O HETATM 2807 O HOH 198 2.204 21.945 -0.523 1.00 64.88 O HETATM 2808 O HOH 199 -19.457 2.672 -21.368 1.00 41.78 O HETATM 2809 O HOH 200 -3.951 -13.506 -31.739 1.00 56.66 O HETATM 2810 O HOH 201 12.189 15.641 -11.147 1.00 32.95 O HETATM 2811 O HOH 202 -9.441 2.896 -1.920 1.00 37.94 O HETATM 2812 O HOH 203 -11.408 -16.249 -25.289 1.00 58.16 O HETATM 2813 O HOH 204 0.878 27.355 -7.926 1.00 54.36 O HETATM 2814 O HOH 205 -7.283 -6.013 -2.586 1.00 40.93 O HETATM 2815 O HOH 206 -0.405 -14.040 -30.014 1.00 44.64 O HETATM 2816 O HOH 207 10.572 27.978 -9.603 1.00 47.60 O HETATM 2817 O HOH 208 -6.861 11.483 0.317 1.00 55.35 O HETATM 2818 O HOH 209 11.774 1.593 -5.402 1.00 52.86 O HETATM 2819 O HOH 210 -14.631 -6.257 -9.755 1.00 52.77 O HETATM 2820 O HOH 211 -4.293 12.414 1.291 1.00 44.90 O HETATM 2821 O HOH 212 4.230 25.053 -12.816 1.00 43.41 O HETATM 2822 O HOH 213 -8.826 4.272 0.479 1.00 50.30 O HETATM 2823 O HOH 214 -3.685 8.128 0.103 1.00 39.88 O HETATM 2824 O HOH 215 3.061 -6.908 -6.515 1.00 46.18 O HETATM 2825 O HOH 216 3.998 -12.092 -34.987 1.00 58.07 O HETATM 2826 O HOH 217 -7.773 -9.109 -5.681 1.00 51.64 O HETATM 2827 O HOH 218 -9.441 -17.429 -24.362 1.00 61.29 O HETATM 2828 O HOH 219 -14.794 17.573 -10.528 1.00 38.89 O HETATM 2829 O HOH 220 7.931 -0.645 -4.025 1.00 50.49 O HETATM 2830 O HOH 221 -10.745 5.927 -9.834 1.00 47.51 O HETATM 2831 O HOH 222 2.724 22.400 2.501 1.00 61.38 O HETATM 2832 O HOH 223 0.894 1.567 -30.898 1.00 50.67 O HETATM 2833 O HOH 224 -20.425 -2.378 -26.056 1.00 53.05 O HETATM 2834 O HOH 225 -18.302 3.637 -23.891 1.00 38.55 O HETATM 2835 O HOH 226 -17.178 6.300 -23.782 1.00 39.04 O HETATM 2836 O HOH 227 -18.367 -3.153 -28.885 1.00 42.77 O HETATM 2837 O HOH 228 -16.982 -3.860 -32.222 1.00 55.21 O HETATM 2838 O HOH 229 -1.629 0.981 -29.925 1.00 31.23 O HETATM 2839 O HOH 230 -6.875 -1.039 -32.860 1.00 51.10 O HETATM 2840 O HOH 231 -3.441 1.391 -31.835 1.00 34.77 O HETATM 2841 N ILE A 232 5.836 -2.792 -34.657 1.00 0.24 N HETATM 2842 CA ILE A 232 6.001 -1.976 -33.460 1.00 0.07 C HETATM 2843 C ILE A 232 5.021 -2.442 -32.379 1.00 0.23 C HETATM 2844 O ILE A 232 4.379 -3.480 -32.539 1.00 -0.39 O HETATM 2845 N ILE A 232 4.914 -1.705 -31.273 1.00 -0.26 N HETATM 2846 CA ILE A 232 3.986 -2.065 -30.200 1.00 0.13 C HETATM 2847 C ILE A 232 2.657 -1.348 -30.438 1.00 0.20 C HETATM 2848 O ILE A 232 2.565 -0.125 -30.301 1.00 -0.39 O HETATM 2849 N ILE A 232 1.628 -2.103 -30.807 1.00 -0.26 N HETATM 2850 CA ILE A 232 0.308 -1.520 -31.002 1.00 0.13 C HETATM 2851 C ILE A 232 -0.744 -2.542 -30.607 1.00 0.20 C HETATM 2852 O ILE A 232 -0.489 -3.753 -30.615 1.00 -0.39 O HETATM 2853 N ILE A 232 -1.934 -2.041 -30.254 1.00 -0.26 N HETATM 2854 CA ILE A 232 -3.062 -2.928 -29.998 1.00 0.14 C HETATM 2855 C ILE A 232 -3.358 -3.763 -31.235 1.00 0.20 C HETATM 2856 O ILE A 232 -3.408 -3.244 -32.351 1.00 -0.39 O HETATM 2857 N ILE A 232 -3.615 -5.055 -31.025 1.00 -0.27 N HETATM 2858 CA ILE A 232 -3.881 -5.942 -32.145 1.00 0.12 C HETATM 2859 C ILE A 232 -5.195 -5.664 -32.840 1.00 0.20 C HETATM 2860 O ILE A 232 -5.311 -5.866 -34.050 1.00 -0.39 O HETATM 2861 N ILE A 232 -6.196 -5.203 -32.095 1.00 -0.26 N HETATM 2862 CA ILE A 232 -7.493 -4.831 -32.645 1.00 0.13 C HETATM 2863 C ILE A 232 -8.333 -4.196 -31.547 1.00 0.20 C HETATM 2864 O ILE A 232 -7.828 -3.899 -30.457 1.00 -0.39 O HETATM 2865 N ILE A 232 -9.605 -3.986 -31.806 1.00 -0.27 N HETATM 2866 CA ILE A 232 -10.420 -3.290 -30.846 1.00 0.12 C HETATM 2867 C ILE A 232 -11.875 -3.525 -31.086 1.00 0.20 C HETATM 2868 O ILE A 232 -12.264 -4.502 -31.730 1.00 -0.39 O HETATM 2869 N ILE A 232 -12.682 -2.612 -30.559 1.00 -0.27 N HETATM 2870 CA ILE A 232 -14.124 -2.724 -30.648 1.00 0.12 C HETATM 2871 C ILE A 232 -14.759 -1.361 -30.544 1.00 0.20 C HETATM 2872 O ILE A 232 -14.125 -0.386 -30.133 1.00 -0.39 O HETATM 2873 N ILE A 232 -16.024 -1.294 -30.941 1.00 -0.26 N HETATM 2874 CA ILE A 232 -16.728 -0.026 -30.910 1.00 0.16 C HETATM 2875 C ILE A 232 -17.010 0.360 -29.465 1.00 0.21 C HETATM 2876 O ILE A 232 -17.399 -0.486 -28.656 1.00 -0.39 O HETATM 2877 N ILE A 232 -16.777 1.633 -29.145 1.00 -0.26 N HETATM 2878 CA ILE A 232 -17.095 2.196 -27.837 1.00 0.13 C HETATM 2879 C ILE A 232 -18.534 1.887 -27.445 1.00 0.20 C HETATM 2880 O ILE A 232 -19.461 2.096 -28.230 1.00 -0.39 O HETATM 2881 N ILE A 232 -18.721 1.383 -26.229 1.00 -0.26 N HETATM 2882 CA ILE A 232 -20.055 0.979 -25.799 1.00 0.15 C HETATM 2883 C ILE A 232 -20.975 2.194 -25.675 1.00 0.21 C HETATM 2884 O ILE A 232 -20.560 3.265 -25.224 1.00 -0.39 O HETATM 2885 N ILE A 232 -22.227 2.034 -26.106 1.00 -0.27 N HETATM 2886 CA ILE A 232 -23.227 3.096 -25.954 1.00 0.11 C HETATM 2887 C ILE A 232 -24.643 2.586 -26.230 1.00 0.06 C HETATM 2888 O ILE A 232 -25.285 1.994 -25.361 1.00 -0.57 O HETATM 2889 OXT ILE A 232 -25.176 2.755 -27.328 1.00 -0.57 O HETATM 2890 CB ILE A 232 -22.908 4.295 -26.867 1.00 0.07 C HETATM 2891 CG ILE A 232 -22.939 3.946 -28.346 1.00 0.18 C HETATM 2892 OD1 ILE A 232 -23.942 3.446 -28.859 1.00 -0.40 O HETATM 2893 ND2 ILE A 232 -21.835 4.221 -29.046 1.00 -0.30 N HETATM 2894 H91 ILE A 232 -21.798 4.013 -30.023 1.00 0.18 H HETATM 2895 H92 ILE A 232 -21.046 4.635 -28.593 1.00 0.18 H HETATM 2896 H89 ILE A 232 -21.904 4.668 -26.617 1.00 0.05 H HETATM 2897 H90 ILE A 232 -23.650 5.085 -26.679 1.00 0.05 H HETATM 2898 H88 ILE A 232 -23.190 3.443 -24.911 1.00 0.08 H HETATM 2899 H87 ILE A 232 -22.489 1.173 -26.541 1.00 0.19 H HETATM 2900 CB ILE A 232 -19.965 0.220 -24.472 1.00 0.08 C HETATM 2901 OG ILE A 232 -19.070 -0.881 -24.603 1.00 -0.39 O HETATM 2902 H86 ILE A 232 -19.388 -1.468 -25.279 1.00 0.21 H HETATM 2903 H84 ILE A 232 -20.963 -0.152 -24.196 1.00 0.06 H HETATM 2904 H85 ILE A 232 -19.597 0.898 -23.688 1.00 0.06 H HETATM 2905 H83 ILE A 232 -20.477 0.304 -26.558 1.00 0.08 H HETATM 2906 H82 ILE A 232 -17.945 1.281 -25.607 1.00 0.19 H HETATM 2907 CB ILE A 232 -16.862 3.706 -27.898 1.00 -0.01 C HETATM 2908 CG ILE A 232 -17.236 4.484 -26.682 1.00 -0.02 C HETATM 2909 CD ILE A 232 -16.999 5.967 -26.926 1.00 0.06 C HETATM 2910 NE ILE A 232 -15.606 6.198 -27.271 1.00 -0.27 N HETATM 2911 CZ ILE A 232 -14.683 6.643 -26.427 1.00 0.29 C HETATM 2912 NH1 ILE A 232 -15.002 6.943 -25.172 1.00 -0.28 N HETATM 2913 H78 ILE A 232 -14.278 7.288 -24.525 1.00 0.26 H HETATM 2914 H79 ILE A 232 -15.973 6.831 -24.846 1.00 0.26 H HETATM 2915 NH2 ILE A 232 -13.441 6.815 -26.857 1.00 -0.28 N HETATM 2916 H80 ILE A 232 -13.196 6.582 -27.830 1.00 0.26 H HETATM 2917 H81 ILE A 232 -12.721 7.182 -26.218 1.00 0.26 H HETATM 2918 H77 ILE A 232 -15.314 6.003 -28.239 1.00 0.26 H HETATM 2919 H75 ILE A 232 -17.247 6.530 -26.014 1.00 0.07 H HETATM 2920 H76 ILE A 232 -17.640 6.307 -27.753 1.00 0.07 H HETATM 2921 H73 ILE A 232 -16.622 4.151 -25.832 1.00 0.03 H HETATM 2922 H74 ILE A 232 -18.299 4.317 -26.454 1.00 0.03 H HETATM 2923 H71 ILE A 232 -17.447 4.101 -28.741 1.00 0.03 H HETATM 2924 H72 ILE A 232 -15.791 3.872 -28.085 1.00 0.03 H HETATM 2925 H70 ILE A 232 -16.424 1.758 -27.084 1.00 0.08 H HETATM 2926 H69 ILE A 232 -16.365 2.230 -29.834 1.00 0.19 H HETATM 2927 CB ILE A 232 -18.033 -0.123 -31.706 1.00 0.09 C HETATM 2928 OG1 ILE A 232 -17.724 -0.279 -33.095 1.00 -0.39 O HETATM 2929 H65 ILE A 232 -17.222 0.471 -33.393 1.00 0.21 H HETATM 2930 CG2 ILE A 232 -18.866 1.125 -31.518 1.00 -0.03 C HETATM 2931 H66 ILE A 232 -19.797 1.035 -32.097 1.00 0.03 H HETATM 2932 H67 ILE A 232 -18.299 2.000 -31.869 1.00 0.03 H HETATM 2933 H68 ILE A 232 -19.108 1.248 -30.452 1.00 0.03 H HETATM 2934 H64 ILE A 232 -18.605 -0.995 -31.357 1.00 0.06 H HETATM 2935 H63 ILE A 232 -16.093 0.747 -31.367 1.00 0.08 H HETATM 2936 H62 ILE A 232 -16.492 -2.118 -31.262 1.00 0.19 H HETATM 2937 H60 ILE A 232 -14.491 -3.359 -29.828 1.00 0.08 H HETATM 2938 H61 ILE A 232 -14.394 -3.178 -31.613 1.00 0.08 H HETATM 2939 H59 ILE A 232 -12.284 -1.825 -30.087 1.00 0.19 H HETATM 2940 H57 ILE A 232 -10.216 -2.212 -30.920 1.00 0.08 H HETATM 2941 H58 ILE A 232 -10.163 -3.644 -29.837 1.00 0.08 H HETATM 2942 H56 ILE A 232 -10.003 -4.308 -32.665 1.00 0.19 H HETATM 2943 CB ILE A 232 -8.219 -6.038 -33.245 1.00 -0.01 C HETATM 2944 CG ILE A 232 -8.612 -7.106 -32.234 1.00 -0.02 C HETATM 2945 CD ILE A 232 -8.585 -8.483 -32.891 1.00 0.06 C HETATM 2946 NE ILE A 232 -9.270 -9.501 -32.097 1.00 -0.27 N HETATM 2947 CZ ILE A 232 -9.031 -10.806 -32.187 1.00 0.29 C HETATM 2948 NH1 ILE A 232 -9.701 -11.662 -31.426 1.00 -0.28 N HETATM 2949 H52 ILE A 232 -9.513 -12.672 -31.499 1.00 0.26 H HETATM 2950 H53 ILE A 232 -10.409 -11.316 -30.763 1.00 0.26 H HETATM 2951 NH2 ILE A 232 -8.122 -11.257 -33.042 1.00 -0.28 N HETATM 2952 H54 ILE A 232 -7.600 -10.596 -33.635 1.00 0.26 H HETATM 2953 H55 ILE A 232 -7.939 -12.268 -33.113 1.00 0.26 H HETATM 2954 H51 ILE A 232 -9.984 -9.187 -31.424 1.00 0.26 H HETATM 2955 H49 ILE A 232 -7.537 -8.788 -33.025 1.00 0.07 H HETATM 2956 H50 ILE A 232 -9.076 -8.414 -33.873 1.00 0.07 H HETATM 2957 H47 ILE A 232 -9.627 -6.900 -31.862 1.00 0.03 H HETATM 2958 H48 ILE A 232 -7.903 -7.090 -31.393 1.00 0.03 H HETATM 2959 H45 ILE A 232 -7.558 -6.500 -33.993 1.00 0.03 H HETATM 2960 H46 ILE A 232 -9.134 -5.678 -33.738 1.00 0.03 H HETATM 2961 H44 ILE A 232 -7.336 -4.091 -33.444 1.00 0.08 H HETATM 2962 H43 ILE A 232 -6.051 -5.107 -31.110 1.00 0.19 H HETATM 2963 H41 ILE A 232 -3.897 -6.977 -31.773 1.00 0.08 H HETATM 2964 H42 ILE A 232 -3.069 -5.829 -32.879 1.00 0.08 H HETATM 2965 H40 ILE A 232 -3.625 -5.415 -30.092 1.00 0.19 H HETATM 2966 CB ILE A 232 -4.326 -2.147 -29.628 1.00 0.00 C HETATM 2967 CG ILE A 232 -4.288 -1.218 -28.426 1.00 -0.04 C HETATM 2968 CD1 ILE A 232 -4.447 0.139 -28.453 1.00 0.02 C HETATM 2969 NE1 ILE A 232 -4.436 0.646 -27.160 1.00 -0.29 N HETATM 2970 CE2 ILE A 232 -4.264 -0.386 -26.275 1.00 0.06 C HETATM 2971 CD2 ILE A 232 -4.191 -1.582 -27.028 1.00 -0.02 C HETATM 2972 CE3 ILE A 232 -4.026 -2.793 -26.348 1.00 -0.07 C HETATM 2973 CZ3 ILE A 232 -3.929 -2.768 -24.946 1.00 -0.08 C HETATM 2974 CH2 ILE A 232 -4.014 -1.568 -24.230 1.00 -0.08 C HETATM 2975 CZ2 ILE A 232 -4.176 -0.367 -24.871 1.00 -0.04 C HETATM 2976 H37 ILE A 232 -4.234 0.563 -24.317 1.00 0.05 H HETATM 2977 H39 ILE A 232 -3.950 -1.589 -23.148 1.00 0.05 H HETATM 2978 H38 ILE A 232 -3.785 -3.698 -24.408 1.00 0.05 H HETATM 2979 H36 ILE A 232 -3.974 -3.730 -26.890 1.00 0.05 H HETATM 2980 H35 ILE A 232 -4.540 1.639 -26.907 1.00 0.22 H HETATM 2981 H34 ILE A 232 -4.565 0.736 -29.356 1.00 0.08 H HETATM 2982 H32 ILE A 232 -5.119 -2.886 -29.440 1.00 0.04 H HETATM 2983 H33 ILE A 232 -4.595 -1.534 -30.501 1.00 0.04 H HETATM 2984 H31 ILE A 232 -2.800 -3.596 -29.164 1.00 0.08 H HETATM 2985 H30 ILE A 232 -2.050 -1.052 -30.165 1.00 0.19 H HETATM 2986 CB ILE A 232 0.097 -1.069 -32.452 1.00 -0.02 C HETATM 2987 H27 ILE A 232 -0.908 -0.636 -32.559 1.00 0.03 H HETATM 2988 H28 ILE A 232 0.196 -1.935 -33.123 1.00 0.03 H HETATM 2989 H29 ILE A 232 0.852 -0.313 -32.715 1.00 0.03 H HETATM 2990 H26 ILE A 232 0.212 -0.640 -30.349 1.00 0.08 H HETATM 2991 H25 ILE A 232 1.762 -3.083 -30.953 1.00 0.19 H HETATM 2992 CB ILE A 232 4.574 -1.723 -28.832 1.00 -0.01 C HETATM 2993 CG ILE A 232 3.764 -2.117 -27.584 1.00 -0.04 C HETATM 2994 CD1 ILE A 232 3.470 -3.608 -27.573 1.00 -0.06 C HETATM 2995 H19 ILE A 232 2.892 -3.861 -26.672 1.00 0.02 H HETATM 2996 H20 ILE A 232 4.417 -4.168 -27.570 1.00 0.02 H HETATM 2997 H21 ILE A 232 2.889 -3.874 -28.468 1.00 0.02 H HETATM 2998 CD2 ILE A 232 4.448 -1.707 -26.269 1.00 -0.06 C HETATM 2999 H22 ILE A 232 4.657 -0.627 -26.286 1.00 0.02 H HETATM 3000 H23 ILE A 232 5.392 -2.261 -26.158 1.00 0.02 H HETATM 3001 H24 ILE A 232 3.785 -1.939 -25.423 1.00 0.02 H HETATM 3002 H18 ILE A 232 2.803 -1.584 -27.637 1.00 0.03 H HETATM 3003 H16 ILE A 232 4.717 -0.633 -28.800 1.00 0.03 H HETATM 3004 H17 ILE A 232 5.551 -2.223 -28.760 1.00 0.03 H HETATM 3005 H15 ILE A 232 3.810 -3.150 -30.235 1.00 0.08 H HETATM 3006 H14 ILE A 232 5.481 -0.887 -31.174 1.00 0.19 H HETATM 3007 CB ILE A 232 5.825 -0.490 -33.795 1.00 0.02 C HETATM 3008 CG1 ILE A 232 4.344 -0.159 -34.004 1.00 -0.05 C HETATM 3009 CD1 ILE A 232 4.103 1.188 -34.646 1.00 -0.06 C HETATM 3010 H11 ILE A 232 3.021 1.351 -34.761 1.00 0.02 H HETATM 3011 H12 ILE A 232 4.585 1.215 -35.634 1.00 0.02 H HETATM 3012 H13 ILE A 232 4.527 1.979 -34.010 1.00 0.02 H HETATM 3013 H6 ILE A 232 3.845 -0.170 -33.024 1.00 0.03 H HETATM 3014 H7 ILE A 232 3.903 -0.934 -34.649 1.00 0.03 H HETATM 3015 CG2 ILE A 232 6.640 -0.134 -35.033 1.00 -0.06 C HETATM 3016 H8 ILE A 232 7.698 -0.380 -34.859 1.00 0.02 H HETATM 3017 H9 ILE A 232 6.543 0.942 -35.239 1.00 0.02 H HETATM 3018 H10 ILE A 232 6.267 -0.707 -35.895 1.00 0.02 H HETATM 3019 H5 ILE A 232 6.198 0.106 -32.949 1.00 0.04 H HETATM 3020 H4 ILE A 232 7.023 -2.119 -33.080 1.00 0.11 H HETATM 3021 H1 ILE A 232 5.955 -3.764 -34.420 1.00 0.20 H HETATM 3022 H2 ILE A 232 6.526 -2.527 -35.342 1.00 0.20 H HETATM 3023 H3 ILE A 232 4.913 -2.649 -35.037 1.00 0.20 H CONECT 1 2 8 9 10 CONECT 8 1 CONECT 9 1 CONECT 10 1 CONECT 1312 1313 1319 1320 1321 CONECT 1319 1312 CONECT 1320 1312 CONECT 1321 1312 CONECT 2841 2842 3021 3022 3023 CONECT 2842 2841 2843 3007 3020 CONECT 2843 2842 2844 2845 CONECT 2844 2843 CONECT 2845 2843 2846 3006 CONECT 2846 2845 2847 2992 3005 CONECT 2847 2846 2848 2849 CONECT 2848 2847 CONECT 2849 2847 2850 2991 CONECT 2850 2849 2851 2986 2990 CONECT 2851 2850 2852 2853 CONECT 2852 2851 CONECT 2853 2851 2854 2985 CONECT 2854 2853 2855 2966 2984 CONECT 2855 2854 2856 2857 CONECT 2856 2855 CONECT 2857 2855 2858 2965 CONECT 2858 2857 2859 2963 2964 CONECT 2859 2858 2860 2861 CONECT 2860 2859 CONECT 2861 2859 2862 2962 CONECT 2862 2861 2863 2943 2961 CONECT 2863 2862 2864 2865 CONECT 2864 2863 CONECT 2865 2863 2866 2942 CONECT 2866 2865 2867 2940 2941 CONECT 2867 2866 2868 2869 CONECT 2868 2867 CONECT 2869 2867 2870 2939 CONECT 2870 2869 2871 2937 2938 CONECT 2871 2870 2872 2873 CONECT 2872 2871 CONECT 2873 2871 2874 2936 CONECT 2874 2873 2875 2927 2935 CONECT 2875 2874 2876 2877 CONECT 2876 2875 CONECT 2877 2875 2878 2926 CONECT 2878 2877 2879 2907 2925 CONECT 2879 2878 2880 2881 CONECT 2880 2879 CONECT 2881 2879 2882 2906 CONECT 2882 2881 2883 2900 2905 CONECT 2883 2882 2884 2885 CONECT 2884 2883 CONECT 2885 2883 2886 2899 CONECT 2886 2885 2887 2890 2898 CONECT 2887 2886 2888 2889 CONECT 2888 2887 CONECT 2889 2887 CONECT 2890 2886 2891 2896 2897 CONECT 2891 2890 2892 2893 CONECT 2892 2891 CONECT 2893 2891 2894 2895 CONECT 2894 2893 CONECT 2895 2893 CONECT 2896 2890 CONECT 2897 2890 CONECT 2898 2886 CONECT 2899 2885 CONECT 2900 2882 2901 2903 2904 CONECT 2901 2900 2902 CONECT 2902 2901 CONECT 2903 2900 CONECT 2904 2900 CONECT 2905 2882 CONECT 2906 2881 CONECT 2907 2878 2908 2923 2924 CONECT 2908 2907 2909 2921 2922 CONECT 2909 2908 2910 2919 2920 CONECT 2910 2909 2911 2918 CONECT 2911 2910 2912 2915 CONECT 2912 2911 2913 2914 CONECT 2913 2912 CONECT 2914 2912 CONECT 2915 2911 2916 2917 CONECT 2916 2915 CONECT 2917 2915 CONECT 2918 2910 CONECT 2919 2909 CONECT 2920 2909 CONECT 2921 2908 CONECT 2922 2908 CONECT 2923 2907 CONECT 2924 2907 CONECT 2925 2878 CONECT 2926 2877 CONECT 2927 2874 2928 2930 2934 CONECT 2928 2927 2929 CONECT 2929 2928 CONECT 2930 2927 2931 2932 2933 CONECT 2931 2930 CONECT 2932 2930 CONECT 2933 2930 CONECT 2934 2927 CONECT 2935 2874 CONECT 2936 2873 CONECT 2937 2870 CONECT 2938 2870 CONECT 2939 2869 CONECT 2940 2866 CONECT 2941 2866 CONECT 2942 2865 CONECT 2943 2862 2944 2959 2960 CONECT 2944 2943 2945 2957 2958 CONECT 2945 2944 2946 2955 2956 CONECT 2946 2945 2947 2954 CONECT 2947 2946 2948 2951 CONECT 2948 2947 2949 2950 CONECT 2949 2948 CONECT 2950 2948 CONECT 2951 2947 2952 2953 CONECT 2952 2951 CONECT 2953 2951 CONECT 2954 2946 CONECT 2955 2945 CONECT 2956 2945 CONECT 2957 2944 CONECT 2958 2944 CONECT 2959 2943 CONECT 2960 2943 CONECT 2961 2862 CONECT 2962 2861 CONECT 2963 2858 CONECT 2964 2858 CONECT 2965 2857 CONECT 2966 2854 2967 2982 2983 CONECT 2967 2966 2968 2971 CONECT 2968 2967 2969 2981 CONECT 2969 2968 2970 2980 CONECT 2970 2969 2971 2975 CONECT 2971 2967 2970 2972 CONECT 2972 2971 2973 2979 CONECT 2973 2972 2974 2978 CONECT 2974 2973 2975 2977 CONECT 2975 2970 2974 2976 CONECT 2976 2975 CONECT 2977 2974 CONECT 2978 2973 CONECT 2979 2972 CONECT 2980 2969 CONECT 2981 2968 CONECT 2982 2966 CONECT 2983 2966 CONECT 2984 2854 CONECT 2985 2853 CONECT 2986 2850 2987 2988 2989 CONECT 2987 2986 CONECT 2988 2986 CONECT 2989 2986 CONECT 2990 2850 CONECT 2991 2849 CONECT 2992 2846 2993 3003 3004 CONECT 2993 2992 2994 2998 3002 CONECT 2994 2993 2995 2996 2997 CONECT 2995 2994 CONECT 2996 2994 CONECT 2997 2994 CONECT 2998 2993 2999 3000 3001 CONECT 2999 2998 CONECT 3000 2998 CONECT 3001 2998 CONECT 3002 2993 CONECT 3003 2992 CONECT 3004 2992 CONECT 3005 2846 CONECT 3006 2845 CONECT 3007 2842 3008 3015 3019 CONECT 3008 3007 3009 3013 3014 CONECT 3009 3008 3010 3011 3012 CONECT 3010 3009 CONECT 3011 3009 CONECT 3012 3009 CONECT 3013 3008 CONECT 3014 3008 CONECT 3015 3007 3016 3017 3018 CONECT 3016 3015 CONECT 3017 3015 CONECT 3018 3015 CONECT 3019 3007 CONECT 3020 2842 CONECT 3021 2841 CONECT 3022 2841 CONECT 3023 2841 MASTER 0 0 0 0 0 0 0 0 3021 2 191 22 END
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Entry Information
PDB ID
5xvw
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
PHD finger protein ALFIN-LIKE 2
Ligand Name
14-mer
EC.Number
E.C.-.-.-.-
Resolution
1.85(Å)
Affinity (Kd/Ki/IC50)
Kd=3.29uM
Release Year
2018
Protein/NA Sequence
Check fasta file
Primary Reference
(2018) J. Mol. Biol. Vol. 430: pp. 4245-4259
Ligand Properties
Formula
C
5
5
H
9
3
N
2
0
O
1
6
Molecular Weight
1290.450
Exact Mass
1289.710
No. of atoms
184
No. of bonds
185
Polar Surface Area
616.4
LOGP Value
-3.12 (
Computed with XLOGP3
)
-4.94 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 16
No. of Hydrogen Bond Acceptors: 16
No. of Rotatable Bonds: 53
No. of Nitrogen and Oxygen Atoms: 36
No. of Rings: 2
Canonical SMILES
OC[C@@H](C(=O)N[C@H](C(=O)O)CC(=O)N)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)CNC(=O)CNC(=O)[C@@H](NC(=O)CNC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)[NH3+])CC(C)C)C)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N
InChI String
InChI=1S/C55H90N20O16/c1-7-27(4)43(57)51(88)72-35(18-26(2)3)49(86)68-28(5)45(82)71-36(19-30-21-64-32-13-9-8-12-31(30)32)47(84)67-24-41(80)69-33(14-10-16-62-54(58)59)46(83)66-22-40(79)65-23-42(81)75-44(29(6)77)52(89)70-34(15-11-17-63-55(60)61)48(85)74-38(25-76)50(87)73-37(53(90)91)20-39(56)78/h8-9,12-13,21,26-29,33-38,43-44,64,76-77H,7,10-11,14-20,22-25,57H2,1-6H3,(H2,56,78)(H,65,79)(H,66,83)(H,67,84)(H,68,86)(H,69,80)(H,70,89)(H,71,82)(H,72,88)(H,73,87)(H,74,85)(H,75,81)(H,90,91)(H4,58,59,62)(H4,60,61,63)/p+3/t27-,28-,29+,33-,34-,35-,36-,37-,38-,43-,44-/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
Q9FKW0
Q9SRM4
Entrez Gene ID
NCBI Entrez Gene ID:
834451
820290
ASD
Information of known allosteric effects of PDB entries
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