Browse entries in the PDBbind-CN Database
HEADER 5Y53_COMPLEX COMPND 5Y53_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 THR A 661 139 ATOM 1 N SER A -1 -20.194 -1.083 -12.429 1.00 19.08 N ATOM 2 CA SER A -1 -19.871 -1.834 -11.217 1.00 17.18 C ATOM 3 C SER A -1 -21.113 -2.516 -10.634 1.00 10.24 C ATOM 4 O SER A -1 -22.232 -2.039 -10.834 1.00 12.90 O ATOM 5 CB SER A -1 -19.255 -0.903 -10.190 1.00 23.04 C ATOM 6 OG SER A -1 -17.976 -0.474 -10.622 1.00 28.99 O ATOM 7 HG SER A -1 -18.064 0.006 -11.483 1.00 0.00 H ATOM 8 HN3 SER A -1 -20.898 -0.351 -12.205 1.00 0.00 H ATOM 9 HN2 SER A -1 -20.581 -1.731 -13.144 1.00 0.00 H ATOM 10 HN1 SER A -1 -19.331 -0.634 -12.797 1.00 0.00 H ATOM 11 N PRO A 10 -20.923 -3.618 -9.901 1.00 9.38 N ATOM 12 CA PRO A 10 -22.071 -4.265 -9.236 1.00 8.04 C ATOM 13 C PRO A 10 -22.744 -3.304 -8.262 1.00 10.91 C ATOM 14 O PRO A 10 -22.082 -2.579 -7.500 1.00 10.89 O ATOM 15 CB PRO A 10 -21.440 -5.467 -8.513 1.00 11.59 C ATOM 16 CG PRO A 10 -20.118 -5.666 -9.168 1.00 13.45 C ATOM 17 CD PRO A 10 -19.659 -4.308 -9.600 1.00 12.90 C ATOM 18 N ARG A 11 -24.091 -3.305 -8.277 1.00 8.37 N ATOM 19 CA ARG A 11 -24.824 -2.410 -7.375 1.00 10.86 C ATOM 20 C ARG A 11 -25.895 -3.126 -6.563 1.00 8.45 C ATOM 21 O ARG A 11 -26.053 -2.821 -5.375 1.00 10.41 O ATOM 22 CB ARG A 11 -25.485 -1.256 -8.172 1.00 12.92 C ATOM 23 CG ARG A 11 -24.486 -0.186 -8.600 1.00 13.91 C ATOM 24 CD ARG A 11 -23.950 0.569 -7.379 1.00 28.89 C ATOM 25 NE ARG A 11 -22.884 1.506 -7.725 1.00 29.70 N ATOM 26 CZ ARG A 11 -21.584 1.241 -7.593 1.00 44.77 C ATOM 27 NH1 ARG A 11 -21.175 0.066 -7.108 1.00 16.02 N ATOM 28 NH2 ARG A 11 -20.689 2.157 -7.940 1.00 52.20 N ATOM 29 HE ARG A 11 -23.156 2.438 -8.098 1.00 0.00 H ATOM 30 HH12 ARG A 11 -20.158 -0.130 -7.009 1.00 0.00 H ATOM 31 HH11 ARG A 11 -21.873 -0.653 -6.829 1.00 0.00 H ATOM 32 HH22 ARG A 11 -19.674 1.956 -7.839 1.00 0.00 H ATOM 33 HH21 ARG A 11 -21.003 3.076 -8.313 1.00 0.00 H ATOM 34 H ARG A 11 -24.607 -3.935 -8.923 1.00 0.00 H ATOM 35 N THR A 12 -26.657 -4.039 -7.172 1.00 10.82 N ATOM 36 CA THR A 12 -27.698 -4.728 -6.422 1.00 8.32 C ATOM 37 C THR A 12 -27.083 -5.839 -5.583 1.00 8.39 C ATOM 38 O THR A 12 -25.944 -6.268 -5.806 1.00 8.48 O ATOM 39 CB THR A 12 -28.757 -5.340 -7.347 1.00 10.02 C ATOM 40 OG1 THR A 12 -28.137 -6.347 -8.156 1.00 9.76 O ATOM 41 CG2 THR A 12 -29.402 -4.271 -8.248 1.00 12.75 C ATOM 42 HG1 THR A 12 -28.813 -6.748 -8.757 1.00 0.00 H ATOM 43 H THR A 12 -26.507 -4.257 -8.178 1.00 0.00 H ATOM 44 N VAL A 13 -27.856 -6.311 -4.602 1.00 9.07 N ATOM 45 CA VAL A 13 -27.398 -7.436 -3.780 1.00 9.48 C ATOM 46 C VAL A 13 -27.017 -8.605 -4.670 1.00 6.60 C ATOM 47 O VAL A 13 -25.993 -9.261 -4.458 1.00 7.14 O ATOM 48 CB VAL A 13 -28.482 -7.841 -2.753 1.00 6.66 C ATOM 49 CG1 VAL A 13 -28.130 -9.185 -2.120 1.00 10.64 C ATOM 50 CG2 VAL A 13 -28.603 -6.788 -1.670 1.00 7.17 C ATOM 51 H VAL A 13 -28.785 -5.880 -4.420 1.00 0.00 H ATOM 52 N GLU A 14 -27.842 -8.894 -5.680 1.00 7.41 N ATOM 53 CA GLU A 14 -27.562 -10.023 -6.552 1.00 7.95 C ATOM 54 C GLU A 14 -26.270 -9.806 -7.332 1.00 6.78 C ATOM 55 O GLU A 14 -25.442 -10.716 -7.419 1.00 7.34 O ATOM 56 CB GLU A 14 -28.740 -10.272 -7.504 1.00 8.30 C ATOM 57 CG GLU A 14 -28.444 -11.374 -8.514 1.00 7.28 C ATOM 58 CD GLU A 14 -29.640 -11.742 -9.366 1.00 18.29 C ATOM 59 OE1 GLU A 14 -30.726 -11.145 -9.183 1.00 16.16 O ATOM 60 OE2 GLU A 14 -29.488 -12.638 -10.220 1.00 21.38 O ATOM 61 H GLU A 14 -28.687 -8.310 -5.843 1.00 0.00 H ATOM 62 N GLU A 15 -26.097 -8.612 -7.918 1.00 6.96 N ATOM 63 CA GLU A 15 -24.895 -8.327 -8.700 1.00 5.97 C ATOM 64 C GLU A 15 -23.664 -8.419 -7.826 1.00 5.79 C ATOM 65 O GLU A 15 -22.639 -8.972 -8.247 1.00 9.25 O ATOM 66 CB GLU A 15 -24.973 -6.934 -9.327 1.00 11.30 C ATOM 67 CG GLU A 15 -25.967 -6.812 -10.511 1.00 7.69 C ATOM 68 CD GLU A 15 -26.255 -5.378 -10.857 1.00 13.08 C ATOM 69 OE1 GLU A 15 -25.907 -4.473 -10.062 1.00 8.88 O ATOM 70 OE2 GLU A 15 -26.822 -5.145 -11.946 1.00 18.64 O ATOM 71 H GLU A 15 -26.828 -7.879 -7.815 1.00 0.00 H ATOM 72 N ILE A 16 -23.750 -7.889 -6.604 1.00 5.63 N ATOM 73 CA ILE A 16 -22.564 -7.889 -5.749 1.00 4.58 C ATOM 74 C ILE A 16 -22.232 -9.299 -5.308 1.00 6.92 C ATOM 75 O ILE A 16 -21.050 -9.683 -5.241 1.00 6.89 O ATOM 76 CB ILE A 16 -22.781 -6.945 -4.552 1.00 5.99 C ATOM 77 CG1 ILE A 16 -22.914 -5.520 -5.093 1.00 6.98 C ATOM 78 CG2 ILE A 16 -21.651 -7.071 -3.543 1.00 6.71 C ATOM 79 CD1 ILE A 16 -23.496 -4.569 -4.041 1.00 8.19 C ATOM 80 H ILE A 16 -24.646 -7.483 -6.266 1.00 0.00 H ATOM 81 N PHE A 17 -23.260 -10.095 -4.975 1.00 6.74 N ATOM 82 CA PHE A 17 -22.986 -11.452 -4.531 1.00 6.46 C ATOM 83 C PHE A 17 -22.478 -12.327 -5.675 1.00 7.41 C ATOM 84 O PHE A 17 -21.633 -13.195 -5.442 1.00 7.89 O ATOM 85 CB PHE A 17 -24.236 -12.087 -3.892 1.00 7.52 C ATOM 86 CG PHE A 17 -23.960 -13.423 -3.290 1.00 5.57 C ATOM 87 CD1 PHE A 17 -23.003 -13.545 -2.312 1.00 7.03 C ATOM 88 CD2 PHE A 17 -24.640 -14.559 -3.715 1.00 9.75 C ATOM 89 CE1 PHE A 17 -22.701 -14.765 -1.770 1.00 8.03 C ATOM 90 CE2 PHE A 17 -24.351 -15.800 -3.152 1.00 9.88 C ATOM 91 CZ PHE A 17 -23.397 -15.899 -2.196 1.00 8.79 C ATOM 92 H PHE A 17 -24.238 -9.746 -5.034 1.00 0.00 H ATOM 93 N LYS A 18 -22.948 -12.100 -6.906 1.00 6.37 N ATOM 94 CA LYS A 18 -22.366 -12.809 -8.049 1.00 10.10 C ATOM 95 C LYS A 18 -20.882 -12.482 -8.194 1.00 6.09 C ATOM 96 O LYS A 18 -20.068 -13.375 -8.457 1.00 8.43 O ATOM 97 CB LYS A 18 -23.124 -12.447 -9.337 1.00 10.36 C ATOM 98 CG LYS A 18 -22.577 -13.108 -10.604 1.00 14.69 C ATOM 99 CD LYS A 18 -23.366 -12.613 -11.837 1.00 21.35 C ATOM 100 CE LYS A 18 -22.850 -13.213 -13.145 1.00 27.55 C ATOM 101 NZ LYS A 18 -23.576 -12.636 -14.310 1.00 40.29 N ATOM 102 HZ1 LYS A 18 -24.591 -12.843 -14.221 1.00 0.00 H ATOM 103 HZ2 LYS A 18 -23.432 -11.606 -14.331 1.00 0.00 H ATOM 104 HZ3 LYS A 18 -23.210 -13.057 -15.188 1.00 0.00 H ATOM 105 H LYS A 18 -23.724 -11.423 -7.052 1.00 0.00 H ATOM 106 N ASP A 19 -20.521 -11.197 -8.039 1.00 6.29 N ATOM 107 CA ASP A 19 -19.126 -10.772 -8.133 1.00 7.09 C ATOM 108 C ASP A 19 -18.304 -11.408 -7.018 1.00 5.98 C ATOM 109 O ASP A 19 -17.230 -11.969 -7.261 1.00 6.89 O ATOM 110 CB ASP A 19 -19.086 -9.231 -8.086 1.00 5.71 C ATOM 111 CG ASP A 19 -17.682 -8.648 -8.024 1.00 7.01 C ATOM 112 OD1 ASP A 19 -17.110 -8.626 -6.929 1.00 9.33 O ATOM 113 OD2 ASP A 19 -17.168 -8.192 -9.076 1.00 10.19 O ATOM 114 H ASP A 19 -21.255 -10.485 -7.847 1.00 0.00 H ATOM 115 N TYR A 20 -18.835 -11.383 -5.792 1.00 5.69 N ATOM 116 CA TYR A 20 -18.175 -12.012 -4.651 1.00 4.43 C ATOM 117 C TYR A 20 -17.931 -13.491 -4.921 1.00 6.71 C ATOM 118 O TYR A 20 -16.832 -14.012 -4.691 1.00 7.02 O ATOM 119 CB TYR A 20 -19.038 -11.840 -3.380 1.00 5.25 C ATOM 120 CG TYR A 20 -18.484 -12.584 -2.178 1.00 4.54 C ATOM 121 CD1 TYR A 20 -18.789 -13.916 -1.939 1.00 9.04 C ATOM 122 CD2 TYR A 20 -17.642 -11.936 -1.277 1.00 8.14 C ATOM 123 CE1 TYR A 20 -18.243 -14.593 -0.841 1.00 9.21 C ATOM 124 CE2 TYR A 20 -17.111 -12.593 -0.186 1.00 10.13 C ATOM 125 CZ TYR A 20 -17.409 -13.918 0.022 1.00 10.88 C ATOM 126 OH TYR A 20 -16.852 -14.546 1.123 1.00 13.38 O ATOM 127 HH TYR A 20 -17.150 -15.490 1.149 1.00 0.00 H ATOM 128 H TYR A 20 -19.745 -10.901 -5.646 1.00 0.00 H ATOM 129 N SER A 21 -18.967 -14.189 -5.378 1.00 6.06 N ATOM 130 CA SER A 21 -18.867 -15.631 -5.575 1.00 6.01 C ATOM 131 C SER A 21 -17.845 -15.972 -6.647 1.00 5.24 C ATOM 132 O SER A 21 -17.143 -16.981 -6.532 1.00 7.74 O ATOM 133 CB SER A 21 -20.231 -16.212 -5.965 1.00 7.90 C ATOM 134 OG SER A 21 -21.152 -15.986 -4.913 1.00 8.94 O ATOM 135 HG SER A 21 -21.238 -15.013 -4.755 1.00 0.00 H ATOM 136 H SER A 21 -19.859 -13.701 -5.597 1.00 0.00 H ATOM 137 N ALA A 22 -17.774 -15.155 -7.699 1.00 7.44 N ATOM 138 CA ALA A 22 -16.811 -15.401 -8.767 1.00 6.35 C ATOM 139 C ALA A 22 -15.377 -15.170 -8.287 1.00 10.03 C ATOM 140 O ALA A 22 -14.482 -15.990 -8.538 1.00 9.63 O ATOM 141 CB ALA A 22 -17.134 -14.511 -9.969 1.00 7.82 C ATOM 142 H ALA A 22 -18.411 -14.335 -7.758 1.00 0.00 H ATOM 143 N ARG A 23 -15.130 -14.059 -7.592 1.00 5.38 N ATOM 144 CA ARG A 23 -13.778 -13.839 -7.063 1.00 6.07 C ATOM 145 C ARG A 23 -13.379 -14.928 -6.075 1.00 6.12 C ATOM 146 O ARG A 23 -12.219 -15.368 -6.047 1.00 7.13 O ATOM 147 CB ARG A 23 -13.690 -12.481 -6.372 1.00 4.77 C ATOM 148 CG ARG A 23 -13.982 -11.280 -7.226 1.00 5.41 C ATOM 149 CD ARG A 23 -13.859 -9.995 -6.375 1.00 6.97 C ATOM 150 NE ARG A 23 -14.406 -8.863 -7.128 1.00 6.35 N ATOM 151 CZ ARG A 23 -13.676 -8.102 -7.934 1.00 8.54 C ATOM 152 NH1 ARG A 23 -12.350 -8.309 -8.026 1.00 6.29 N ATOM 153 NH2 ARG A 23 -14.250 -7.128 -8.637 1.00 6.73 N ATOM 154 HE ARG A 23 -15.418 -8.645 -7.026 1.00 0.00 H ATOM 155 HH12 ARG A 23 -11.774 -7.715 -8.656 1.00 0.00 H ATOM 156 HH11 ARG A 23 -11.901 -9.063 -7.467 1.00 0.00 H ATOM 157 HH22 ARG A 23 -13.675 -6.534 -9.268 1.00 0.00 H ATOM 158 HH21 ARG A 23 -15.273 -6.962 -8.556 1.00 0.00 H ATOM 159 H ARG A 23 -15.882 -13.360 -7.427 1.00 0.00 H ATOM 160 N ARG A 24 -14.310 -15.316 -5.203 1.00 4.87 N ATOM 161 CA ARG A 24 -14.056 -16.368 -4.234 1.00 4.31 C ATOM 162 C ARG A 24 -13.731 -17.683 -4.926 1.00 8.23 C ATOM 163 O ARG A 24 -12.808 -18.403 -4.518 1.00 8.17 O ATOM 164 CB ARG A 24 -15.280 -16.551 -3.337 1.00 6.63 C ATOM 165 CG ARG A 24 -15.050 -17.636 -2.314 1.00 9.41 C ATOM 166 CD ARG A 24 -16.308 -17.843 -1.429 1.00 9.35 C ATOM 167 NE ARG A 24 -16.135 -18.980 -0.529 1.00 9.65 N ATOM 168 CZ ARG A 24 -16.283 -20.240 -0.914 1.00 12.57 C ATOM 169 NH1 ARG A 24 -16.562 -20.530 -2.185 1.00 12.09 N ATOM 170 NH2 ARG A 24 -16.091 -21.211 -0.041 1.00 12.95 N ATOM 171 HE ARG A 24 -15.883 -18.792 0.462 1.00 0.00 H ATOM 172 HH12 ARG A 24 -16.677 -21.521 -2.479 1.00 0.00 H ATOM 173 HH11 ARG A 24 -16.665 -19.765 -2.882 1.00 0.00 H ATOM 174 HH22 ARG A 24 -16.205 -22.203 -0.333 1.00 0.00 H ATOM 175 HH21 ARG A 24 -15.826 -20.984 0.939 1.00 0.00 H ATOM 176 H ARG A 24 -15.242 -14.854 -5.217 1.00 0.00 H ATOM 177 N ALA A 25 -14.480 -18.016 -5.981 1.00 7.50 N ATOM 178 CA ALA A 25 -14.197 -19.256 -6.691 1.00 8.23 C ATOM 179 C ALA A 25 -12.766 -19.271 -7.210 1.00 8.68 C ATOM 180 O ALA A 25 -12.086 -20.310 -7.169 1.00 10.05 O ATOM 181 CB ALA A 25 -15.177 -19.433 -7.851 1.00 10.41 C ATOM 182 H ALA A 25 -15.256 -17.397 -6.292 1.00 0.00 H ATOM 183 N ALA A 26 -12.310 -18.124 -7.721 1.00 7.18 N ATOM 184 CA ALA A 26 -10.935 -17.999 -8.221 1.00 6.89 C ATOM 185 C ALA A 26 -9.926 -18.201 -7.093 1.00 7.39 C ATOM 186 O ALA A 26 -8.936 -18.930 -7.245 1.00 7.17 O ATOM 187 CB ALA A 26 -10.731 -16.624 -8.869 1.00 9.19 C ATOM 188 H ALA A 26 -12.944 -17.300 -7.766 1.00 0.00 H ATOM 189 N LEU A 27 -10.146 -17.540 -5.957 1.00 5.34 N ATOM 190 CA LEU A 27 -9.197 -17.654 -4.852 1.00 4.51 C ATOM 191 C LEU A 27 -9.219 -19.055 -4.262 1.00 5.62 C ATOM 192 O LEU A 27 -8.179 -19.578 -3.845 1.00 7.65 O ATOM 193 CB LEU A 27 -9.525 -16.613 -3.764 1.00 6.61 C ATOM 194 CG LEU A 27 -9.411 -15.167 -4.221 1.00 7.14 C ATOM 195 CD1 LEU A 27 -9.904 -14.257 -3.090 1.00 15.36 C ATOM 196 CD2 LEU A 27 -7.961 -14.852 -4.566 1.00 15.14 C ATOM 197 H LEU A 27 -10.992 -16.944 -5.857 1.00 0.00 H ATOM 198 N LEU A 28 -10.402 -19.672 -4.194 1.00 7.36 N ATOM 199 CA LEU A 28 -10.474 -21.046 -3.714 1.00 7.27 C ATOM 200 C LEU A 28 -9.656 -21.971 -4.610 1.00 7.82 C ATOM 201 O LEU A 28 -8.899 -22.817 -4.116 1.00 8.46 O ATOM 202 CB LEU A 28 -11.934 -21.497 -3.642 1.00 8.39 C ATOM 203 CG LEU A 28 -12.140 -22.964 -3.274 1.00 10.40 C ATOM 204 CD1 LEU A 28 -11.775 -23.179 -1.852 1.00 13.40 C ATOM 205 CD2 LEU A 28 -13.608 -23.325 -3.515 1.00 18.07 C ATOM 206 H LEU A 28 -11.268 -19.174 -4.482 1.00 0.00 H ATOM 207 N ARG A 29 -9.785 -21.810 -5.929 1.00 6.15 N ATOM 208 CA ARG A 29 -8.934 -22.575 -6.849 1.00 7.08 C ATOM 209 C ARG A 29 -7.450 -22.311 -6.584 1.00 9.02 C ATOM 210 O ARG A 29 -6.649 -23.246 -6.516 1.00 9.17 O ATOM 211 CB ARG A 29 -9.297 -22.249 -8.299 1.00 7.97 C ATOM 212 CG ARG A 29 -8.499 -23.091 -9.290 1.00 13.51 C ATOM 213 CD ARG A 29 -9.136 -23.194 -10.667 1.00 14.46 C ATOM 214 NE ARG A 29 -9.514 -21.890 -11.196 1.00 21.03 N ATOM 215 CZ ARG A 29 -8.733 -21.099 -11.930 1.00 13.85 C ATOM 216 NH1 ARG A 29 -9.223 -19.932 -12.328 1.00 14.48 N ATOM 217 NH2 ARG A 29 -7.482 -21.460 -12.290 1.00 14.22 N ATOM 218 HE ARG A 29 -10.473 -21.549 -10.983 1.00 0.00 H ATOM 219 HH12 ARG A 29 -8.639 -19.291 -12.902 1.00 0.00 H ATOM 220 HH11 ARG A 29 -10.191 -19.658 -12.066 1.00 0.00 H ATOM 221 HH22 ARG A 29 -6.900 -20.817 -12.864 1.00 0.00 H ATOM 222 HH21 ARG A 29 -7.101 -22.381 -11.993 1.00 0.00 H ATOM 223 H ARG A 29 -10.488 -21.143 -6.305 1.00 0.00 H ATOM 224 N ALA A 30 -7.064 -21.045 -6.402 1.00 6.32 N ATOM 225 CA ALA A 30 -5.653 -20.721 -6.158 1.00 7.28 C ATOM 226 C ALA A 30 -5.098 -21.442 -4.933 1.00 6.90 C ATOM 227 O ALA A 30 -3.925 -21.867 -4.918 1.00 7.00 O ATOM 228 CB ALA A 30 -5.514 -19.212 -5.964 1.00 7.60 C ATOM 229 H ALA A 30 -7.770 -20.282 -6.433 1.00 0.00 H ATOM 230 N LEU A 31 -5.915 -21.554 -3.881 1.00 6.98 N ATOM 231 CA LEU A 31 -5.474 -22.067 -2.604 1.00 9.10 C ATOM 232 C LEU A 31 -5.681 -23.569 -2.461 1.00 7.86 C ATOM 233 O LEU A 31 -5.250 -24.139 -1.457 1.00 11.06 O ATOM 234 CB LEU A 31 -6.183 -21.315 -1.480 1.00 9.20 C ATOM 235 CG LEU A 31 -5.796 -19.843 -1.425 1.00 10.06 C ATOM 236 CD1 LEU A 31 -6.710 -19.086 -0.487 1.00 10.73 C ATOM 237 CD2 LEU A 31 -4.334 -19.682 -0.983 1.00 11.55 C ATOM 238 H LEU A 31 -6.907 -21.260 -3.986 1.00 0.00 H ATOM 239 N THR A 32 -6.282 -24.234 -3.459 1.00 7.05 N ATOM 240 CA THR A 32 -6.507 -25.669 -3.371 1.00 10.55 C ATOM 241 C THR A 32 -6.028 -26.345 -4.648 1.00 6.12 C ATOM 242 O THR A 32 -4.889 -26.816 -4.706 1.00 9.14 O ATOM 243 CB THR A 32 -7.990 -26.002 -3.073 1.00 9.44 C ATOM 244 OG1 THR A 32 -8.864 -25.483 -4.089 1.00 8.89 O ATOM 245 CG2 THR A 32 -8.405 -25.452 -1.719 1.00 11.47 C ATOM 246 HG1 THR A 32 -8.767 -24.499 -4.134 1.00 0.00 H ATOM 247 H THR A 32 -6.591 -23.717 -4.307 1.00 0.00 H ATOM 248 N LYS A 33 -6.865 -26.358 -5.688 1.00 8.73 N ATOM 249 CA LYS A 33 -6.515 -27.070 -6.915 1.00 8.70 C ATOM 250 C LYS A 33 -5.190 -26.594 -7.502 1.00 8.00 C ATOM 251 O LYS A 33 -4.352 -27.410 -7.921 1.00 9.88 O ATOM 252 CB LYS A 33 -7.636 -26.904 -7.946 1.00 7.21 C ATOM 253 CG LYS A 33 -7.382 -27.585 -9.267 1.00 12.56 C ATOM 254 CD LYS A 33 -8.636 -27.440 -10.138 1.00 12.64 C ATOM 255 CE LYS A 33 -8.501 -28.146 -11.463 1.00 11.60 C ATOM 256 NZ LYS A 33 -9.825 -28.065 -12.169 1.00 14.44 N ATOM 257 HZ1 LYS A 33 -10.555 -28.526 -11.589 1.00 0.00 H ATOM 258 HZ2 LYS A 33 -10.077 -27.067 -12.317 1.00 0.00 H ATOM 259 HZ3 LYS A 33 -9.756 -28.547 -13.088 1.00 0.00 H ATOM 260 H LYS A 33 -7.774 -25.857 -5.624 1.00 0.00 H ATOM 261 N ASP A 34 -4.985 -25.274 -7.557 1.00 7.27 N ATOM 262 CA ASP A 34 -3.786 -24.703 -8.165 1.00 6.33 C ATOM 263 C ASP A 34 -2.760 -24.263 -7.125 1.00 5.75 C ATOM 264 O ASP A 34 -1.901 -23.422 -7.431 1.00 7.87 O ATOM 265 CB ASP A 34 -4.141 -23.503 -9.031 1.00 6.24 C ATOM 266 CG ASP A 34 -5.013 -23.862 -10.203 1.00 9.96 C ATOM 267 OD1 ASP A 34 -4.971 -25.029 -10.669 1.00 8.37 O ATOM 268 OD2 ASP A 34 -5.729 -22.955 -10.677 1.00 10.06 O ATOM 269 H ASP A 34 -5.700 -24.635 -7.155 1.00 0.00 H ATOM 270 N VAL A 35 -2.819 -24.820 -5.912 1.00 7.29 N ATOM 271 CA VAL A 35 -1.985 -24.299 -4.828 1.00 7.13 C ATOM 272 C VAL A 35 -0.497 -24.425 -5.135 1.00 7.73 C ATOM 273 O VAL A 35 0.294 -23.578 -4.709 1.00 8.43 O ATOM 274 CB VAL A 35 -2.354 -24.983 -3.493 1.00 8.83 C ATOM 275 CG1 VAL A 35 -1.898 -26.429 -3.491 1.00 7.96 C ATOM 276 CG2 VAL A 35 -1.751 -24.214 -2.297 1.00 10.15 C ATOM 277 H VAL A 35 -3.457 -25.623 -5.738 1.00 0.00 H ATOM 278 N ASP A 36 -0.081 -25.448 -5.886 1.00 7.64 N ATOM 279 CA ASP A 36 1.348 -25.552 -6.183 1.00 7.71 C ATOM 280 C ASP A 36 1.796 -24.459 -7.145 1.00 9.38 C ATOM 281 O ASP A 36 2.941 -23.993 -7.075 1.00 10.29 O ATOM 282 CB ASP A 36 1.674 -26.932 -6.759 1.00 12.32 C ATOM 283 CG ASP A 36 1.584 -28.041 -5.715 1.00 16.29 C ATOM 284 OD1 ASP A 36 1.395 -27.758 -4.510 1.00 15.89 O ATOM 285 OD2 ASP A 36 1.711 -29.214 -6.109 1.00 19.01 O ATOM 286 H ASP A 36 -0.755 -26.152 -6.250 1.00 0.00 H ATOM 287 N ASP A 37 0.908 -24.016 -8.029 1.00 9.37 N ATOM 288 CA ASP A 37 1.241 -22.906 -8.916 1.00 7.33 C ATOM 289 C ASP A 37 1.276 -21.605 -8.130 1.00 8.35 C ATOM 290 O ASP A 37 2.237 -20.825 -8.216 1.00 8.02 O ATOM 291 CB ASP A 37 0.207 -22.844 -10.045 1.00 6.49 C ATOM 292 CG ASP A 37 0.008 -24.210 -10.701 1.00 12.13 C ATOM 293 OD1 ASP A 37 0.974 -24.680 -11.341 1.00 14.12 O ATOM 294 OD2 ASP A 37 -1.066 -24.832 -10.548 1.00 9.93 O ATOM 295 H ASP A 37 -0.029 -24.463 -8.089 1.00 0.00 H ATOM 296 N PHE A 38 0.231 -21.367 -7.340 1.00 5.90 N ATOM 297 CA PHE A 38 0.179 -20.177 -6.508 1.00 6.28 C ATOM 298 C PHE A 38 1.416 -20.073 -5.610 1.00 7.08 C ATOM 299 O PHE A 38 2.066 -19.023 -5.540 1.00 7.94 O ATOM 300 CB PHE A 38 -1.113 -20.209 -5.679 1.00 4.44 C ATOM 301 CG PHE A 38 -1.089 -19.251 -4.534 1.00 5.88 C ATOM 302 CD1 PHE A 38 -1.110 -17.891 -4.779 1.00 5.84 C ATOM 303 CD2 PHE A 38 -1.059 -19.706 -3.219 1.00 9.38 C ATOM 304 CE1 PHE A 38 -1.091 -16.974 -3.737 1.00 8.95 C ATOM 305 CE2 PHE A 38 -1.014 -18.791 -2.164 1.00 9.57 C ATOM 306 CZ PHE A 38 -1.039 -17.431 -2.424 1.00 9.65 C ATOM 307 H PHE A 38 -0.559 -22.043 -7.318 1.00 0.00 H ATOM 308 N TYR A 39 1.771 -21.169 -4.939 1.00 7.07 N ATOM 309 CA TYR A 39 2.904 -21.128 -4.023 1.00 8.07 C ATOM 310 C TYR A 39 4.186 -20.790 -4.768 1.00 9.01 C ATOM 311 O TYR A 39 4.968 -19.940 -4.325 1.00 10.56 O ATOM 312 CB TYR A 39 3.033 -22.476 -3.305 1.00 8.42 C ATOM 313 CG TYR A 39 4.113 -22.534 -2.243 1.00 13.05 C ATOM 314 CD1 TYR A 39 5.434 -22.806 -2.594 1.00 13.69 C ATOM 315 CD2 TYR A 39 3.794 -22.357 -0.899 1.00 13.94 C ATOM 316 CE1 TYR A 39 6.434 -22.890 -1.612 1.00 17.33 C ATOM 317 CE2 TYR A 39 4.790 -22.447 0.088 1.00 15.41 C ATOM 318 CZ TYR A 39 6.088 -22.710 -0.279 1.00 19.59 C ATOM 319 OH TYR A 39 7.042 -22.785 0.718 1.00 23.42 O ATOM 320 HH TYR A 39 6.801 -23.508 1.350 1.00 0.00 H ATOM 321 H TYR A 39 1.239 -22.053 -5.069 1.00 0.00 H ATOM 322 N SER A 40 4.391 -21.425 -5.920 1.00 7.96 N ATOM 323 CA SER A 40 5.619 -21.207 -6.681 1.00 8.45 C ATOM 324 C SER A 40 5.742 -19.767 -7.152 1.00 10.76 C ATOM 325 O SER A 40 6.854 -19.230 -7.247 1.00 13.50 O ATOM 326 CB SER A 40 5.663 -22.156 -7.879 1.00 8.73 C ATOM 327 OG SER A 40 6.752 -21.837 -8.730 1.00 9.95 O ATOM 328 HG SER A 40 6.651 -20.909 -9.059 1.00 0.00 H ATOM 329 H SER A 40 3.671 -22.082 -6.281 1.00 0.00 H ATOM 330 N GLN A 41 4.617 -19.120 -7.437 1.00 6.17 N ATOM 331 CA GLN A 41 4.648 -17.752 -7.927 1.00 5.91 C ATOM 332 C GLN A 41 4.979 -16.752 -6.827 1.00 9.91 C ATOM 333 O GLN A 41 5.362 -15.620 -7.134 1.00 9.73 O ATOM 334 CB GLN A 41 3.308 -17.399 -8.569 1.00 6.73 C ATOM 335 CG GLN A 41 3.064 -18.168 -9.844 1.00 5.21 C ATOM 336 CD GLN A 41 1.621 -18.022 -10.333 1.00 8.45 C ATOM 337 OE1 GLN A 41 0.886 -17.148 -9.880 1.00 9.42 O ATOM 338 NE2 GLN A 41 1.214 -18.897 -11.264 1.00 9.44 N ATOM 339 HE22 GLN A 41 1.870 -19.621 -11.619 1.00 0.00 H ATOM 340 HE21 GLN A 41 0.242 -18.852 -11.631 1.00 0.00 H ATOM 341 H GLN A 41 3.703 -19.599 -7.308 1.00 0.00 H ATOM 342 N CYS A 42 4.850 -17.144 -5.566 1.00 9.02 N ATOM 343 CA CYS A 42 5.066 -16.203 -4.465 1.00 5.97 C ATOM 344 C CYS A 42 6.507 -16.258 -3.956 1.00 8.46 C ATOM 345 O CYS A 42 6.760 -16.463 -2.782 1.00 8.58 O ATOM 346 CB CYS A 42 4.076 -16.479 -3.338 1.00 8.67 C ATOM 347 SG CYS A 42 2.376 -16.002 -3.781 1.00 10.87 S ATOM 348 H CYS A 42 4.593 -18.130 -5.357 1.00 0.00 H ATOM 349 N ASP A 43 7.445 -16.032 -4.852 1.00 10.90 N ATOM 350 CA ASP A 43 8.865 -16.105 -4.545 1.00 12.22 C ATOM 351 C ASP A 43 9.247 -14.973 -3.609 1.00 9.51 C ATOM 352 O ASP A 43 8.999 -13.810 -3.949 1.00 9.18 O ATOM 353 CB ASP A 43 9.631 -15.998 -5.863 1.00 16.80 C ATOM 354 CG ASP A 43 11.134 -16.142 -5.718 1.00 26.63 C ATOM 355 OD1 ASP A 43 11.705 -16.112 -4.600 1.00 20.06 O ATOM 356 OD2 ASP A 43 11.757 -16.289 -6.793 1.00 42.84 O ATOM 357 H ASP A 43 7.158 -15.791 -5.822 1.00 0.00 H ATOM 358 N PRO A 44 9.812 -15.259 -2.426 1.00 10.59 N ATOM 359 CA PRO A 44 10.180 -14.184 -1.498 1.00 9.84 C ATOM 360 C PRO A 44 11.148 -13.167 -2.066 1.00 10.43 C ATOM 361 O PRO A 44 11.182 -12.051 -1.540 1.00 9.19 O ATOM 362 CB PRO A 44 10.816 -14.937 -0.315 1.00 13.11 C ATOM 363 CG PRO A 44 10.203 -16.300 -0.366 1.00 13.41 C ATOM 364 CD PRO A 44 9.985 -16.598 -1.816 1.00 8.56 C ATOM 365 N GLU A 45 11.934 -13.499 -3.105 1.00 9.70 N ATOM 366 CA GLU A 45 12.900 -12.513 -3.593 1.00 10.13 C ATOM 367 C GLU A 45 12.268 -11.467 -4.505 1.00 8.02 C ATOM 368 O GLU A 45 12.905 -10.448 -4.779 1.00 10.22 O ATOM 369 CB GLU A 45 14.059 -13.186 -4.334 1.00 12.52 C ATOM 370 CG GLU A 45 13.643 -13.749 -5.642 1.00 13.44 C ATOM 371 CD GLU A 45 14.778 -14.455 -6.357 1.00 29.46 C ATOM 372 OE1 GLU A 45 15.931 -14.292 -5.919 1.00 17.24 O ATOM 373 OE2 GLU A 45 14.498 -15.206 -7.317 1.00 30.66 O ATOM 374 H GLU A 45 11.858 -14.435 -3.552 1.00 0.00 H ATOM 375 N LYS A 46 11.024 -11.667 -4.952 1.00 8.56 N ATOM 376 CA LYS A 46 10.407 -10.693 -5.847 1.00 8.43 C ATOM 377 C LYS A 46 9.941 -9.453 -5.059 1.00 10.03 C ATOM 378 O LYS A 46 9.982 -9.408 -3.824 1.00 9.67 O ATOM 379 CB LYS A 46 9.244 -11.345 -6.598 1.00 11.05 C ATOM 380 CG LYS A 46 9.705 -12.488 -7.491 1.00 10.70 C ATOM 381 CD LYS A 46 8.548 -13.136 -8.240 1.00 16.34 C ATOM 382 CE LYS A 46 9.102 -14.089 -9.310 1.00 15.41 C ATOM 383 NZ LYS A 46 8.027 -14.949 -9.910 1.00 31.10 N ATOM 384 HZ1 LYS A 46 7.585 -15.521 -9.163 1.00 0.00 H ATOM 385 HZ2 LYS A 46 7.308 -14.343 -10.355 1.00 0.00 H ATOM 386 HZ3 LYS A 46 8.446 -15.576 -10.626 1.00 0.00 H ATOM 387 H LYS A 46 10.497 -12.515 -4.662 1.00 0.00 H ATOM 388 N GLU A 47 9.505 -8.425 -5.792 1.00 9.20 N ATOM 389 CA GLU A 47 8.885 -7.268 -5.169 1.00 11.58 C ATOM 390 C GLU A 47 7.565 -7.704 -4.535 1.00 9.11 C ATOM 391 O GLU A 47 7.133 -8.844 -4.702 1.00 8.13 O ATOM 392 CB GLU A 47 8.688 -6.164 -6.200 1.00 14.18 C ATOM 393 CG GLU A 47 10.014 -5.709 -6.802 1.00 14.78 C ATOM 394 CD GLU A 47 9.872 -4.492 -7.686 1.00 38.14 C ATOM 395 OE1 GLU A 47 9.154 -4.566 -8.704 1.00 43.93 O ATOM 396 OE2 GLU A 47 10.485 -3.453 -7.354 1.00 48.50 O ATOM 397 H GLU A 47 9.611 -8.453 -6.826 1.00 0.00 H ATOM 398 N ASN A 48 6.914 -6.793 -3.812 1.00 8.32 N ATOM 399 CA ASN A 48 5.685 -7.154 -3.105 1.00 7.41 C ATOM 400 C ASN A 48 4.612 -7.657 -4.062 1.00 7.97 C ATOM 401 O ASN A 48 4.261 -6.988 -5.043 1.00 9.27 O ATOM 402 CB ASN A 48 5.143 -5.978 -2.277 1.00 9.15 C ATOM 403 CG ASN A 48 5.129 -4.627 -3.006 1.00 9.02 C ATOM 404 OD1 ASN A 48 5.076 -4.519 -4.231 1.00 14.72 O ATOM 405 ND2 ASN A 48 5.189 -3.575 -2.204 1.00 12.17 N ATOM 406 HD22 ASN A 48 5.233 -3.709 -1.174 1.00 0.00 H ATOM 407 HD21 ASN A 48 5.193 -2.615 -2.605 1.00 0.00 H ATOM 408 H ASN A 48 7.281 -5.822 -3.750 1.00 0.00 H ATOM 409 N LEU A 49 4.084 -8.843 -3.770 1.00 6.63 N ATOM 410 CA LEU A 49 3.048 -9.465 -4.589 1.00 4.96 C ATOM 411 C LEU A 49 1.764 -9.629 -3.778 1.00 8.35 C ATOM 412 O LEU A 49 1.785 -9.723 -2.549 1.00 8.60 O ATOM 413 CB LEU A 49 3.489 -10.829 -5.110 1.00 7.75 C ATOM 414 CG LEU A 49 4.747 -10.812 -5.973 1.00 12.29 C ATOM 415 CD1 LEU A 49 5.226 -12.257 -6.259 1.00 11.03 C ATOM 416 CD2 LEU A 49 4.498 -10.047 -7.242 1.00 9.55 C ATOM 417 H LEU A 49 4.423 -9.346 -2.925 1.00 0.00 H ATOM 418 N CYS A 50 0.640 -9.695 -4.495 1.00 7.12 N ATOM 419 CA CYS A 50 -0.689 -9.869 -3.917 1.00 8.06 C ATOM 420 C CYS A 50 -1.416 -10.953 -4.683 1.00 10.02 C ATOM 421 O CYS A 50 -1.161 -11.159 -5.873 1.00 8.29 O ATOM 422 CB CYS A 50 -1.531 -8.609 -4.017 1.00 12.32 C ATOM 423 SG CYS A 50 -0.622 -7.094 -3.586 1.00 15.77 S ATOM 424 H CYS A 50 0.716 -9.618 -5.529 1.00 0.00 H ATOM 425 N LEU A 51 -2.362 -11.593 -4.009 1.00 7.11 N ATOM 426 CA LEU A 51 -3.235 -12.585 -4.627 1.00 4.42 C ATOM 427 C LEU A 51 -4.566 -11.916 -4.947 1.00 6.54 C ATOM 428 O LEU A 51 -5.249 -11.446 -4.041 1.00 6.00 O ATOM 429 CB LEU A 51 -3.447 -13.781 -3.703 1.00 7.00 C ATOM 430 CG LEU A 51 -4.486 -14.813 -4.182 1.00 6.17 C ATOM 431 CD1 LEU A 51 -4.115 -15.407 -5.564 1.00 5.74 C ATOM 432 CD2 LEU A 51 -4.661 -15.936 -3.147 1.00 6.11 C ATOM 433 H LEU A 51 -2.487 -11.379 -2.999 1.00 0.00 H ATOM 434 N TYR A 52 -4.922 -11.869 -6.231 1.00 6.71 N ATOM 435 CA TYR A 52 -6.166 -11.259 -6.683 1.00 5.08 C ATOM 436 C TYR A 52 -7.091 -12.336 -7.210 1.00 7.22 C ATOM 437 O TYR A 52 -6.640 -13.263 -7.883 1.00 7.14 O ATOM 438 CB TYR A 52 -5.934 -10.283 -7.850 1.00 7.77 C ATOM 439 CG TYR A 52 -5.204 -9.031 -7.499 1.00 11.63 C ATOM 440 CD1 TYR A 52 -3.807 -9.004 -7.491 1.00 12.76 C ATOM 441 CD2 TYR A 52 -5.894 -7.863 -7.189 1.00 9.59 C ATOM 442 CE1 TYR A 52 -3.120 -7.861 -7.173 1.00 12.06 C ATOM 443 CE2 TYR A 52 -5.204 -6.710 -6.872 1.00 13.98 C ATOM 444 CZ TYR A 52 -3.815 -6.719 -6.864 1.00 19.12 C ATOM 445 OH TYR A 52 -3.129 -5.573 -6.537 1.00 17.14 O ATOM 446 HH TYR A 52 -3.375 -5.293 -5.620 1.00 0.00 H ATOM 447 H TYR A 52 -4.285 -12.285 -6.940 1.00 0.00 H ATOM 448 N GLY A 53 -8.378 -12.167 -6.971 1.00 8.61 N ATOM 449 CA GLY A 53 -9.403 -12.959 -7.641 1.00 9.27 C ATOM 450 C GLY A 53 -10.325 -11.999 -8.362 1.00 5.70 C ATOM 451 O GLY A 53 -10.664 -10.939 -7.832 1.00 8.26 O ATOM 452 H GLY A 53 -8.671 -11.445 -6.282 1.00 0.00 H ATOM 453 N HIS A 54 -10.737 -12.379 -9.563 1.00 7.13 N ATOM 454 CA HIS A 54 -11.448 -11.465 -10.438 1.00 6.35 C ATOM 455 C HIS A 54 -12.819 -12.013 -10.775 1.00 7.34 C ATOM 456 O HIS A 54 -13.058 -13.218 -10.657 1.00 8.35 O ATOM 457 CB HIS A 54 -10.641 -11.241 -11.721 1.00 9.06 C ATOM 458 CG HIS A 54 -9.353 -10.517 -11.499 1.00 10.78 C ATOM 459 ND1 HIS A 54 -9.292 -9.170 -11.203 1.00 16.71 N ATOM 460 CD2 HIS A 54 -8.071 -10.950 -11.561 1.00 10.67 C ATOM 461 CE1 HIS A 54 -8.024 -8.814 -11.057 1.00 14.53 C ATOM 462 NE2 HIS A 54 -7.265 -9.867 -11.303 1.00 10.74 N ATOM 463 H HIS A 54 -10.547 -13.350 -9.884 1.00 0.00 H ATOM 464 N PRO A 55 -13.753 -11.153 -11.178 1.00 7.47 N ATOM 465 CA PRO A 55 -15.108 -11.638 -11.458 1.00 9.24 C ATOM 466 C PRO A 55 -15.203 -12.545 -12.681 1.00 7.92 C ATOM 467 O PRO A 55 -16.248 -13.172 -12.865 1.00 11.16 O ATOM 468 CB PRO A 55 -15.927 -10.355 -11.649 1.00 13.23 C ATOM 469 CG PRO A 55 -14.959 -9.290 -11.887 1.00 13.42 C ATOM 470 CD PRO A 55 -13.671 -9.676 -11.181 1.00 10.08 C ATOM 471 N ASN A 56 -14.160 -12.653 -13.501 1.00 7.70 N ATOM 472 CA ASN A 56 -14.147 -13.658 -14.560 1.00 8.57 C ATOM 473 C ASN A 56 -13.647 -15.016 -14.066 1.00 9.45 C ATOM 474 O ASN A 56 -13.398 -15.927 -14.882 1.00 7.74 O ATOM 475 CB ASN A 56 -13.309 -13.163 -15.742 1.00 10.48 C ATOM 476 CG ASN A 56 -11.839 -12.939 -15.385 1.00 11.92 C ATOM 477 OD1 ASN A 56 -11.402 -13.209 -14.271 1.00 11.10 O ATOM 478 ND2 ASN A 56 -11.067 -12.445 -16.352 1.00 14.26 N ATOM 479 HD22 ASN A 56 -11.475 -12.229 -17.284 1.00 0.00 H ATOM 480 HD21 ASN A 56 -10.056 -12.276 -16.175 1.00 0.00 H ATOM 481 H ASN A 56 -13.346 -12.015 -13.386 1.00 0.00 H ATOM 482 N GLU A 57 -13.524 -15.176 -12.745 1.00 6.79 N ATOM 483 CA GLU A 57 -13.133 -16.400 -12.047 1.00 6.07 C ATOM 484 C GLU A 57 -11.675 -16.772 -12.283 1.00 10.65 C ATOM 485 O GLU A 57 -11.278 -17.915 -12.066 1.00 11.68 O ATOM 486 CB GLU A 57 -14.075 -17.574 -12.387 1.00 9.17 C ATOM 487 CG GLU A 57 -15.498 -17.288 -11.921 1.00 13.48 C ATOM 488 CD GLU A 57 -16.370 -18.526 -11.784 1.00 23.16 C ATOM 489 OE1 GLU A 57 -15.843 -19.656 -11.714 1.00 22.25 O ATOM 490 OE2 GLU A 57 -17.603 -18.353 -11.735 1.00 24.92 O ATOM 491 H GLU A 57 -13.727 -14.345 -12.153 1.00 0.00 H ATOM 492 N SER A 58 -10.860 -15.808 -12.665 1.00 5.62 N ATOM 493 CA SER A 58 -9.418 -15.991 -12.756 1.00 8.99 C ATOM 494 C SER A 58 -8.748 -15.483 -11.485 1.00 9.61 C ATOM 495 O SER A 58 -9.221 -14.539 -10.855 1.00 8.20 O ATOM 496 CB SER A 58 -8.849 -15.235 -13.954 1.00 8.70 C ATOM 497 OG SER A 58 -8.927 -13.831 -13.765 1.00 8.01 O ATOM 498 HG SER A 58 -9.874 -13.567 -13.647 1.00 0.00 H ATOM 499 H SER A 58 -11.263 -14.881 -12.911 1.00 0.00 H ATOM 500 N TRP A 59 -7.639 -16.122 -11.116 1.00 6.89 N ATOM 501 CA TRP A 59 -6.790 -15.646 -10.028 1.00 5.96 C ATOM 502 C TRP A 59 -5.427 -15.292 -10.605 1.00 8.97 C ATOM 503 O TRP A 59 -5.009 -15.797 -11.662 1.00 7.17 O ATOM 504 CB TRP A 59 -6.650 -16.681 -8.894 1.00 7.02 C ATOM 505 CG TRP A 59 -5.930 -17.961 -9.274 1.00 8.75 C ATOM 506 CD1 TRP A 59 -6.496 -19.120 -9.740 1.00 7.58 C ATOM 507 CD2 TRP A 59 -4.508 -18.215 -9.200 1.00 5.84 C ATOM 508 NE1 TRP A 59 -5.518 -20.064 -9.978 1.00 7.17 N ATOM 509 CE2 TRP A 59 -4.295 -19.539 -9.637 1.00 6.41 C ATOM 510 CE3 TRP A 59 -3.412 -17.452 -8.787 1.00 7.78 C ATOM 511 CZ2 TRP A 59 -3.007 -20.110 -9.699 1.00 7.66 C ATOM 512 CZ3 TRP A 59 -2.163 -17.996 -8.842 1.00 9.37 C ATOM 513 CH2 TRP A 59 -1.957 -19.327 -9.289 1.00 9.29 C ATOM 514 HE1 TRP A 59 -5.681 -21.020 -10.355 1.00 0.00 H ATOM 515 H TRP A 59 -7.369 -16.990 -11.621 1.00 0.00 H ATOM 516 N GLU A 60 -4.738 -14.383 -9.924 1.00 6.31 N ATOM 517 CA GLU A 60 -3.384 -14.058 -10.335 1.00 6.98 C ATOM 518 C GLU A 60 -2.610 -13.592 -9.119 1.00 5.97 C ATOM 519 O GLU A 60 -3.177 -13.105 -8.137 1.00 6.23 O ATOM 520 CB GLU A 60 -3.356 -12.962 -11.418 1.00 7.83 C ATOM 521 CG GLU A 60 -3.795 -11.615 -10.929 1.00 7.89 C ATOM 522 CD GLU A 60 -3.742 -10.538 -11.985 1.00 16.97 C ATOM 523 OE1 GLU A 60 -2.796 -10.544 -12.806 1.00 17.21 O ATOM 524 OE2 GLU A 60 -4.638 -9.674 -11.971 1.00 17.46 O ATOM 525 H GLU A 60 -5.165 -13.908 -9.103 1.00 0.00 H ATOM 526 N VAL A 61 -1.296 -13.712 -9.227 1.00 5.60 N ATOM 527 CA VAL A 61 -0.338 -13.146 -8.275 1.00 2.73 C ATOM 528 C VAL A 61 0.356 -12.002 -9.011 1.00 4.01 C ATOM 529 O VAL A 61 0.988 -12.228 -10.060 1.00 6.85 O ATOM 530 CB VAL A 61 0.667 -14.216 -7.813 1.00 5.67 C ATOM 531 CG1 VAL A 61 1.822 -13.592 -7.015 1.00 7.42 C ATOM 532 CG2 VAL A 61 -0.046 -15.281 -6.961 1.00 9.45 C ATOM 533 H VAL A 61 -0.920 -14.242 -10.039 1.00 0.00 H ATOM 534 N ASN A 62 0.243 -10.774 -8.481 1.00 6.41 N ATOM 535 CA ASN A 62 0.763 -9.634 -9.220 1.00 7.91 C ATOM 536 C ASN A 62 1.188 -8.526 -8.263 1.00 7.76 C ATOM 537 O ASN A 62 0.810 -8.511 -7.087 1.00 8.88 O ATOM 538 CB ASN A 62 -0.277 -9.102 -10.227 1.00 11.35 C ATOM 539 CG ASN A 62 0.376 -8.479 -11.471 1.00 16.13 C ATOM 540 OD1 ASN A 62 1.381 -7.777 -11.376 1.00 38.17 O ATOM 541 ND2 ASN A 62 -0.187 -8.746 -12.631 1.00 28.57 N ATOM 542 HD22 ASN A 62 -1.037 -9.344 -12.671 1.00 0.00 H ATOM 543 HD21 ASN A 62 0.218 -8.359 -13.507 1.00 0.00 H ATOM 544 H ASN A 62 -0.210 -10.639 -7.555 1.00 0.00 H ATOM 545 N LEU A 63 1.952 -7.580 -8.808 1.00 8.96 N ATOM 546 CA LEU A 63 2.223 -6.321 -8.129 1.00 10.87 C ATOM 547 C LEU A 63 0.911 -5.600 -7.822 1.00 14.94 C ATOM 548 O LEU A 63 -0.074 -5.750 -8.558 1.00 13.74 O ATOM 549 CB LEU A 63 3.082 -5.415 -9.018 1.00 12.83 C ATOM 550 CG LEU A 63 4.461 -5.919 -9.430 1.00 14.43 C ATOM 551 CD1 LEU A 63 5.091 -5.095 -10.557 1.00 18.52 C ATOM 552 CD2 LEU A 63 5.344 -5.887 -8.204 1.00 14.77 C ATOM 553 H LEU A 63 2.367 -7.746 -9.747 1.00 0.00 H ATOM 554 N PRO A 64 0.881 -4.773 -6.777 1.00 10.85 N ATOM 555 CA PRO A 64 -0.312 -3.954 -6.521 1.00 10.65 C ATOM 556 C PRO A 64 -0.533 -2.907 -7.608 1.00 12.04 C ATOM 557 O PRO A 64 0.308 -2.651 -8.476 1.00 14.10 O ATOM 558 CB PRO A 64 -0.017 -3.310 -5.167 1.00 15.38 C ATOM 559 CG PRO A 64 1.476 -3.234 -5.131 1.00 15.53 C ATOM 560 CD PRO A 64 1.941 -4.520 -5.785 1.00 12.39 C ATOM 561 N ALA A 65 -1.719 -2.300 -7.545 1.00 16.18 N ATOM 562 CA ALA A 65 -2.105 -1.271 -8.506 1.00 22.56 C ATOM 563 C ALA A 65 -1.093 -0.132 -8.521 1.00 16.89 C ATOM 564 O ALA A 65 -0.666 0.345 -7.462 1.00 17.66 O ATOM 565 CB ALA A 65 -3.490 -0.730 -8.150 1.00 20.66 C ATOM 566 H ALA A 65 -2.386 -2.566 -6.792 1.00 0.00 H ATOM 567 N GLU A 66 -0.721 0.316 -9.728 1.00 18.42 N ATOM 568 CA GLU A 66 0.334 1.323 -9.834 1.00 17.10 C ATOM 569 C GLU A 66 -0.172 2.708 -9.441 1.00 22.88 C ATOM 570 O GLU A 66 0.576 3.511 -8.870 1.00 30.28 O ATOM 571 CB GLU A 66 0.903 1.342 -11.252 1.00 36.51 C ATOM 572 CG GLU A 66 1.954 2.414 -11.481 1.00 48.14 C ATOM 573 CD GLU A 66 2.383 2.505 -12.931 1.00 65.21 C ATOM 574 OE1 GLU A 66 2.804 1.468 -13.493 1.00 61.40 O ATOM 575 OE2 GLU A 66 2.289 3.613 -13.507 1.00 64.04 O ATOM 576 H GLU A 66 -1.181 -0.051 -10.586 1.00 0.00 H ATOM 577 N GLU A 67 -1.426 3.009 -9.740 1.00 19.75 N ATOM 578 CA GLU A 67 -2.013 4.306 -9.435 1.00 27.62 C ATOM 579 C GLU A 67 -2.813 4.197 -8.147 1.00 22.09 C ATOM 580 O GLU A 67 -3.540 3.222 -7.945 1.00 19.34 O ATOM 581 CB GLU A 67 -2.909 4.784 -10.574 1.00 21.75 C ATOM 582 CG GLU A 67 -2.172 5.044 -11.888 1.00 30.38 C ATOM 583 CD GLU A 67 -1.315 6.297 -11.839 1.00 41.29 C ATOM 584 OE1 GLU A 67 -1.801 7.331 -11.325 1.00 33.34 O ATOM 585 OE2 GLU A 67 -0.163 6.253 -12.327 1.00 47.35 O ATOM 586 H GLU A 67 -2.014 2.292 -10.211 1.00 0.00 H ATOM 587 N VAL A 68 -2.667 5.186 -7.273 1.00 16.62 N ATOM 588 CA VAL A 68 -3.371 5.153 -5.991 1.00 14.49 C ATOM 589 C VAL A 68 -4.054 6.505 -5.785 1.00 19.03 C ATOM 590 O VAL A 68 -3.584 7.524 -6.316 1.00 18.25 O ATOM 591 CB VAL A 68 -2.425 4.792 -4.830 1.00 17.17 C ATOM 592 CG1 VAL A 68 -1.833 3.396 -5.032 1.00 23.02 C ATOM 593 CG2 VAL A 68 -1.333 5.815 -4.676 1.00 21.09 C ATOM 594 H VAL A 68 -2.048 5.990 -7.501 1.00 0.00 H ATOM 595 N PRO A 69 -5.197 6.564 -5.079 1.00 15.15 N ATOM 596 CA PRO A 69 -5.838 5.394 -4.466 1.00 12.97 C ATOM 597 C PRO A 69 -6.485 4.494 -5.519 1.00 12.60 C ATOM 598 O PRO A 69 -6.991 4.984 -6.511 1.00 15.29 O ATOM 599 CB PRO A 69 -6.888 6.020 -3.539 1.00 13.13 C ATOM 600 CG PRO A 69 -7.289 7.286 -4.251 1.00 16.09 C ATOM 601 CD PRO A 69 -6.008 7.791 -4.915 1.00 13.93 C ATOM 602 N PRO A 70 -6.428 3.185 -5.307 1.00 19.39 N ATOM 603 CA PRO A 70 -6.972 2.252 -6.295 1.00 18.45 C ATOM 604 C PRO A 70 -8.484 2.333 -6.340 1.00 13.50 C ATOM 605 O PRO A 70 -9.138 2.709 -5.367 1.00 15.68 O ATOM 606 CB PRO A 70 -6.515 0.886 -5.775 1.00 24.99 C ATOM 607 CG PRO A 70 -6.495 1.093 -4.279 1.00 30.59 C ATOM 608 CD PRO A 70 -5.989 2.502 -4.076 1.00 26.93 C ATOM 609 N GLU A 71 -9.035 1.926 -7.486 1.00 16.84 N ATOM 610 CA GLU A 71 -10.483 1.963 -7.656 1.00 20.58 C ATOM 611 C GLU A 71 -11.176 1.056 -6.651 1.00 22.23 C ATOM 612 O GLU A 71 -12.202 1.431 -6.074 1.00 37.34 O ATOM 613 CB GLU A 71 -10.855 1.578 -9.086 1.00 28.15 C ATOM 614 CG GLU A 71 -9.923 2.159 -10.131 1.00 47.99 C ATOM 615 CD GLU A 71 -10.499 2.069 -11.529 1.00 58.82 C ATOM 616 OE1 GLU A 71 -11.038 0.998 -11.881 1.00 61.98 O ATOM 617 OE2 GLU A 71 -10.423 3.071 -12.272 1.00 64.63 O ATOM 618 H GLU A 71 -8.430 1.582 -8.259 1.00 0.00 H ATOM 619 N LEU A 72 -10.613 -0.119 -6.397 1.00 15.46 N ATOM 620 CA LEU A 72 -11.151 -1.072 -5.447 1.00 13.03 C ATOM 621 C LEU A 72 -10.217 -1.222 -4.256 1.00 14.21 C ATOM 622 O LEU A 72 -9.005 -1.002 -4.384 1.00 13.37 O ATOM 623 CB LEU A 72 -11.325 -2.459 -6.091 1.00 13.07 C ATOM 624 CG LEU A 72 -12.383 -2.677 -7.158 1.00 28.51 C ATOM 625 CD1 LEU A 72 -12.472 -4.179 -7.427 1.00 27.08 C ATOM 626 CD2 LEU A 72 -13.692 -2.104 -6.684 1.00 29.78 C ATOM 627 H LEU A 72 -9.741 -0.368 -6.906 1.00 0.00 H ATOM 628 N PRO A 73 -10.741 -1.633 -3.093 1.00 10.76 N ATOM 629 CA PRO A 73 -9.870 -2.108 -2.014 1.00 8.20 C ATOM 630 C PRO A 73 -8.861 -3.106 -2.561 1.00 8.12 C ATOM 631 O PRO A 73 -9.156 -3.887 -3.469 1.00 10.70 O ATOM 632 CB PRO A 73 -10.838 -2.765 -1.024 1.00 11.98 C ATOM 633 CG PRO A 73 -12.166 -2.050 -1.261 1.00 11.55 C ATOM 634 CD PRO A 73 -12.174 -1.755 -2.751 1.00 10.28 C ATOM 635 N GLU A 74 -7.659 -3.075 -1.994 1.00 11.09 N ATOM 636 CA GLU A 74 -6.569 -3.898 -2.482 1.00 11.98 C ATOM 637 C GLU A 74 -6.265 -5.045 -1.523 1.00 11.27 C ATOM 638 O GLU A 74 -6.443 -4.920 -0.305 1.00 9.96 O ATOM 639 CB GLU A 74 -5.306 -3.053 -2.691 1.00 15.17 C ATOM 640 CG GLU A 74 -5.335 -2.233 -3.975 1.00 22.75 C ATOM 641 CD GLU A 74 -5.042 -3.057 -5.229 1.00 26.43 C ATOM 642 OE1 GLU A 74 -3.913 -3.574 -5.358 1.00 22.84 O ATOM 643 OE2 GLU A 74 -5.931 -3.171 -6.099 1.00 33.37 O ATOM 644 H GLU A 74 -7.497 -2.446 -1.182 1.00 0.00 H ATOM 645 N PRO A 75 -5.808 -6.178 -2.049 1.00 8.20 N ATOM 646 CA PRO A 75 -5.467 -7.330 -1.193 1.00 6.61 C ATOM 647 C PRO A 75 -4.221 -7.040 -0.370 1.00 11.55 C ATOM 648 O PRO A 75 -3.509 -6.056 -0.588 1.00 11.28 O ATOM 649 CB PRO A 75 -5.181 -8.464 -2.183 1.00 9.04 C ATOM 650 CG PRO A 75 -5.417 -7.912 -3.538 1.00 13.87 C ATOM 651 CD PRO A 75 -5.528 -6.425 -3.472 1.00 12.36 C ATOM 652 N ALA A 76 -3.945 -7.945 0.571 1.00 8.38 N ATOM 653 CA ALA A 76 -2.734 -7.876 1.378 1.00 6.52 C ATOM 654 C ALA A 76 -1.491 -7.857 0.492 1.00 9.66 C ATOM 655 O ALA A 76 -1.378 -8.632 -0.461 1.00 9.53 O ATOM 656 CB ALA A 76 -2.669 -9.067 2.330 1.00 8.33 C ATOM 657 H ALA A 76 -4.615 -8.724 0.733 1.00 0.00 H ATOM 658 N LEU A 77 -0.560 -6.977 0.827 1.00 9.82 N ATOM 659 CA LEU A 77 0.622 -6.686 0.033 1.00 9.33 C ATOM 660 C LEU A 77 1.829 -7.476 0.531 1.00 9.54 C ATOM 661 O LEU A 77 2.056 -7.571 1.740 1.00 12.26 O ATOM 662 CB LEU A 77 0.918 -5.187 0.151 1.00 14.66 C ATOM 663 CG LEU A 77 2.053 -4.523 -0.614 1.00 18.92 C ATOM 664 CD1 LEU A 77 1.761 -4.683 -2.068 1.00 14.99 C ATOM 665 CD2 LEU A 77 2.160 -3.036 -0.242 1.00 23.92 C ATOM 666 H LEU A 77 -0.683 -6.458 1.720 1.00 0.00 H ATOM 667 N GLY A 78 2.611 -8.032 -0.394 1.00 7.63 N ATOM 668 CA GLY A 78 3.847 -8.672 0.026 1.00 11.23 C ATOM 669 C GLY A 78 3.679 -10.030 0.676 1.00 8.40 C ATOM 670 O GLY A 78 4.526 -10.430 1.492 1.00 8.75 O ATOM 671 H GLY A 78 2.342 -8.008 -1.398 1.00 0.00 H ATOM 672 N ILE A 79 2.628 -10.782 0.308 1.00 8.58 N ATOM 673 CA ILE A 79 2.438 -12.090 0.927 1.00 6.33 C ATOM 674 C ILE A 79 3.601 -13.013 0.597 1.00 9.17 C ATOM 675 O ILE A 79 3.895 -13.933 1.367 1.00 9.98 O ATOM 676 CB ILE A 79 1.077 -12.711 0.520 1.00 6.46 C ATOM 677 CG1 ILE A 79 1.003 -12.907 -0.996 1.00 9.47 C ATOM 678 CG2 ILE A 79 -0.026 -11.789 0.966 1.00 10.94 C ATOM 679 CD1 ILE A 79 -0.243 -13.697 -1.479 1.00 8.01 C ATOM 680 H ILE A 79 1.958 -10.436 -0.409 1.00 0.00 H ATOM 681 N ASN A 80 4.309 -12.765 -0.511 1.00 6.43 N ATOM 682 CA ASN A 80 5.447 -13.601 -0.866 1.00 7.78 C ATOM 683 C ASN A 80 6.604 -13.458 0.111 1.00 8.03 C ATOM 684 O ASN A 80 7.422 -14.377 0.232 1.00 9.15 O ATOM 685 CB ASN A 80 5.933 -13.283 -2.286 1.00 7.01 C ATOM 686 CG ASN A 80 6.229 -11.797 -2.515 1.00 8.11 C ATOM 687 OD1 ASN A 80 5.450 -10.940 -2.156 1.00 7.92 O ATOM 688 ND2 ASN A 80 7.381 -11.504 -3.132 1.00 7.81 N ATOM 689 HD22 ASN A 80 8.023 -12.268 -3.425 1.00 0.00 H ATOM 690 HD21 ASN A 80 7.634 -10.512 -3.318 1.00 0.00 H ATOM 691 H ASN A 80 4.044 -11.968 -1.124 1.00 0.00 H ATOM 692 N PHE A 81 6.709 -12.318 0.801 1.00 7.48 N ATOM 693 CA PHE A 81 7.928 -12.082 1.573 1.00 7.61 C ATOM 694 C PHE A 81 8.119 -13.119 2.672 1.00 11.60 C ATOM 695 O PHE A 81 9.264 -13.462 3.006 1.00 13.69 O ATOM 696 CB PHE A 81 7.906 -10.690 2.202 1.00 10.39 C ATOM 697 CG PHE A 81 7.893 -9.553 1.215 1.00 7.43 C ATOM 698 CD1 PHE A 81 8.285 -9.724 -0.103 1.00 9.02 C ATOM 699 CD2 PHE A 81 7.542 -8.283 1.648 1.00 10.25 C ATOM 700 CE1 PHE A 81 8.298 -8.633 -0.986 1.00 11.33 C ATOM 701 CE2 PHE A 81 7.569 -7.204 0.783 1.00 11.04 C ATOM 702 CZ PHE A 81 7.926 -7.386 -0.529 1.00 9.87 C ATOM 703 H PHE A 81 5.942 -11.616 0.789 1.00 0.00 H ATOM 704 N ALA A 82 7.026 -13.608 3.256 1.00 12.64 N ATOM 705 CA ALA A 82 7.083 -14.518 4.395 1.00 18.15 C ATOM 706 C ALA A 82 7.042 -15.992 4.006 1.00 17.18 C ATOM 707 O ALA A 82 7.072 -16.857 4.890 1.00 14.11 O ATOM 708 CB ALA A 82 5.913 -14.216 5.338 1.00 29.74 C ATOM 709 H ALA A 82 6.095 -13.330 2.885 1.00 0.00 H ATOM 710 N ARG A 83 6.980 -16.298 2.712 1.00 9.95 N ATOM 711 CA ARG A 83 6.689 -17.665 2.284 1.00 9.21 C ATOM 712 C ARG A 83 7.682 -18.683 2.833 1.00 13.42 C ATOM 713 O ARG A 83 7.278 -19.780 3.231 1.00 13.97 O ATOM 714 CB ARG A 83 6.668 -17.747 0.758 1.00 8.48 C ATOM 715 CG ARG A 83 6.032 -19.041 0.268 1.00 10.83 C ATOM 716 CD ARG A 83 6.407 -19.315 -1.148 1.00 7.71 C ATOM 717 NE ARG A 83 7.849 -19.608 -1.284 1.00 10.05 N ATOM 718 CZ ARG A 83 8.469 -19.799 -2.450 1.00 14.00 C ATOM 719 NH1 ARG A 83 7.794 -19.706 -3.605 1.00 9.72 N ATOM 720 NH2 ARG A 83 9.788 -20.051 -2.469 1.00 10.57 N ATOM 721 HE ARG A 83 8.417 -19.669 -0.415 1.00 0.00 H ATOM 722 HH12 ARG A 83 8.286 -19.857 -4.509 1.00 0.00 H ATOM 723 HH11 ARG A 83 6.778 -19.483 -3.597 1.00 0.00 H ATOM 724 HH22 ARG A 83 10.276 -20.201 -3.375 1.00 0.00 H ATOM 725 HH21 ARG A 83 10.322 -20.097 -1.577 1.00 0.00 H ATOM 726 H ARG A 83 7.140 -15.558 1.999 1.00 0.00 H ATOM 727 N ASP A 84 8.980 -18.366 2.818 1.00 10.71 N ATOM 728 CA ASP A 84 10.005 -19.342 3.178 1.00 10.49 C ATOM 729 C ASP A 84 10.449 -19.199 4.630 1.00 15.44 C ATOM 730 O ASP A 84 11.506 -19.717 5.003 1.00 15.74 O ATOM 731 CB ASP A 84 11.209 -19.221 2.237 1.00 10.63 C ATOM 732 CG ASP A 84 10.920 -19.747 0.854 1.00 10.05 C ATOM 733 OD1 ASP A 84 9.867 -20.423 0.679 1.00 14.45 O ATOM 734 OD2 ASP A 84 11.740 -19.481 -0.037 1.00 13.88 O ATOM 735 H ASP A 84 9.266 -17.404 2.544 1.00 0.00 H ATOM 736 N GLY A 85 9.675 -18.493 5.446 1.00 11.73 N ATOM 737 CA GLY A 85 9.981 -18.328 6.849 1.00 18.83 C ATOM 738 C GLY A 85 8.951 -18.931 7.770 1.00 22.15 C ATOM 739 O GLY A 85 9.023 -18.707 8.987 1.00 20.09 O ATOM 740 H GLY A 85 8.819 -18.043 5.062 1.00 0.00 H ATOM 741 N MET A 86 7.992 -19.689 7.244 1.00 12.45 N ATOM 742 CA MET A 86 6.993 -20.326 8.078 1.00 15.57 C ATOM 743 C MET A 86 6.568 -21.613 7.394 1.00 13.42 C ATOM 744 O MET A 86 6.795 -21.811 6.195 1.00 12.50 O ATOM 745 CB MET A 86 5.802 -19.397 8.350 1.00 19.59 C ATOM 746 CG MET A 86 5.144 -18.822 7.102 1.00 23.02 C ATOM 747 SD MET A 86 4.117 -17.339 7.423 1.00 20.17 S ATOM 748 CE MET A 86 3.059 -17.985 8.661 1.00 17.63 C ATOM 749 H MET A 86 7.959 -19.827 6.214 1.00 0.00 H ATOM 750 N GLN A 87 6.007 -22.522 8.186 1.00 13.53 N ATOM 751 CA GLN A 87 5.516 -23.757 7.606 1.00 11.15 C ATOM 752 C GLN A 87 4.407 -23.450 6.616 1.00 10.73 C ATOM 753 O GLN A 87 3.631 -22.506 6.803 1.00 12.87 O ATOM 754 CB GLN A 87 5.000 -24.698 8.690 1.00 14.52 C ATOM 755 CG GLN A 87 6.106 -25.322 9.546 1.00 14.44 C ATOM 756 CD GLN A 87 5.547 -26.382 10.462 1.00 17.88 C ATOM 757 OE1 GLN A 87 5.110 -27.438 10.003 1.00 25.72 O ATOM 758 NE2 GLN A 87 5.535 -26.100 11.760 1.00 29.95 N ATOM 759 HE22 GLN A 87 5.916 -25.194 12.099 1.00 0.00 H ATOM 760 HE21 GLN A 87 5.144 -26.786 12.438 1.00 0.00 H ATOM 761 H GLN A 87 5.922 -22.349 9.208 1.00 0.00 H ATOM 762 N ARG A 88 4.353 -24.255 5.554 1.00 12.37 N ATOM 763 CA ARG A 88 3.433 -24.005 4.446 1.00 10.98 C ATOM 764 C ARG A 88 1.997 -23.840 4.927 1.00 11.14 C ATOM 765 O ARG A 88 1.286 -22.932 4.483 1.00 10.35 O ATOM 766 CB ARG A 88 3.537 -25.150 3.444 1.00 11.44 C ATOM 767 CG ARG A 88 2.592 -25.062 2.275 1.00 14.23 C ATOM 768 CD ARG A 88 2.596 -26.410 1.571 1.00 19.96 C ATOM 769 NE ARG A 88 1.744 -26.474 0.381 1.00 13.46 N ATOM 770 CZ ARG A 88 2.194 -26.279 -0.851 1.00 19.59 C ATOM 771 NH1 ARG A 88 1.369 -26.383 -1.888 1.00 14.81 N ATOM 772 NH2 ARG A 88 3.469 -25.987 -1.055 1.00 19.43 N ATOM 773 HE ARG A 88 0.733 -26.683 0.509 1.00 0.00 H ATOM 774 HH12 ARG A 88 1.725 -26.229 -2.853 1.00 0.00 H ATOM 775 HH11 ARG A 88 0.368 -26.618 -1.734 1.00 0.00 H ATOM 776 HH22 ARG A 88 3.819 -25.835 -2.022 1.00 0.00 H ATOM 777 HH21 ARG A 88 4.120 -25.910 -0.248 1.00 0.00 H ATOM 778 H ARG A 88 4.982 -25.082 5.513 1.00 0.00 H ATOM 779 N LYS A 89 1.553 -24.709 5.838 1.00 13.48 N ATOM 780 CA LYS A 89 0.159 -24.633 6.289 1.00 12.42 C ATOM 781 C LYS A 89 -0.141 -23.292 6.944 1.00 12.00 C ATOM 782 O LYS A 89 -1.256 -22.760 6.806 1.00 12.91 O ATOM 783 CB LYS A 89 -0.144 -25.789 7.253 1.00 13.19 C ATOM 784 CG LYS A 89 0.714 -25.769 8.512 1.00 19.26 C ATOM 785 CD LYS A 89 0.234 -26.765 9.565 1.00 34.27 C ATOM 786 CE LYS A 89 1.039 -26.624 10.848 1.00 24.23 C ATOM 787 NZ LYS A 89 0.487 -27.468 11.955 1.00 47.55 N ATOM 788 HZ1 LYS A 89 -0.493 -27.180 12.153 1.00 0.00 H ATOM 789 HZ2 LYS A 89 0.505 -28.468 11.669 1.00 0.00 H ATOM 790 HZ3 LYS A 89 1.067 -27.340 12.809 1.00 0.00 H ATOM 791 H LYS A 89 2.190 -25.434 6.225 1.00 0.00 H ATOM 792 N ASP A 90 0.823 -22.740 7.683 1.00 12.79 N ATOM 793 CA ASP A 90 0.642 -21.466 8.366 1.00 13.88 C ATOM 794 C ASP A 90 0.676 -20.301 7.391 1.00 10.97 C ATOM 795 O ASP A 90 -0.054 -19.315 7.574 1.00 12.35 O ATOM 796 CB ASP A 90 1.705 -21.311 9.450 1.00 14.79 C ATOM 797 CG ASP A 90 1.560 -22.350 10.535 1.00 19.99 C ATOM 798 OD1 ASP A 90 0.401 -22.590 10.942 1.00 23.95 O ATOM 799 OD2 ASP A 90 2.584 -22.948 10.951 1.00 20.66 O ATOM 800 H ASP A 90 1.733 -23.235 7.774 1.00 0.00 H ATOM 801 N TRP A 91 1.488 -20.406 6.342 1.00 10.29 N ATOM 802 CA TRP A 91 1.501 -19.345 5.346 1.00 10.03 C ATOM 803 C TRP A 91 0.193 -19.338 4.557 1.00 9.36 C ATOM 804 O TRP A 91 -0.389 -18.268 4.317 1.00 7.44 O ATOM 805 CB TRP A 91 2.717 -19.515 4.426 1.00 10.88 C ATOM 806 CG TRP A 91 2.838 -18.451 3.400 1.00 7.24 C ATOM 807 CD1 TRP A 91 3.246 -17.156 3.597 1.00 6.80 C ATOM 808 CD2 TRP A 91 2.546 -18.572 2.004 1.00 9.78 C ATOM 809 NE1 TRP A 91 3.219 -16.467 2.402 1.00 7.79 N ATOM 810 CE2 TRP A 91 2.786 -17.309 1.416 1.00 7.54 C ATOM 811 CE3 TRP A 91 2.102 -19.625 1.193 1.00 13.18 C ATOM 812 CZ2 TRP A 91 2.615 -17.072 0.057 1.00 7.70 C ATOM 813 CZ3 TRP A 91 1.905 -19.380 -0.162 1.00 12.35 C ATOM 814 CH2 TRP A 91 2.165 -18.103 -0.710 1.00 9.65 C ATOM 815 HE1 TRP A 91 3.485 -15.470 2.272 1.00 0.00 H ATOM 816 H TRP A 91 2.106 -21.236 6.235 1.00 0.00 H ATOM 817 N LEU A 92 -0.290 -20.524 4.159 1.00 7.83 N ATOM 818 CA LEU A 92 -1.539 -20.587 3.414 1.00 7.34 C ATOM 819 C LEU A 92 -2.696 -20.079 4.258 1.00 8.33 C ATOM 820 O LEU A 92 -3.594 -19.404 3.745 1.00 8.74 O ATOM 821 CB LEU A 92 -1.796 -22.017 2.938 1.00 8.30 C ATOM 822 CG LEU A 92 -0.875 -22.499 1.834 1.00 8.63 C ATOM 823 CD1 LEU A 92 -1.157 -23.959 1.583 1.00 10.66 C ATOM 824 CD2 LEU A 92 -1.121 -21.680 0.567 1.00 9.25 C ATOM 825 H LEU A 92 0.227 -21.398 4.382 1.00 0.00 H ATOM 826 N SER A 93 -2.691 -20.376 5.560 1.00 9.43 N ATOM 827 CA SER A 93 -3.760 -19.862 6.414 1.00 8.85 C ATOM 828 C SER A 93 -3.732 -18.338 6.471 1.00 9.17 C ATOM 829 O SER A 93 -4.785 -17.689 6.411 1.00 9.64 O ATOM 830 CB SER A 93 -3.652 -20.457 7.819 1.00 15.72 C ATOM 831 OG SER A 93 -2.465 -20.033 8.455 1.00 19.47 O ATOM 832 HG SER A 93 -1.684 -20.327 7.923 1.00 0.00 H ATOM 833 H SER A 93 -1.935 -20.966 5.962 1.00 0.00 H ATOM 834 N LEU A 94 -2.534 -17.751 6.573 1.00 9.23 N ATOM 835 CA LEU A 94 -2.395 -16.298 6.540 1.00 10.37 C ATOM 836 C LEU A 94 -2.941 -15.723 5.237 1.00 9.59 C ATOM 837 O LEU A 94 -3.681 -14.724 5.231 1.00 9.01 O ATOM 838 CB LEU A 94 -0.916 -15.929 6.692 1.00 13.95 C ATOM 839 CG LEU A 94 -0.553 -14.451 6.588 1.00 27.22 C ATOM 840 CD1 LEU A 94 -1.219 -13.665 7.706 1.00 31.97 C ATOM 841 CD2 LEU A 94 0.958 -14.292 6.636 1.00 37.09 C ATOM 842 H LEU A 94 -1.685 -18.342 6.678 1.00 0.00 H ATOM 843 N VAL A 95 -2.570 -16.338 4.114 1.00 6.12 N ATOM 844 CA VAL A 95 -3.083 -15.850 2.833 1.00 8.15 C ATOM 845 C VAL A 95 -4.606 -15.956 2.799 1.00 9.48 C ATOM 846 O VAL A 95 -5.308 -15.052 2.315 1.00 8.86 O ATOM 847 CB VAL A 95 -2.444 -16.629 1.665 1.00 6.14 C ATOM 848 CG1 VAL A 95 -3.083 -16.199 0.357 1.00 7.49 C ATOM 849 CG2 VAL A 95 -0.932 -16.343 1.580 1.00 7.09 C ATOM 850 H VAL A 95 -1.925 -17.153 4.148 1.00 0.00 H ATOM 851 N ALA A 96 -5.134 -17.081 3.283 1.00 8.66 N ATOM 852 CA ALA A 96 -6.579 -17.331 3.263 1.00 7.66 C ATOM 853 C ALA A 96 -7.337 -16.284 4.070 1.00 9.77 C ATOM 854 O ALA A 96 -8.330 -15.728 3.596 1.00 7.83 O ATOM 855 CB ALA A 96 -6.863 -18.740 3.797 1.00 7.72 C ATOM 856 H ALA A 96 -4.503 -17.802 3.686 1.00 0.00 H ATOM 857 N VAL A 97 -6.875 -15.974 5.284 1.00 8.70 N ATOM 858 CA VAL A 97 -7.619 -15.005 6.089 1.00 8.73 C ATOM 859 C VAL A 97 -7.576 -13.626 5.437 1.00 7.32 C ATOM 860 O VAL A 97 -8.604 -12.951 5.333 1.00 7.51 O ATOM 861 CB VAL A 97 -7.114 -14.958 7.545 1.00 8.90 C ATOM 862 CG1 VAL A 97 -5.643 -14.633 7.619 1.00 12.51 C ATOM 863 CG2 VAL A 97 -7.916 -13.928 8.331 1.00 9.87 C ATOM 864 H VAL A 97 -6.005 -16.412 5.649 1.00 0.00 H ATOM 865 N HIS A 98 -6.411 -13.200 4.950 1.00 5.96 N ATOM 866 CA HIS A 98 -6.362 -11.902 4.286 1.00 4.46 C ATOM 867 C HIS A 98 -7.226 -11.884 3.039 1.00 8.67 C ATOM 868 O HIS A 98 -7.789 -10.839 2.694 1.00 7.54 O ATOM 869 CB HIS A 98 -4.910 -11.533 3.970 1.00 8.37 C ATOM 870 CG HIS A 98 -4.194 -10.996 5.171 1.00 11.97 C ATOM 871 ND1 HIS A 98 -4.412 -9.727 5.662 1.00 14.89 N ATOM 872 CD2 HIS A 98 -3.320 -11.581 6.019 1.00 26.58 C ATOM 873 CE1 HIS A 98 -3.664 -9.536 6.735 1.00 14.87 C ATOM 874 NE2 HIS A 98 -3.008 -10.653 6.987 1.00 17.85 N ATOM 875 H HIS A 98 -5.554 -13.781 5.042 1.00 0.00 H ATOM 876 N SER A 99 -7.340 -13.033 2.368 1.00 6.13 N ATOM 877 CA SER A 99 -8.181 -13.123 1.175 1.00 5.80 C ATOM 878 C SER A 99 -9.658 -13.043 1.540 1.00 6.05 C ATOM 879 O SER A 99 -10.416 -12.357 0.856 1.00 6.49 O ATOM 880 CB SER A 99 -7.844 -14.405 0.412 1.00 8.33 C ATOM 881 OG SER A 99 -6.501 -14.348 -0.102 1.00 7.91 O ATOM 882 HG SER A 99 -5.865 -14.244 0.650 1.00 0.00 H ATOM 883 H SER A 99 -6.825 -13.874 2.698 1.00 0.00 H ATOM 884 N ASP A 100 -10.069 -13.695 2.634 1.00 5.24 N ATOM 885 CA ASP A 100 -11.451 -13.578 3.105 1.00 8.09 C ATOM 886 C ASP A 100 -11.786 -12.125 3.415 1.00 7.34 C ATOM 887 O ASP A 100 -12.858 -11.617 3.043 1.00 7.11 O ATOM 888 CB ASP A 100 -11.644 -14.409 4.374 1.00 8.56 C ATOM 889 CG ASP A 100 -11.663 -15.897 4.113 1.00 11.37 C ATOM 890 OD1 ASP A 100 -12.198 -16.315 3.060 1.00 12.28 O ATOM 891 OD2 ASP A 100 -11.177 -16.633 5.005 1.00 11.63 O ATOM 892 H ASP A 100 -9.398 -14.293 3.157 1.00 0.00 H ATOM 893 N CYS A 101 -10.848 -11.432 4.079 1.00 5.59 N ATOM 894 CA CYS A 101 -11.061 -10.032 4.430 1.00 6.56 C ATOM 895 C CYS A 101 -11.164 -9.164 3.196 1.00 6.80 C ATOM 896 O CYS A 101 -11.996 -8.262 3.143 1.00 8.76 O ATOM 897 CB CYS A 101 -9.936 -9.519 5.326 1.00 6.38 C ATOM 898 SG CYS A 101 -9.974 -10.329 6.953 1.00 10.98 S ATOM 899 H CYS A 101 -9.958 -11.899 4.347 1.00 0.00 H ATOM 900 N TRP A 102 -10.356 -9.457 2.167 1.00 8.06 N ATOM 901 CA TRP A 102 -10.392 -8.670 0.940 1.00 5.20 C ATOM 902 C TRP A 102 -11.707 -8.862 0.201 1.00 6.47 C ATOM 903 O TRP A 102 -12.314 -7.890 -0.273 1.00 6.29 O ATOM 904 CB TRP A 102 -9.191 -9.044 0.057 1.00 5.70 C ATOM 905 CG TRP A 102 -9.201 -8.302 -1.263 1.00 6.08 C ATOM 906 CD1 TRP A 102 -9.015 -6.961 -1.448 1.00 6.38 C ATOM 907 CD2 TRP A 102 -9.444 -8.858 -2.563 1.00 5.82 C ATOM 908 NE1 TRP A 102 -9.099 -6.651 -2.780 1.00 5.99 N ATOM 909 CE2 TRP A 102 -9.372 -7.794 -3.492 1.00 4.53 C ATOM 910 CE3 TRP A 102 -9.731 -10.145 -3.033 1.00 6.99 C ATOM 911 CZ2 TRP A 102 -9.567 -7.970 -4.865 1.00 8.36 C ATOM 912 CZ3 TRP A 102 -9.896 -10.329 -4.417 1.00 7.16 C ATOM 913 CH2 TRP A 102 -9.832 -9.242 -5.314 1.00 5.66 C ATOM 914 HE1 TRP A 102 -8.976 -5.702 -3.187 1.00 0.00 H ATOM 915 H TRP A 102 -9.695 -10.256 2.245 1.00 0.00 H ATOM 916 N LEU A 103 -12.167 -10.115 0.094 1.00 7.30 N ATOM 917 CA LEU A 103 -13.442 -10.370 -0.573 1.00 7.58 C ATOM 918 C LEU A 103 -14.564 -9.589 0.090 1.00 7.11 C ATOM 919 O LEU A 103 -15.415 -9.006 -0.584 1.00 7.53 O ATOM 920 CB LEU A 103 -13.771 -11.861 -0.533 1.00 5.64 C ATOM 921 CG LEU A 103 -12.884 -12.711 -1.427 1.00 8.95 C ATOM 922 CD1 LEU A 103 -13.090 -14.178 -1.059 1.00 10.00 C ATOM 923 CD2 LEU A 103 -13.217 -12.471 -2.924 1.00 11.96 C ATOM 924 H LEU A 103 -11.617 -10.906 0.485 1.00 0.00 H ATOM 925 N LEU A 104 -14.591 -9.591 1.420 1.00 6.04 N ATOM 926 CA LEU A 104 -15.603 -8.825 2.148 1.00 7.46 C ATOM 927 C LEU A 104 -15.477 -7.334 1.854 1.00 6.49 C ATOM 928 O LEU A 104 -16.474 -6.647 1.591 1.00 8.82 O ATOM 929 CB LEU A 104 -15.448 -9.095 3.649 1.00 7.87 C ATOM 930 CG LEU A 104 -16.587 -8.652 4.560 1.00 7.91 C ATOM 931 CD1 LEU A 104 -17.867 -9.389 4.202 1.00 9.68 C ATOM 932 CD2 LEU A 104 -16.213 -8.952 5.988 1.00 6.07 C ATOM 933 H LEU A 104 -13.885 -10.143 1.948 1.00 0.00 H ATOM 934 N SER A 105 -14.244 -6.818 1.902 1.00 6.12 N ATOM 935 CA SER A 105 -14.013 -5.406 1.635 1.00 6.97 C ATOM 936 C SER A 105 -14.496 -5.015 0.246 1.00 6.95 C ATOM 937 O SER A 105 -15.132 -3.965 0.074 1.00 7.02 O ATOM 938 CB SER A 105 -12.526 -5.100 1.806 1.00 10.03 C ATOM 939 OG SER A 105 -12.300 -3.709 1.736 1.00 9.53 O ATOM 940 HG SER A 105 -11.333 -3.527 1.848 1.00 0.00 H ATOM 941 H SER A 105 -13.439 -7.434 2.133 1.00 0.00 H ATOM 942 N VAL A 106 -14.215 -5.851 -0.764 1.00 6.25 N ATOM 943 CA VAL A 106 -14.633 -5.503 -2.116 1.00 5.69 C ATOM 944 C VAL A 106 -16.153 -5.456 -2.211 1.00 6.86 C ATOM 945 O VAL A 106 -16.732 -4.513 -2.759 1.00 6.43 O ATOM 946 CB VAL A 106 -14.047 -6.503 -3.120 1.00 4.62 C ATOM 947 CG1 VAL A 106 -14.673 -6.310 -4.485 1.00 8.30 C ATOM 948 CG2 VAL A 106 -12.524 -6.337 -3.199 1.00 7.81 C ATOM 949 H VAL A 106 -13.704 -6.739 -0.584 1.00 0.00 H ATOM 950 N SER A 107 -16.819 -6.473 -1.665 1.00 6.08 N ATOM 951 CA SER A 107 -18.277 -6.524 -1.799 1.00 5.05 C ATOM 952 C SER A 107 -18.934 -5.341 -1.108 1.00 5.82 C ATOM 953 O SER A 107 -19.901 -4.763 -1.626 1.00 7.38 O ATOM 954 CB SER A 107 -18.823 -7.822 -1.233 1.00 8.60 C ATOM 955 OG SER A 107 -18.409 -8.911 -2.036 1.00 10.99 O ATOM 956 HG SER A 107 -18.749 -8.788 -2.958 1.00 0.00 H ATOM 957 H SER A 107 -16.311 -7.220 -1.151 1.00 0.00 H ATOM 958 N PHE A 108 -18.433 -4.971 0.075 1.00 5.91 N ATOM 959 CA PHE A 108 -19.084 -3.875 0.785 1.00 6.27 C ATOM 960 C PHE A 108 -18.612 -2.512 0.296 1.00 7.93 C ATOM 961 O PHE A 108 -19.299 -1.504 0.532 1.00 9.19 O ATOM 962 CB PHE A 108 -18.934 -4.080 2.299 1.00 8.79 C ATOM 963 CG PHE A 108 -19.934 -5.071 2.821 1.00 6.10 C ATOM 964 CD1 PHE A 108 -21.243 -4.682 3.124 1.00 8.42 C ATOM 965 CD2 PHE A 108 -19.612 -6.421 2.863 1.00 8.10 C ATOM 966 CE1 PHE A 108 -22.163 -5.630 3.511 1.00 11.06 C ATOM 967 CE2 PHE A 108 -20.518 -7.360 3.268 1.00 8.92 C ATOM 968 CZ PHE A 108 -21.807 -6.966 3.590 1.00 9.95 C ATOM 969 H PHE A 108 -17.603 -5.451 0.478 1.00 0.00 H ATOM 970 N TYR A 109 -17.556 -2.478 -0.515 1.00 6.80 N ATOM 971 CA TYR A 109 -17.266 -1.277 -1.288 1.00 5.62 C ATOM 972 C TYR A 109 -18.343 -1.065 -2.344 1.00 7.76 C ATOM 973 O TYR A 109 -18.934 0.017 -2.450 1.00 8.34 O ATOM 974 CB TYR A 109 -15.881 -1.398 -1.938 1.00 4.53 C ATOM 975 CG TYR A 109 -15.522 -0.229 -2.797 1.00 7.53 C ATOM 976 CD1 TYR A 109 -14.945 0.907 -2.254 1.00 11.28 C ATOM 977 CD2 TYR A 109 -15.732 -0.290 -4.163 1.00 11.32 C ATOM 978 CE1 TYR A 109 -14.613 1.995 -3.072 1.00 17.98 C ATOM 979 CE2 TYR A 109 -15.413 0.771 -4.976 1.00 18.73 C ATOM 980 CZ TYR A 109 -14.858 1.905 -4.426 1.00 22.38 C ATOM 981 OH TYR A 109 -14.543 2.950 -5.271 1.00 38.25 O ATOM 982 HH TYR A 109 -13.885 2.642 -5.944 1.00 0.00 H ATOM 983 H TYR A 109 -16.937 -3.310 -0.597 1.00 0.00 H ATOM 984 N PHE A 110 -18.561 -2.086 -3.178 1.00 7.36 N ATOM 985 CA PHE A 110 -19.622 -2.008 -4.174 1.00 5.78 C ATOM 986 C PHE A 110 -20.962 -1.745 -3.505 1.00 8.99 C ATOM 987 O PHE A 110 -21.824 -1.047 -4.060 1.00 10.00 O ATOM 988 CB PHE A 110 -19.718 -3.316 -4.967 1.00 5.94 C ATOM 989 CG PHE A 110 -18.564 -3.568 -5.906 1.00 8.39 C ATOM 990 CD1 PHE A 110 -18.027 -2.545 -6.686 1.00 8.21 C ATOM 991 CD2 PHE A 110 -18.049 -4.851 -6.033 1.00 5.99 C ATOM 992 CE1 PHE A 110 -16.962 -2.804 -7.557 1.00 10.36 C ATOM 993 CE2 PHE A 110 -16.989 -5.125 -6.891 1.00 8.03 C ATOM 994 CZ PHE A 110 -16.452 -4.106 -7.665 1.00 9.97 C ATOM 995 H PHE A 110 -17.971 -2.940 -3.116 1.00 0.00 H ATOM 996 N GLY A 111 -21.146 -2.290 -2.298 1.00 7.00 N ATOM 997 CA GLY A 111 -22.392 -2.200 -1.547 1.00 7.01 C ATOM 998 C GLY A 111 -22.548 -0.955 -0.689 1.00 7.33 C ATOM 999 O GLY A 111 -23.433 -0.903 0.170 1.00 9.99 O ATOM 1000 H GLY A 111 -20.353 -2.809 -1.870 1.00 0.00 H ATOM 1001 N ALA A 112 -21.731 0.068 -0.927 1.00 8.16 N ATOM 1002 CA ALA A 112 -21.774 1.245 -0.048 1.00 9.65 C ATOM 1003 C ALA A 112 -23.164 1.867 0.003 1.00 7.27 C ATOM 1004 O ALA A 112 -23.593 2.365 1.057 1.00 9.61 O ATOM 1005 CB ALA A 112 -20.759 2.291 -0.518 1.00 12.99 C ATOM 1006 H ALA A 112 -21.068 0.035 -1.728 1.00 0.00 H ATOM 1007 N ARG A 113 -23.861 1.866 -1.123 1.00 8.15 N ATOM 1008 CA ARG A 113 -25.160 2.515 -1.234 1.00 10.13 C ATOM 1009 C ARG A 113 -26.318 1.615 -0.846 1.00 9.79 C ATOM 1010 O ARG A 113 -27.458 2.086 -0.860 1.00 14.51 O ATOM 1011 CB ARG A 113 -25.357 3.032 -2.657 1.00 13.52 C ATOM 1012 CG ARG A 113 -24.383 4.139 -3.015 1.00 16.45 C ATOM 1013 CD ARG A 113 -24.338 4.367 -4.523 1.00 18.73 C ATOM 1014 NE ARG A 113 -23.151 5.131 -4.874 1.00 29.26 N ATOM 1015 CZ ARG A 113 -21.941 4.591 -5.008 1.00 45.51 C ATOM 1016 NH1 ARG A 113 -21.773 3.284 -4.819 1.00 37.17 N ATOM 1017 NH2 ARG A 113 -20.897 5.355 -5.313 1.00 41.86 N ATOM 1018 HE ARG A 113 -23.253 6.154 -5.029 1.00 0.00 H ATOM 1019 HH12 ARG A 113 -20.829 2.861 -4.923 1.00 0.00 H ATOM 1020 HH11 ARG A 113 -22.586 2.686 -4.567 1.00 0.00 H ATOM 1021 HH22 ARG A 113 -19.954 4.929 -5.417 1.00 0.00 H ATOM 1022 HH21 ARG A 113 -21.023 6.378 -5.448 1.00 0.00 H ATOM 1023 H ARG A 113 -23.467 1.385 -1.957 1.00 0.00 H ATOM 1024 N LEU A 114 -26.066 0.349 -0.515 1.00 8.69 N ATOM 1025 CA LEU A 114 -27.121 -0.504 0.022 1.00 7.84 C ATOM 1026 C LEU A 114 -27.541 -0.005 1.390 1.00 10.29 C ATOM 1027 O LEU A 114 -26.722 0.482 2.168 1.00 9.57 O ATOM 1028 CB LEU A 114 -26.642 -1.948 0.177 1.00 5.76 C ATOM 1029 CG LEU A 114 -26.181 -2.637 -1.106 1.00 9.15 C ATOM 1030 CD1 LEU A 114 -25.611 -3.992 -0.744 1.00 10.67 C ATOM 1031 CD2 LEU A 114 -27.337 -2.755 -2.120 1.00 12.92 C ATOM 1032 H LEU A 114 -25.108 -0.035 -0.641 1.00 0.00 H ATOM 1033 N ASN A 115 -28.820 -0.179 1.706 1.00 9.61 N ATOM 1034 CA ASN A 115 -29.291 0.202 3.025 1.00 10.08 C ATOM 1035 C ASN A 115 -28.939 -0.884 4.050 1.00 13.55 C ATOM 1036 O ASN A 115 -28.388 -1.934 3.721 1.00 9.63 O ATOM 1037 CB ASN A 115 -30.791 0.531 2.985 1.00 11.44 C ATOM 1038 CG ASN A 115 -31.674 -0.677 2.661 1.00 10.74 C ATOM 1039 OD1 ASN A 115 -31.407 -1.793 3.090 1.00 12.41 O ATOM 1040 ND2 ASN A 115 -32.756 -0.439 1.907 1.00 17.46 N ATOM 1041 HD22 ASN A 115 -32.948 0.523 1.562 1.00 0.00 H ATOM 1042 HD21 ASN A 115 -33.404 -1.216 1.667 1.00 0.00 H ATOM 1043 H ASN A 115 -29.480 -0.586 1.012 1.00 0.00 H ATOM 1044 N ARG A 116 -29.255 -0.607 5.318 1.00 10.17 N ATOM 1045 CA ARG A 116 -28.895 -1.505 6.415 1.00 9.71 C ATOM 1046 C ARG A 116 -29.446 -2.914 6.212 1.00 9.36 C ATOM 1047 O ARG A 116 -28.734 -3.904 6.426 1.00 8.90 O ATOM 1048 CB ARG A 116 -29.404 -0.900 7.722 1.00 15.93 C ATOM 1049 CG ARG A 116 -29.141 -1.689 8.940 1.00 16.99 C ATOM 1050 CD ARG A 116 -29.671 -0.918 10.151 1.00 26.97 C ATOM 1051 NE ARG A 116 -28.951 0.345 10.330 1.00 31.78 N ATOM 1052 CZ ARG A 116 -29.173 1.192 11.331 1.00 44.99 C ATOM 1053 NH1 ARG A 116 -30.088 0.894 12.244 1.00 30.37 N ATOM 1054 NH2 ARG A 116 -28.476 2.326 11.429 1.00 28.95 N ATOM 1055 HE ARG A 116 -28.222 0.595 9.632 1.00 0.00 H ATOM 1056 HH12 ARG A 116 -30.270 1.549 13.031 1.00 0.00 H ATOM 1057 HH11 ARG A 116 -30.624 0.005 12.173 1.00 0.00 H ATOM 1058 HH22 ARG A 116 -28.657 2.982 12.216 1.00 0.00 H ATOM 1059 HH21 ARG A 116 -27.751 2.554 10.719 1.00 0.00 H ATOM 1060 H ARG A 116 -29.771 0.271 5.531 1.00 0.00 H ATOM 1061 N ASN A 117 -30.707 -3.024 5.795 1.00 10.65 N ATOM 1062 CA ASN A 117 -31.314 -4.333 5.575 1.00 9.75 C ATOM 1063 C ASN A 117 -30.641 -5.078 4.430 1.00 10.17 C ATOM 1064 O ASN A 117 -30.412 -6.290 4.524 1.00 9.55 O ATOM 1065 CB ASN A 117 -32.805 -4.155 5.285 1.00 13.14 C ATOM 1066 CG ASN A 117 -33.594 -5.432 5.491 1.00 34.90 C ATOM 1067 OD1 ASN A 117 -33.952 -6.118 4.529 1.00 38.32 O ATOM 1068 ND2 ASN A 117 -33.877 -5.756 6.751 1.00 31.88 N ATOM 1069 HD22 ASN A 117 -33.554 -5.147 7.530 1.00 0.00 H ATOM 1070 HD21 ASN A 117 -34.421 -6.618 6.957 1.00 0.00 H ATOM 1071 H ASN A 117 -31.267 -2.164 5.624 1.00 0.00 H ATOM 1072 N GLU A 118 -30.340 -4.365 3.341 1.00 8.38 N ATOM 1073 CA GLU A 118 -29.661 -4.960 2.199 1.00 7.52 C ATOM 1074 C GLU A 118 -28.268 -5.419 2.580 1.00 6.14 C ATOM 1075 O GLU A 118 -27.812 -6.473 2.126 1.00 8.52 O ATOM 1076 CB GLU A 118 -29.594 -3.951 1.055 1.00 6.03 C ATOM 1077 CG GLU A 118 -30.953 -3.726 0.432 1.00 6.94 C ATOM 1078 CD GLU A 118 -30.990 -2.607 -0.564 1.00 17.55 C ATOM 1079 OE1 GLU A 118 -30.296 -1.592 -0.361 1.00 14.12 O ATOM 1080 OE2 GLU A 118 -31.747 -2.746 -1.555 1.00 20.28 O ATOM 1081 H GLU A 118 -30.598 -3.358 3.308 1.00 0.00 H ATOM 1082 N ARG A 119 -27.559 -4.638 3.392 1.00 7.04 N ATOM 1083 CA ARG A 119 -26.218 -5.059 3.782 1.00 9.06 C ATOM 1084 C ARG A 119 -26.268 -6.335 4.616 1.00 5.11 C ATOM 1085 O ARG A 119 -25.441 -7.235 4.434 1.00 7.96 O ATOM 1086 CB ARG A 119 -25.514 -3.919 4.529 1.00 9.40 C ATOM 1087 CG ARG A 119 -25.364 -2.670 3.645 1.00 12.71 C ATOM 1088 CD ARG A 119 -24.488 -1.574 4.240 1.00 16.79 C ATOM 1089 NE ARG A 119 -25.035 -1.018 5.470 1.00 14.35 N ATOM 1090 CZ ARG A 119 -25.540 0.210 5.615 1.00 13.90 C ATOM 1091 NH1 ARG A 119 -25.603 1.089 4.597 1.00 6.64 N ATOM 1092 NH2 ARG A 119 -25.990 0.557 6.809 1.00 11.37 N ATOM 1093 HE ARG A 119 -25.032 -1.631 6.310 1.00 0.00 H ATOM 1094 HH12 ARG A 119 -26.004 2.036 4.752 1.00 0.00 H ATOM 1095 HH11 ARG A 119 -25.251 0.821 3.656 1.00 0.00 H ATOM 1096 HH22 ARG A 119 -26.390 1.505 6.959 1.00 0.00 H ATOM 1097 HH21 ARG A 119 -25.944 -0.118 7.599 1.00 0.00 H ATOM 1098 H ARG A 119 -27.955 -3.742 3.743 1.00 0.00 H ATOM 1099 N LYS A 120 -27.242 -6.436 5.527 1.00 7.00 N ATOM 1100 CA LYS A 120 -27.421 -7.667 6.286 1.00 8.16 C ATOM 1101 C LYS A 120 -27.739 -8.853 5.380 1.00 5.94 C ATOM 1102 O LYS A 120 -27.227 -9.959 5.593 1.00 7.92 O ATOM 1103 CB LYS A 120 -28.545 -7.500 7.300 1.00 12.15 C ATOM 1104 CG LYS A 120 -28.554 -8.634 8.288 1.00 13.91 C ATOM 1105 CD LYS A 120 -29.728 -8.480 9.238 1.00 33.22 C ATOM 1106 CE LYS A 120 -31.032 -8.732 8.495 1.00 40.24 C ATOM 1107 NZ LYS A 120 -31.731 -9.960 8.968 1.00 45.81 N ATOM 1108 HZ1 LYS A 120 -31.115 -10.785 8.823 1.00 0.00 H ATOM 1109 HZ2 LYS A 120 -31.952 -9.864 9.980 1.00 0.00 H ATOM 1110 HZ3 LYS A 120 -32.612 -10.085 8.430 1.00 0.00 H ATOM 1111 H LYS A 120 -27.877 -5.629 5.695 1.00 0.00 H ATOM 1112 N ARG A 121 -28.592 -8.639 4.373 1.00 7.81 N ATOM 1113 CA ARG A 121 -28.953 -9.720 3.457 1.00 5.18 C ATOM 1114 C ARG A 121 -27.746 -10.155 2.667 1.00 8.54 C ATOM 1115 O ARG A 121 -27.541 -11.351 2.446 1.00 9.44 O ATOM 1116 CB ARG A 121 -30.042 -9.262 2.497 1.00 9.47 C ATOM 1117 CG ARG A 121 -31.364 -9.087 3.189 1.00 12.09 C ATOM 1118 CD ARG A 121 -32.416 -8.611 2.219 1.00 14.68 C ATOM 1119 NE ARG A 121 -32.247 -9.174 0.880 1.00 13.27 N ATOM 1120 CZ ARG A 121 -32.194 -8.450 -0.233 1.00 15.35 C ATOM 1121 NH1 ARG A 121 -32.317 -7.125 -0.169 1.00 22.18 N ATOM 1122 NH2 ARG A 121 -32.058 -9.050 -1.419 1.00 13.04 N ATOM 1123 HE ARG A 121 -32.163 -10.207 0.793 1.00 0.00 H ATOM 1124 HH12 ARG A 121 -32.276 -6.556 -1.039 1.00 0.00 H ATOM 1125 HH11 ARG A 121 -32.454 -6.659 0.751 1.00 0.00 H ATOM 1126 HH22 ARG A 121 -32.017 -8.480 -2.288 1.00 0.00 H ATOM 1127 HH21 ARG A 121 -31.993 -10.087 -1.473 1.00 0.00 H ATOM 1128 H ARG A 121 -29.003 -7.693 4.240 1.00 0.00 H ATOM 1129 N LEU A 122 -26.914 -9.195 2.262 1.00 7.57 N ATOM 1130 CA LEU A 122 -25.713 -9.561 1.510 1.00 7.51 C ATOM 1131 C LEU A 122 -24.735 -10.337 2.374 1.00 7.72 C ATOM 1132 O LEU A 122 -24.145 -11.322 1.920 1.00 7.54 O ATOM 1133 CB LEU A 122 -25.044 -8.310 0.945 1.00 5.38 C ATOM 1134 CG LEU A 122 -23.663 -8.472 0.337 1.00 5.80 C ATOM 1135 CD1 LEU A 122 -23.718 -9.408 -0.869 1.00 6.92 C ATOM 1136 CD2 LEU A 122 -23.106 -7.096 -0.032 1.00 9.08 C ATOM 1137 H LEU A 122 -27.116 -8.198 2.478 1.00 0.00 H ATOM 1138 N PHE A 123 -24.527 -9.911 3.623 1.00 8.03 N ATOM 1139 CA PHE A 123 -23.639 -10.702 4.463 1.00 7.53 C ATOM 1140 C PHE A 123 -24.189 -12.111 4.659 1.00 7.21 C ATOM 1141 O PHE A 123 -23.417 -13.077 4.765 1.00 7.69 O ATOM 1142 CB PHE A 123 -23.411 -10.021 5.819 1.00 8.41 C ATOM 1143 CG PHE A 123 -22.375 -10.734 6.636 1.00 9.42 C ATOM 1144 CD1 PHE A 123 -21.018 -10.566 6.356 1.00 11.56 C ATOM 1145 CD2 PHE A 123 -22.763 -11.664 7.590 1.00 9.66 C ATOM 1146 CE1 PHE A 123 -20.036 -11.287 7.074 1.00 10.78 C ATOM 1147 CE2 PHE A 123 -21.807 -12.386 8.310 1.00 10.61 C ATOM 1148 CZ PHE A 123 -20.441 -12.194 8.049 1.00 11.44 C ATOM 1149 H PHE A 123 -24.982 -9.047 3.982 1.00 0.00 H ATOM 1150 N SER A 124 -25.518 -12.243 4.768 1.00 7.15 N ATOM 1151 CA SER A 124 -26.102 -13.568 4.965 1.00 7.59 C ATOM 1152 C SER A 124 -25.768 -14.495 3.802 1.00 9.82 C ATOM 1153 O SER A 124 -25.407 -15.658 4.019 1.00 10.71 O ATOM 1154 CB SER A 124 -27.611 -13.461 5.143 1.00 11.89 C ATOM 1155 OG SER A 124 -28.107 -14.700 5.628 1.00 18.97 O ATOM 1156 HG SER A 124 -27.897 -15.416 4.977 1.00 0.00 H ATOM 1157 H SER A 124 -26.132 -11.405 4.713 1.00 0.00 H ATOM 1158 N LEU A 125 -25.852 -13.988 2.569 1.00 6.07 N ATOM 1159 CA LEU A 125 -25.460 -14.771 1.404 1.00 7.05 C ATOM 1160 C LEU A 125 -23.994 -15.177 1.490 1.00 6.63 C ATOM 1161 O LEU A 125 -23.629 -16.340 1.240 1.00 8.78 O ATOM 1162 CB LEU A 125 -25.704 -13.945 0.140 1.00 7.02 C ATOM 1163 CG LEU A 125 -27.178 -13.659 -0.155 1.00 8.80 C ATOM 1164 CD1 LEU A 125 -27.297 -12.620 -1.274 1.00 8.89 C ATOM 1165 CD2 LEU A 125 -27.905 -14.955 -0.511 1.00 11.82 C ATOM 1166 H LEU A 125 -26.203 -13.018 2.438 1.00 0.00 H ATOM 1167 N ILE A 126 -23.131 -14.219 1.841 1.00 6.22 N ATOM 1168 CA ILE A 126 -21.698 -14.499 1.933 1.00 8.15 C ATOM 1169 C ILE A 126 -21.430 -15.541 3.010 1.00 9.20 C ATOM 1170 O ILE A 126 -20.564 -16.410 2.862 1.00 10.48 O ATOM 1171 CB ILE A 126 -20.932 -13.186 2.214 1.00 5.12 C ATOM 1172 CG1 ILE A 126 -20.877 -12.327 0.952 1.00 6.76 C ATOM 1173 CG2 ILE A 126 -19.518 -13.440 2.771 1.00 7.73 C ATOM 1174 CD1 ILE A 126 -20.530 -10.841 1.221 1.00 10.23 C ATOM 1175 H ILE A 126 -23.482 -13.263 2.051 1.00 0.00 H ATOM 1176 N ASN A 127 -22.165 -15.453 4.120 1.00 6.88 N ATOM 1177 CA ASN A 127 -21.922 -16.311 5.261 1.00 6.05 C ATOM 1178 C ASN A 127 -22.421 -17.724 5.052 1.00 10.77 C ATOM 1179 O ASN A 127 -22.144 -18.587 5.893 1.00 15.08 O ATOM 1180 CB ASN A 127 -22.568 -15.686 6.495 1.00 7.56 C ATOM 1181 CG ASN A 127 -21.857 -16.077 7.785 1.00 12.19 C ATOM 1182 OD1 ASN A 127 -20.636 -16.177 7.829 1.00 19.00 O ATOM 1183 ND2 ASN A 127 -22.624 -16.284 8.831 1.00 18.73 N ATOM 1184 HD22 ASN A 127 -23.656 -16.188 8.746 1.00 0.00 H ATOM 1185 HD21 ASN A 127 -22.199 -16.544 9.744 1.00 0.00 H ATOM 1186 H ASN A 127 -22.931 -14.751 4.167 1.00 0.00 H ATOM 1187 N ASP A 128 -23.125 -17.996 3.960 1.00 6.75 N ATOM 1188 CA ASP A 128 -23.509 -19.359 3.646 1.00 9.25 C ATOM 1189 C ASP A 128 -22.438 -20.082 2.840 1.00 19.16 C ATOM 1190 O ASP A 128 -22.631 -21.251 2.503 1.00 18.42 O ATOM 1191 CB ASP A 128 -24.857 -19.398 2.912 1.00 8.99 C ATOM 1192 CG ASP A 128 -26.038 -19.133 3.842 1.00 11.12 C ATOM 1193 OD1 ASP A 128 -25.884 -19.328 5.059 1.00 18.14 O ATOM 1194 OD2 ASP A 128 -27.126 -18.760 3.353 1.00 19.00 O ATOM 1195 H ASP A 128 -23.404 -17.223 3.323 1.00 0.00 H ATOM 1196 N LEU A 129 -21.313 -19.423 2.546 1.00 12.91 N ATOM 1197 CA LEU A 129 -20.154 -20.051 1.905 1.00 10.43 C ATOM 1198 C LEU A 129 -19.044 -20.189 2.931 1.00 15.21 C ATOM 1199 O LEU A 129 -18.764 -19.226 3.657 1.00 15.50 O ATOM 1200 CB LEU A 129 -19.656 -19.223 0.716 1.00 11.94 C ATOM 1201 CG LEU A 129 -20.615 -19.074 -0.459 1.00 15.79 C ATOM 1202 CD1 LEU A 129 -20.137 -17.989 -1.424 1.00 14.42 C ATOM 1203 CD2 LEU A 129 -20.763 -20.419 -1.186 1.00 15.77 C ATOM 1204 H LEU A 129 -21.257 -18.412 2.784 1.00 0.00 H ATOM 1205 N PRO A 130 -18.408 -21.348 3.035 1.00 10.69 N ATOM 1206 CA PRO A 130 -17.273 -21.484 3.956 1.00 9.56 C ATOM 1207 C PRO A 130 -16.195 -20.470 3.605 1.00 8.35 C ATOM 1208 O PRO A 130 -15.977 -20.153 2.430 1.00 11.28 O ATOM 1209 CB PRO A 130 -16.782 -22.919 3.713 1.00 18.77 C ATOM 1210 CG PRO A 130 -17.942 -23.615 3.106 1.00 26.27 C ATOM 1211 CD PRO A 130 -18.724 -22.596 2.326 1.00 11.65 C ATOM 1212 N THR A 131 -15.522 -19.970 4.632 1.00 8.40 N ATOM 1213 CA THR A 131 -14.426 -19.039 4.400 1.00 10.02 C ATOM 1214 C THR A 131 -13.212 -19.766 3.844 1.00 9.10 C ATOM 1215 O THR A 131 -13.017 -20.964 4.067 1.00 9.21 O ATOM 1216 CB THR A 131 -14.036 -18.314 5.689 1.00 10.45 C ATOM 1217 OG1 THR A 131 -13.440 -19.232 6.619 1.00 9.32 O ATOM 1218 CG2 THR A 131 -15.270 -17.715 6.327 1.00 10.07 C ATOM 1219 HG1 THR A 131 -13.194 -18.748 7.447 1.00 0.00 H ATOM 1220 H THR A 131 -15.776 -20.242 5.603 1.00 0.00 H ATOM 1221 N LEU A 132 -12.377 -19.022 3.125 1.00 9.59 N ATOM 1222 CA LEU A 132 -11.147 -19.633 2.613 1.00 7.73 C ATOM 1223 C LEU A 132 -10.274 -20.126 3.763 1.00 11.28 C ATOM 1224 O LEU A 132 -9.635 -21.184 3.663 1.00 11.22 O ATOM 1225 CB LEU A 132 -10.387 -18.638 1.738 1.00 9.61 C ATOM 1226 CG LEU A 132 -11.180 -18.148 0.522 1.00 9.69 C ATOM 1227 CD1 LEU A 132 -10.450 -16.942 -0.075 1.00 11.36 C ATOM 1228 CD2 LEU A 132 -11.319 -19.253 -0.533 1.00 10.69 C ATOM 1229 H LEU A 132 -12.593 -18.024 2.929 1.00 0.00 H ATOM 1230 N PHE A 133 -10.260 -19.388 4.872 1.00 8.77 N ATOM 1231 CA PHE A 133 -9.564 -19.850 6.071 1.00 10.21 C ATOM 1232 C PHE A 133 -10.091 -21.213 6.521 1.00 10.18 C ATOM 1233 O PHE A 133 -9.301 -22.118 6.810 1.00 11.73 O ATOM 1234 CB PHE A 133 -9.720 -18.801 7.183 1.00 10.19 C ATOM 1235 CG PHE A 133 -9.158 -19.208 8.504 1.00 12.23 C ATOM 1236 CD1 PHE A 133 -7.791 -19.398 8.669 1.00 20.22 C ATOM 1237 CD2 PHE A 133 -9.990 -19.372 9.608 1.00 14.30 C ATOM 1238 CE1 PHE A 133 -7.257 -19.752 9.903 1.00 30.36 C ATOM 1239 CE2 PHE A 133 -9.464 -19.736 10.839 1.00 16.71 C ATOM 1240 CZ PHE A 133 -8.098 -19.921 10.991 1.00 23.69 C ATOM 1241 H PHE A 133 -10.751 -18.471 4.885 1.00 0.00 H ATOM 1242 N ASP A 134 -11.427 -21.374 6.594 1.00 8.70 N ATOM 1243 CA ASP A 134 -12.033 -22.674 6.891 1.00 13.54 C ATOM 1244 C ASP A 134 -11.554 -23.750 5.920 1.00 12.39 C ATOM 1245 O ASP A 134 -11.220 -24.870 6.329 1.00 14.10 O ATOM 1246 CB ASP A 134 -13.564 -22.596 6.799 1.00 14.16 C ATOM 1247 CG ASP A 134 -14.206 -21.779 7.899 1.00 24.59 C ATOM 1248 OD1 ASP A 134 -13.568 -21.546 8.942 1.00 21.99 O ATOM 1249 OD2 ASP A 134 -15.381 -21.386 7.697 1.00 35.22 O ATOM 1250 H ASP A 134 -12.045 -20.553 6.435 1.00 0.00 H ATOM 1251 N VAL A 135 -11.570 -23.447 4.622 1.00 10.78 N ATOM 1252 CA VAL A 135 -11.221 -24.457 3.619 1.00 14.80 C ATOM 1253 C VAL A 135 -9.768 -24.884 3.769 1.00 18.37 C ATOM 1254 O VAL A 135 -9.455 -26.080 3.813 1.00 17.07 O ATOM 1255 CB VAL A 135 -11.502 -23.931 2.200 1.00 21.57 C ATOM 1256 CG1 VAL A 135 -10.928 -24.904 1.165 1.00 18.89 C ATOM 1257 CG2 VAL A 135 -13.004 -23.726 1.972 1.00 18.13 C ATOM 1258 H VAL A 135 -11.832 -22.487 4.319 1.00 0.00 H ATOM 1259 N VAL A 136 -8.857 -23.915 3.845 1.00 14.57 N ATOM 1260 CA VAL A 136 -7.426 -24.223 3.829 1.00 16.33 C ATOM 1261 C VAL A 136 -7.002 -24.934 5.105 1.00 22.50 C ATOM 1262 O VAL A 136 -6.173 -25.853 5.073 1.00 25.05 O ATOM 1263 CB VAL A 136 -6.619 -22.934 3.593 1.00 21.65 C ATOM 1264 CG1 VAL A 136 -5.171 -23.130 3.973 1.00 38.57 C ATOM 1265 CG2 VAL A 136 -6.717 -22.535 2.142 1.00 21.71 C ATOM 1266 H VAL A 136 -9.167 -22.925 3.917 1.00 0.00 H ATOM 1267 N THR A 137 -7.550 -24.526 6.248 1.00 13.20 N ATOM 1268 CA THR A 137 -7.217 -25.183 7.504 1.00 16.38 C ATOM 1269 C THR A 137 -7.987 -26.484 7.730 1.00 17.77 C ATOM 1270 O THR A 137 -7.641 -27.222 8.657 1.00 24.36 O ATOM 1271 CB THR A 137 -7.474 -24.245 8.682 1.00 19.61 C ATOM 1272 OG1 THR A 137 -8.861 -23.865 8.692 1.00 18.21 O ATOM 1273 CG2 THR A 137 -6.611 -22.980 8.583 1.00 21.78 C ATOM 1274 HG1 THR A 137 -9.081 -23.403 7.845 1.00 0.00 H ATOM 1275 H THR A 137 -8.221 -23.732 6.244 1.00 0.00 H ATOM 1276 N GLY A 138 -8.992 -26.789 6.912 1.00 16.06 N ATOM 1277 CA GLY A 138 -9.797 -27.985 7.138 1.00 14.98 C ATOM 1278 C GLY A 138 -10.581 -27.924 8.431 1.00 24.58 C ATOM 1279 O GLY A 138 -10.683 -28.929 9.148 1.00 19.78 O ATOM 1280 H GLY A 138 -9.205 -26.169 6.105 1.00 0.00 H ATOM 1281 N ARG A 139 -11.120 -26.748 8.752 1.00 25.46 N ATOM 1282 CA ARG A 139 -11.919 -26.543 9.955 1.00 24.75 C ATOM 1283 C ARG A 139 -13.176 -27.393 9.997 1.00 19.95 C ATOM 1284 O ARG A 139 -13.940 -27.461 9.030 1.00 27.38 O ATOM 1285 CB ARG A 139 -12.313 -25.081 10.066 1.00 26.81 C ATOM 1286 CG ARG A 139 -11.400 -24.269 10.909 1.00 32.81 C ATOM 1287 CD ARG A 139 -12.023 -22.918 11.098 1.00 29.90 C ATOM 1288 NE ARG A 139 -11.706 -22.238 12.346 1.00 45.94 N ATOM 1289 CZ ARG A 139 -10.488 -22.097 12.855 1.00 27.76 C ATOM 1290 NH1 ARG A 139 -10.341 -21.450 13.995 1.00 47.19 N ATOM 1291 NH2 ARG A 139 -9.434 -22.587 12.233 1.00 51.62 N ATOM 1292 HE ARG A 139 -12.498 -21.830 12.882 1.00 0.00 H ATOM 1293 HH12 ARG A 139 -9.394 -21.331 14.407 1.00 0.00 H ATOM 1294 HH11 ARG A 139 -11.173 -21.059 14.482 1.00 0.00 H ATOM 1295 HH22 ARG A 139 -8.486 -22.469 12.644 1.00 0.00 H ATOM 1296 HH21 ARG A 139 -9.550 -23.092 11.331 1.00 0.00 H ATOM 1297 H ARG A 139 -10.964 -25.940 8.116 1.00 0.00 H ATOM 1298 N LYS A 140 -13.421 -27.970 11.172 1.00 33.98 N ATOM 1299 CA LYS A 140 -14.557 -28.845 11.434 1.00 39.84 C ATOM 1300 C LYS A 140 -15.921 -28.147 11.285 1.00 28.83 C ATOM 1301 O LYS A 140 -16.166 -27.114 11.892 1.00 21.77 O ATOM 1302 CB LYS A 140 -14.418 -29.436 12.847 1.00 26.42 C ATOM 1303 CG LYS A 140 -15.509 -30.436 13.186 1.00 18.50 C ATOM 1304 CD LYS A 140 -15.147 -31.342 14.354 1.00 27.61 C ATOM 1305 CE LYS A 140 -16.265 -32.346 14.563 1.00 32.51 C ATOM 1306 NZ LYS A 140 -15.984 -33.367 15.610 1.00 35.25 N ATOM 1307 HZ1 LYS A 140 -15.135 -33.907 15.347 1.00 0.00 H ATOM 1308 HZ2 LYS A 140 -15.826 -32.892 16.522 1.00 0.00 H ATOM 1309 HZ3 LYS A 140 -16.796 -34.012 15.690 1.00 0.00 H ATOM 1310 H LYS A 140 -12.759 -27.784 11.953 1.00 0.00 H TER 1311 LYS A 140 ATOM 1312 N SER B -1 -5.344 -9.435 21.292 1.00 22.64 N ATOM 1313 CA SER B -1 -6.207 -8.988 20.198 1.00 17.56 C ATOM 1314 C SER B -1 -7.644 -9.359 20.519 1.00 13.77 C ATOM 1315 O SER B -1 -7.884 -10.297 21.260 1.00 15.52 O ATOM 1316 CB SER B -1 -5.783 -9.620 18.866 1.00 18.46 C ATOM 1317 OG SER B -1 -4.427 -9.350 18.571 1.00 28.81 O ATOM 1318 HG SER B -1 -4.188 -9.771 17.708 1.00 0.00 H ATOM 1319 HN3 SER B -1 -5.426 -10.466 21.397 1.00 0.00 H ATOM 1320 HN2 SER B -1 -5.638 -8.971 22.175 1.00 0.00 H ATOM 1321 HN1 SER B -1 -4.358 -9.184 21.079 1.00 0.00 H ATOM 1322 N PRO B 10 -8.608 -8.623 19.965 1.00 10.28 N ATOM 1323 CA PRO B 10 -10.011 -8.990 20.198 1.00 9.03 C ATOM 1324 C PRO B 10 -10.301 -10.367 19.639 1.00 10.69 C ATOM 1325 O PRO B 10 -9.880 -10.701 18.526 1.00 11.21 O ATOM 1326 CB PRO B 10 -10.800 -7.912 19.438 1.00 11.63 C ATOM 1327 CG PRO B 10 -9.841 -6.749 19.329 1.00 11.92 C ATOM 1328 CD PRO B 10 -8.478 -7.372 19.190 1.00 11.36 C ATOM 1329 N ARG B 11 -11.063 -11.154 20.403 1.00 10.91 N ATOM 1330 CA ARG B 11 -11.371 -12.508 19.962 1.00 9.68 C ATOM 1331 C ARG B 11 -12.851 -12.825 20.026 1.00 9.92 C ATOM 1332 O ARG B 11 -13.369 -13.463 19.108 1.00 11.48 O ATOM 1333 CB ARG B 11 -10.590 -13.560 20.791 1.00 14.20 C ATOM 1334 CG ARG B 11 -9.067 -13.429 20.685 1.00 25.69 C ATOM 1335 CD ARG B 11 -8.368 -14.649 21.265 1.00 37.08 C ATOM 1336 NE ARG B 11 -8.796 -15.862 20.581 1.00 48.88 N ATOM 1337 CZ ARG B 11 -8.273 -17.067 20.780 1.00 43.37 C ATOM 1338 NH1 ARG B 11 -7.293 -17.237 21.660 1.00 46.54 N ATOM 1339 NH2 ARG B 11 -8.737 -18.101 20.094 1.00 44.68 N ATOM 1340 HE ARG B 11 -9.566 -15.779 19.887 1.00 0.00 H ATOM 1341 HH12 ARG B 11 -6.888 -18.183 21.811 1.00 0.00 H ATOM 1342 HH11 ARG B 11 -6.931 -16.424 22.198 1.00 0.00 H ATOM 1343 HH22 ARG B 11 -8.333 -19.048 20.244 1.00 0.00 H ATOM 1344 HH21 ARG B 11 -9.505 -17.966 19.406 1.00 0.00 H ATOM 1345 H ARG B 11 -11.435 -10.802 21.308 1.00 0.00 H ATOM 1346 N THR B 12 -13.541 -12.429 21.091 1.00 10.46 N ATOM 1347 CA THR B 12 -14.966 -12.749 21.138 1.00 8.75 C ATOM 1348 C THR B 12 -15.759 -11.770 20.293 1.00 9.93 C ATOM 1349 O THR B 12 -15.287 -10.696 19.943 1.00 7.71 O ATOM 1350 CB THR B 12 -15.503 -12.696 22.566 1.00 9.92 C ATOM 1351 OG1 THR B 12 -15.429 -11.342 23.054 1.00 11.44 O ATOM 1352 CG2 THR B 12 -14.723 -13.643 23.489 1.00 10.60 C ATOM 1353 HG1 THR B 12 -15.777 -11.307 23.980 1.00 0.00 H ATOM 1354 H THR B 12 -13.082 -11.908 21.865 1.00 0.00 H ATOM 1355 N VAL B 13 -17.007 -12.144 19.993 1.00 9.79 N ATOM 1356 CA VAL B 13 -17.887 -11.219 19.285 1.00 7.91 C ATOM 1357 C VAL B 13 -17.918 -9.861 19.987 1.00 8.21 C ATOM 1358 O VAL B 13 -17.769 -8.803 19.349 1.00 8.22 O ATOM 1359 CB VAL B 13 -19.294 -11.823 19.174 1.00 8.32 C ATOM 1360 CG1 VAL B 13 -20.285 -10.821 18.611 1.00 13.14 C ATOM 1361 CG2 VAL B 13 -19.241 -13.059 18.271 1.00 10.29 C ATOM 1362 H VAL B 13 -17.349 -13.088 20.262 1.00 0.00 H ATOM 1363 N GLU B 14 -18.106 -9.869 21.319 1.00 9.48 N ATOM 1364 CA GLU B 14 -18.189 -8.605 22.055 1.00 9.10 C ATOM 1365 C GLU B 14 -16.878 -7.826 22.005 1.00 9.19 C ATOM 1366 O GLU B 14 -16.884 -6.594 21.880 1.00 8.69 O ATOM 1367 CB GLU B 14 -18.587 -8.860 23.512 1.00 13.00 C ATOM 1368 CG GLU B 14 -20.028 -9.281 23.657 1.00 15.10 C ATOM 1369 CD GLU B 14 -20.247 -10.748 23.339 1.00 12.70 C ATOM 1370 OE1 GLU B 14 -19.257 -11.534 23.347 1.00 13.00 O ATOM 1371 OE2 GLU B 14 -21.426 -11.122 23.124 1.00 14.28 O ATOM 1372 H GLU B 14 -18.192 -10.773 21.826 1.00 0.00 H ATOM 1373 N GLU B 15 -15.739 -8.513 22.124 1.00 6.96 N ATOM 1374 CA GLU B 15 -14.463 -7.801 22.077 1.00 9.21 C ATOM 1375 C GLU B 15 -14.258 -7.162 20.713 1.00 7.99 C ATOM 1376 O GLU B 15 -13.758 -6.036 20.600 1.00 8.28 O ATOM 1377 CB GLU B 15 -13.306 -8.761 22.356 1.00 8.35 C ATOM 1378 CG GLU B 15 -13.203 -9.148 23.847 1.00 9.52 C ATOM 1379 CD GLU B 15 -12.303 -10.357 24.066 1.00 17.21 C ATOM 1380 OE1 GLU B 15 -11.855 -10.994 23.080 1.00 11.27 O ATOM 1381 OE2 GLU B 15 -12.060 -10.682 25.244 1.00 19.96 O ATOM 1382 H GLU B 15 -15.760 -9.545 22.249 1.00 0.00 H ATOM 1383 N ILE B 16 -14.630 -7.887 19.667 1.00 5.96 N ATOM 1384 CA ILE B 16 -14.432 -7.384 18.317 1.00 7.16 C ATOM 1385 C ILE B 16 -15.345 -6.197 18.050 1.00 6.84 C ATOM 1386 O ILE B 16 -14.937 -5.217 17.411 1.00 6.74 O ATOM 1387 CB ILE B 16 -14.640 -8.518 17.307 1.00 4.47 C ATOM 1388 CG1 ILE B 16 -13.553 -9.563 17.534 1.00 8.19 C ATOM 1389 CG2 ILE B 16 -14.531 -7.954 15.876 1.00 9.41 C ATOM 1390 CD1 ILE B 16 -13.810 -10.856 16.759 1.00 8.81 C ATOM 1391 H ILE B 16 -15.066 -8.820 19.813 1.00 0.00 H ATOM 1392 N PHE B 17 -16.583 -6.238 18.563 1.00 5.97 N ATOM 1393 CA PHE B 17 -17.470 -5.091 18.359 1.00 5.18 C ATOM 1394 C PHE B 17 -17.003 -3.877 19.153 1.00 6.65 C ATOM 1395 O PHE B 17 -17.129 -2.735 18.687 1.00 8.75 O ATOM 1396 CB PHE B 17 -18.909 -5.447 18.746 1.00 7.14 C ATOM 1397 CG PHE B 17 -19.869 -4.310 18.564 1.00 9.30 C ATOM 1398 CD1 PHE B 17 -20.273 -3.926 17.297 1.00 11.32 C ATOM 1399 CD2 PHE B 17 -20.352 -3.607 19.661 1.00 9.57 C ATOM 1400 CE1 PHE B 17 -21.152 -2.855 17.131 1.00 7.17 C ATOM 1401 CE2 PHE B 17 -21.225 -2.535 19.505 1.00 11.98 C ATOM 1402 CZ PHE B 17 -21.634 -2.164 18.230 1.00 9.50 C ATOM 1403 H PHE B 17 -16.908 -7.070 19.096 1.00 0.00 H ATOM 1404 N LYS B 18 -16.467 -4.087 20.358 1.00 6.39 N ATOM 1405 CA LYS B 18 -15.910 -2.952 21.091 1.00 7.11 C ATOM 1406 C LYS B 18 -14.800 -2.270 20.297 1.00 7.45 C ATOM 1407 O LYS B 18 -14.760 -1.034 20.179 1.00 9.49 O ATOM 1408 CB LYS B 18 -15.382 -3.417 22.446 1.00 6.08 C ATOM 1409 CG LYS B 18 -14.736 -2.294 23.273 1.00 11.75 C ATOM 1410 CD LYS B 18 -14.210 -2.855 24.590 1.00 16.11 C ATOM 1411 CE LYS B 18 -13.451 -1.789 25.357 1.00 26.33 C ATOM 1412 NZ LYS B 18 -14.410 -0.827 25.946 1.00 41.88 N ATOM 1413 HZ1 LYS B 18 -14.962 -0.381 25.186 1.00 0.00 H ATOM 1414 HZ2 LYS B 18 -15.051 -1.330 26.593 1.00 0.00 H ATOM 1415 HZ3 LYS B 18 -13.888 -0.097 26.471 1.00 0.00 H ATOM 1416 H LYS B 18 -16.446 -5.043 20.768 1.00 0.00 H ATOM 1417 N ASP B 19 -13.884 -3.068 19.751 1.00 5.64 N ATOM 1418 CA ASP B 19 -12.803 -2.532 18.928 1.00 7.87 C ATOM 1419 C ASP B 19 -13.361 -1.821 17.694 1.00 8.17 C ATOM 1420 O ASP B 19 -12.970 -0.689 17.377 1.00 7.73 O ATOM 1421 CB ASP B 19 -11.871 -3.702 18.567 1.00 7.91 C ATOM 1422 CG ASP B 19 -10.760 -3.322 17.612 1.00 11.60 C ATOM 1423 OD1 ASP B 19 -11.049 -3.262 16.409 1.00 8.82 O ATOM 1424 OD2 ASP B 19 -9.610 -3.110 18.074 1.00 10.99 O ATOM 1425 H ASP B 19 -13.940 -4.094 19.914 1.00 0.00 H ATOM 1426 N TYR B 20 -14.327 -2.452 17.012 1.00 7.48 N ATOM 1427 CA TYR B 20 -14.936 -1.829 15.842 1.00 9.06 C ATOM 1428 C TYR B 20 -15.559 -0.480 16.184 1.00 7.96 C ATOM 1429 O TYR B 20 -15.355 0.508 15.471 1.00 6.98 O ATOM 1430 CB TYR B 20 -15.999 -2.764 15.268 1.00 5.88 C ATOM 1431 CG TYR B 20 -16.820 -2.146 14.158 1.00 7.05 C ATOM 1432 CD1 TYR B 20 -18.009 -1.454 14.430 1.00 10.32 C ATOM 1433 CD2 TYR B 20 -16.426 -2.302 12.841 1.00 10.34 C ATOM 1434 CE1 TYR B 20 -18.752 -0.885 13.370 1.00 8.99 C ATOM 1435 CE2 TYR B 20 -17.153 -1.763 11.795 1.00 14.44 C ATOM 1436 CZ TYR B 20 -18.299 -1.050 12.061 1.00 14.53 C ATOM 1437 OH TYR B 20 -18.989 -0.518 10.990 1.00 17.52 O ATOM 1438 HH TYR B 20 -18.401 0.109 10.499 1.00 0.00 H ATOM 1439 H TYR B 20 -14.645 -3.393 17.319 1.00 0.00 H ATOM 1440 N SER B 21 -16.331 -0.421 17.272 1.00 6.98 N ATOM 1441 CA SER B 21 -17.045 0.816 17.570 1.00 7.88 C ATOM 1442 C SER B 21 -16.081 1.935 17.939 1.00 8.05 C ATOM 1443 O SER B 21 -16.336 3.097 17.601 1.00 7.38 O ATOM 1444 CB SER B 21 -18.081 0.572 18.671 1.00 11.27 C ATOM 1445 OG SER B 21 -17.471 0.043 19.832 1.00 12.74 O ATOM 1446 HG SER B 21 -16.794 0.682 20.168 1.00 0.00 H ATOM 1447 H SER B 21 -16.422 -1.246 17.899 1.00 0.00 H ATOM 1448 N ALA B 22 -14.947 1.607 18.572 1.00 6.71 N ATOM 1449 CA ALA B 22 -13.994 2.645 18.939 1.00 7.94 C ATOM 1450 C ALA B 22 -13.273 3.177 17.706 1.00 9.71 C ATOM 1451 O ALA B 22 -13.099 4.391 17.561 1.00 8.91 O ATOM 1452 CB ALA B 22 -12.996 2.103 19.969 1.00 11.20 C ATOM 1453 H ALA B 22 -14.747 0.612 18.801 1.00 0.00 H ATOM 1454 N ARG B 23 -12.838 2.283 16.808 1.00 7.39 N ATOM 1455 CA ARG B 23 -12.214 2.758 15.577 1.00 6.72 C ATOM 1456 C ARG B 23 -13.192 3.575 14.750 1.00 7.41 C ATOM 1457 O ARG B 23 -12.822 4.607 14.174 1.00 7.44 O ATOM 1458 CB ARG B 23 -11.692 1.575 14.752 1.00 7.06 C ATOM 1459 CG ARG B 23 -10.620 0.741 15.431 1.00 6.78 C ATOM 1460 CD ARG B 23 -10.189 -0.381 14.482 1.00 6.08 C ATOM 1461 NE ARG B 23 -9.410 -1.384 15.199 1.00 6.62 N ATOM 1462 CZ ARG B 23 -8.087 -1.357 15.303 1.00 6.84 C ATOM 1463 NH1 ARG B 23 -7.386 -0.398 14.705 1.00 8.82 N ATOM 1464 NH2 ARG B 23 -7.461 -2.297 16.008 1.00 11.58 N ATOM 1465 HE ARG B 23 -9.921 -2.166 15.656 1.00 0.00 H ATOM 1466 HH12 ARG B 23 -6.350 -0.382 14.790 1.00 0.00 H ATOM 1467 HH11 ARG B 23 -7.874 0.336 14.153 1.00 0.00 H ATOM 1468 HH22 ARG B 23 -6.425 -2.280 16.092 1.00 0.00 H ATOM 1469 HH21 ARG B 23 -8.008 -3.048 16.474 1.00 0.00 H ATOM 1470 H ARG B 23 -12.944 1.264 16.986 1.00 0.00 H ATOM 1471 N ARG B 24 -14.448 3.112 14.662 1.00 7.31 N ATOM 1472 CA ARG B 24 -15.460 3.826 13.900 1.00 6.74 C ATOM 1473 C ARG B 24 -15.698 5.215 14.480 1.00 9.36 C ATOM 1474 O ARG B 24 -15.836 6.195 13.741 1.00 9.55 O ATOM 1475 CB ARG B 24 -16.760 3.017 13.885 1.00 7.68 C ATOM 1476 CG ARG B 24 -17.897 3.745 13.172 1.00 11.67 C ATOM 1477 CD ARG B 24 -19.230 3.023 13.391 1.00 10.45 C ATOM 1478 NE ARG B 24 -20.337 3.822 12.872 1.00 10.70 N ATOM 1479 CZ ARG B 24 -20.869 4.869 13.506 1.00 10.68 C ATOM 1480 NH1 ARG B 24 -20.398 5.266 14.696 1.00 11.40 N ATOM 1481 NH2 ARG B 24 -21.876 5.531 12.937 1.00 15.47 N ATOM 1482 HE ARG B 24 -20.736 3.558 11.949 1.00 0.00 H ATOM 1483 HH12 ARG B 24 -20.824 6.084 15.177 1.00 0.00 H ATOM 1484 HH11 ARG B 24 -19.607 4.756 15.138 1.00 0.00 H ATOM 1485 HH22 ARG B 24 -22.300 6.349 13.420 1.00 0.00 H ATOM 1486 HH21 ARG B 24 -22.238 5.230 12.010 1.00 0.00 H ATOM 1487 H ARG B 24 -14.702 2.228 15.147 1.00 0.00 H ATOM 1488 N ALA B 25 -15.791 5.315 15.807 1.00 7.30 N ATOM 1489 CA ALA B 25 -15.982 6.631 16.414 1.00 11.12 C ATOM 1490 C ALA B 25 -14.860 7.587 16.034 1.00 12.14 C ATOM 1491 O ALA B 25 -15.112 8.768 15.738 1.00 11.52 O ATOM 1492 CB ALA B 25 -16.057 6.489 17.936 1.00 8.66 C ATOM 1493 H ALA B 25 -15.728 4.465 16.404 1.00 0.00 H ATOM 1494 N ALA B 26 -13.616 7.092 16.027 1.00 7.94 N ATOM 1495 CA ALA B 26 -12.470 7.899 15.608 1.00 10.35 C ATOM 1496 C ALA B 26 -12.618 8.385 14.173 1.00 11.04 C ATOM 1497 O ALA B 26 -12.447 9.577 13.881 1.00 9.83 O ATOM 1498 CB ALA B 26 -11.195 7.081 15.747 1.00 12.00 C ATOM 1499 H ALA B 26 -13.460 6.108 16.327 1.00 0.00 H ATOM 1500 N LEU B 27 -12.908 7.461 13.253 1.00 8.08 N ATOM 1501 CA LEU B 27 -13.019 7.825 11.847 1.00 5.29 C ATOM 1502 C LEU B 27 -14.186 8.767 11.606 1.00 8.50 C ATOM 1503 O LEU B 27 -14.093 9.669 10.767 1.00 9.75 O ATOM 1504 CB LEU B 27 -13.168 6.553 11.000 1.00 6.79 C ATOM 1505 CG LEU B 27 -11.943 5.617 11.024 1.00 9.84 C ATOM 1506 CD1 LEU B 27 -12.306 4.246 10.504 1.00 15.46 C ATOM 1507 CD2 LEU B 27 -10.824 6.188 10.189 1.00 12.23 C ATOM 1508 H LEU B 27 -13.056 6.473 13.543 1.00 0.00 H ATOM 1509 N LEU B 28 -15.318 8.540 12.286 1.00 7.23 N ATOM 1510 CA LEU B 28 -16.460 9.428 12.107 1.00 10.08 C ATOM 1511 C LEU B 28 -16.090 10.850 12.493 1.00 10.15 C ATOM 1512 O LEU B 28 -16.459 11.812 11.806 1.00 9.53 O ATOM 1513 CB LEU B 28 -17.640 8.929 12.945 1.00 10.81 C ATOM 1514 CG LEU B 28 -18.900 9.774 12.822 1.00 15.43 C ATOM 1515 CD1 LEU B 28 -19.370 9.915 11.387 1.00 20.96 C ATOM 1516 CD2 LEU B 28 -19.986 9.181 13.740 1.00 15.01 C ATOM 1517 H LEU B 28 -15.382 7.733 12.939 1.00 0.00 H ATOM 1518 N ARG B 29 -15.312 10.991 13.572 1.00 10.47 N ATOM 1519 CA ARG B 29 -14.907 12.320 14.016 1.00 11.45 C ATOM 1520 C ARG B 29 -14.024 12.997 12.978 1.00 13.37 C ATOM 1521 O ARG B 29 -14.231 14.170 12.654 1.00 9.63 O ATOM 1522 CB ARG B 29 -14.200 12.233 15.368 1.00 13.16 C ATOM 1523 CG ARG B 29 -14.054 13.587 16.019 1.00 16.63 C ATOM 1524 CD ARG B 29 -13.552 13.459 17.441 1.00 17.97 C ATOM 1525 NE ARG B 29 -12.178 12.976 17.494 1.00 21.19 N ATOM 1526 CZ ARG B 29 -11.825 11.750 17.870 1.00 21.39 C ATOM 1527 NH1 ARG B 29 -10.540 11.415 17.890 1.00 19.45 N ATOM 1528 NH2 ARG B 29 -12.751 10.865 18.233 1.00 24.67 N ATOM 1529 HE ARG B 29 -11.422 13.635 17.219 1.00 0.00 H ATOM 1530 HH12 ARG B 29 -10.257 10.458 18.183 1.00 0.00 H ATOM 1531 HH11 ARG B 29 -9.817 12.109 17.613 1.00 0.00 H ATOM 1532 HH22 ARG B 29 -12.469 9.908 18.526 1.00 0.00 H ATOM 1533 HH21 ARG B 29 -13.756 11.131 18.224 1.00 0.00 H ATOM 1534 H ARG B 29 -14.995 10.150 14.096 1.00 0.00 H ATOM 1535 N ALA B 30 -13.060 12.260 12.417 1.00 10.22 N ATOM 1536 CA ALA B 30 -12.200 12.793 11.367 1.00 10.36 C ATOM 1537 C ALA B 30 -13.007 13.337 10.205 1.00 9.41 C ATOM 1538 O ALA B 30 -12.661 14.375 9.634 1.00 12.56 O ATOM 1539 CB ALA B 30 -11.262 11.704 10.863 1.00 9.15 C ATOM 1540 H ALA B 30 -12.920 11.281 12.738 1.00 0.00 H ATOM 1541 N LEU B 31 -14.085 12.647 9.836 1.00 8.15 N ATOM 1542 CA LEU B 31 -14.870 13.005 8.661 1.00 9.37 C ATOM 1543 C LEU B 31 -15.921 14.075 8.917 1.00 13.34 C ATOM 1544 O LEU B 31 -16.515 14.572 7.954 1.00 12.40 O ATOM 1545 CB LEU B 31 -15.550 11.750 8.085 1.00 8.49 C ATOM 1546 CG LEU B 31 -14.501 10.735 7.613 1.00 11.37 C ATOM 1547 CD1 LEU B 31 -15.091 9.314 7.399 1.00 12.26 C ATOM 1548 CD2 LEU B 31 -13.762 11.241 6.379 1.00 13.84 C ATOM 1549 H LEU B 31 -14.376 11.826 10.405 1.00 0.00 H ATOM 1550 N THR B 32 -16.180 14.429 10.174 1.00 10.87 N ATOM 1551 CA THR B 32 -17.248 15.378 10.474 1.00 12.63 C ATOM 1552 C THR B 32 -16.715 16.500 11.362 1.00 11.50 C ATOM 1553 O THR B 32 -16.227 17.510 10.845 1.00 12.51 O ATOM 1554 CB THR B 32 -18.456 14.663 11.112 1.00 10.53 C ATOM 1555 OG1 THR B 32 -18.088 13.977 12.315 1.00 10.96 O ATOM 1556 CG2 THR B 32 -19.088 13.664 10.130 1.00 11.71 C ATOM 1557 HG1 THR B 32 -18.885 13.531 12.696 1.00 0.00 H ATOM 1558 H THR B 32 -15.616 14.026 10.949 1.00 0.00 H ATOM 1559 N LYS B 33 -16.773 16.319 12.686 1.00 9.34 N ATOM 1560 CA LYS B 33 -16.381 17.370 13.623 1.00 11.92 C ATOM 1561 C LYS B 33 -14.969 17.873 13.359 1.00 15.79 C ATOM 1562 O LYS B 33 -14.699 19.081 13.456 1.00 11.78 O ATOM 1563 CB LYS B 33 -16.473 16.849 15.055 1.00 16.27 C ATOM 1564 CG LYS B 33 -16.003 17.834 16.138 1.00 30.28 C ATOM 1565 CD LYS B 33 -15.768 17.112 17.476 1.00 33.51 C ATOM 1566 CE LYS B 33 -15.596 18.078 18.645 1.00 43.06 C ATOM 1567 NZ LYS B 33 -16.885 18.732 19.010 1.00 50.05 N ATOM 1568 HZ1 LYS B 33 -17.245 19.265 18.193 1.00 0.00 H ATOM 1569 HZ2 LYS B 33 -17.576 18.005 19.283 1.00 0.00 H ATOM 1570 HZ3 LYS B 33 -16.729 19.381 19.808 1.00 0.00 H ATOM 1571 H LYS B 33 -17.106 15.407 13.058 1.00 0.00 H ATOM 1572 N ASP B 34 -14.047 16.964 13.050 1.00 11.79 N ATOM 1573 CA ASP B 34 -12.653 17.323 12.865 1.00 10.44 C ATOM 1574 C ASP B 34 -12.278 17.486 11.402 1.00 8.12 C ATOM 1575 O ASP B 34 -11.082 17.470 11.101 1.00 9.78 O ATOM 1576 CB ASP B 34 -11.719 16.274 13.483 1.00 10.03 C ATOM 1577 CG ASP B 34 -11.771 16.231 15.001 1.00 18.64 C ATOM 1578 OD1 ASP B 34 -12.353 17.148 15.620 1.00 18.43 O ATOM 1579 OD2 ASP B 34 -11.213 15.257 15.573 1.00 16.56 O ATOM 1580 H ASP B 34 -14.333 15.970 12.938 1.00 0.00 H ATOM 1581 N VAL B 35 -13.259 17.684 10.503 1.00 11.36 N ATOM 1582 CA VAL B 35 -12.978 17.590 9.065 1.00 10.22 C ATOM 1583 C VAL B 35 -12.013 18.676 8.592 1.00 12.24 C ATOM 1584 O VAL B 35 -11.241 18.455 7.642 1.00 10.46 O ATOM 1585 CB VAL B 35 -14.276 17.610 8.235 1.00 11.86 C ATOM 1586 CG1 VAL B 35 -14.976 18.960 8.325 1.00 13.46 C ATOM 1587 CG2 VAL B 35 -13.956 17.321 6.777 1.00 12.56 C ATOM 1588 H VAL B 35 -14.222 17.905 10.828 1.00 0.00 H ATOM 1589 N ASP B 36 -12.049 19.868 9.193 1.00 8.78 N ATOM 1590 CA ASP B 36 -11.113 20.902 8.755 1.00 12.18 C ATOM 1591 C ASP B 36 -9.671 20.450 8.959 1.00 11.57 C ATOM 1592 O ASP B 36 -8.817 20.618 8.074 1.00 11.49 O ATOM 1593 CB ASP B 36 -11.369 22.194 9.522 1.00 9.35 C ATOM 1594 CG ASP B 36 -10.389 23.283 9.143 1.00 16.35 C ATOM 1595 OD1 ASP B 36 -10.437 23.719 7.984 1.00 14.30 O ATOM 1596 OD2 ASP B 36 -9.560 23.687 9.987 1.00 13.94 O ATOM 1597 H ASP B 36 -12.729 20.057 9.957 1.00 0.00 H ATOM 1598 N ASP B 37 -9.385 19.863 10.119 1.00 10.45 N ATOM 1599 CA ASP B 37 -8.035 19.386 10.403 1.00 10.97 C ATOM 1600 C ASP B 37 -7.706 18.154 9.567 1.00 11.15 C ATOM 1601 O ASP B 37 -6.614 18.059 8.993 1.00 11.51 O ATOM 1602 CB ASP B 37 -7.909 19.098 11.895 1.00 9.11 C ATOM 1603 CG ASP B 37 -6.566 18.494 12.272 1.00 24.22 C ATOM 1604 OD1 ASP B 37 -5.528 18.926 11.724 1.00 45.22 O ATOM 1605 OD2 ASP B 37 -6.553 17.607 13.152 1.00 44.21 O ATOM 1606 H ASP B 37 -10.133 19.743 10.832 1.00 0.00 H ATOM 1607 N PHE B 38 -8.641 17.204 9.482 1.00 9.71 N ATOM 1608 CA PHE B 38 -8.403 16.010 8.678 1.00 9.12 C ATOM 1609 C PHE B 38 -8.128 16.369 7.221 1.00 7.42 C ATOM 1610 O PHE B 38 -7.169 15.871 6.613 1.00 9.70 O ATOM 1611 CB PHE B 38 -9.599 15.065 8.782 1.00 7.51 C ATOM 1612 CG PHE B 38 -9.573 13.984 7.748 1.00 6.71 C ATOM 1613 CD1 PHE B 38 -8.564 13.034 7.756 1.00 8.82 C ATOM 1614 CD2 PHE B 38 -10.562 13.929 6.766 1.00 6.03 C ATOM 1615 CE1 PHE B 38 -8.541 12.021 6.778 1.00 9.50 C ATOM 1616 CE2 PHE B 38 -10.537 12.952 5.788 1.00 11.79 C ATOM 1617 CZ PHE B 38 -9.529 11.993 5.793 1.00 12.43 C ATOM 1618 H PHE B 38 -9.541 17.316 9.990 1.00 0.00 H ATOM 1619 N TYR B 39 -8.975 17.218 6.635 1.00 7.89 N ATOM 1620 CA TYR B 39 -8.772 17.599 5.243 1.00 9.80 C ATOM 1621 C TYR B 39 -7.397 18.207 5.042 1.00 10.09 C ATOM 1622 O TYR B 39 -6.694 17.872 4.078 1.00 11.31 O ATOM 1623 CB TYR B 39 -9.867 18.574 4.827 1.00 9.17 C ATOM 1624 CG TYR B 39 -9.935 18.890 3.349 1.00 8.66 C ATOM 1625 CD1 TYR B 39 -9.222 19.952 2.812 1.00 12.57 C ATOM 1626 CD2 TYR B 39 -10.748 18.144 2.499 1.00 9.14 C ATOM 1627 CE1 TYR B 39 -9.307 20.259 1.467 1.00 14.92 C ATOM 1628 CE2 TYR B 39 -10.842 18.440 1.162 1.00 12.24 C ATOM 1629 CZ TYR B 39 -10.130 19.492 0.653 1.00 13.62 C ATOM 1630 OH TYR B 39 -10.246 19.767 -0.685 1.00 15.72 O ATOM 1631 HH TYR B 39 -9.680 20.547 -0.911 1.00 0.00 H ATOM 1632 H TYR B 39 -9.778 17.607 7.170 1.00 0.00 H ATOM 1633 N SER B 40 -6.985 19.068 5.978 1.00 9.81 N ATOM 1634 CA SER B 40 -5.685 19.732 5.888 1.00 10.59 C ATOM 1635 C SER B 40 -4.539 18.736 5.964 1.00 12.60 C ATOM 1636 O SER B 40 -3.525 18.889 5.270 1.00 15.60 O ATOM 1637 CB SER B 40 -5.543 20.759 7.012 1.00 18.30 C ATOM 1638 OG SER B 40 -4.207 21.216 7.063 1.00 15.58 O ATOM 1639 HG SER B 40 -3.604 20.450 7.236 1.00 0.00 H ATOM 1640 H SER B 40 -7.603 19.270 6.789 1.00 0.00 H ATOM 1641 N GLN B 41 -4.676 17.718 6.812 1.00 12.13 N ATOM 1642 CA GLN B 41 -3.592 16.756 6.974 1.00 11.52 C ATOM 1643 C GLN B 41 -3.402 15.882 5.742 1.00 14.01 C ATOM 1644 O GLN B 41 -2.328 15.288 5.580 1.00 12.88 O ATOM 1645 CB GLN B 41 -3.823 15.868 8.192 1.00 11.89 C ATOM 1646 CG GLN B 41 -3.763 16.619 9.508 1.00 15.14 C ATOM 1647 CD GLN B 41 -3.702 15.700 10.699 1.00 25.42 C ATOM 1648 OE1 GLN B 41 -3.138 14.594 10.635 1.00 21.05 O ATOM 1649 NE2 GLN B 41 -4.279 16.145 11.804 1.00 19.61 N ATOM 1650 HE22 GLN B 41 -4.739 17.078 11.811 1.00 0.00 H ATOM 1651 HE21 GLN B 41 -4.272 15.562 12.665 1.00 0.00 H ATOM 1652 H GLN B 41 -5.555 17.609 7.358 1.00 0.00 H ATOM 1653 N CYS B 42 -4.400 15.793 4.864 1.00 12.76 N ATOM 1654 CA CYS B 42 -4.288 14.925 3.689 1.00 12.63 C ATOM 1655 C CYS B 42 -3.660 15.705 2.538 1.00 11.72 C ATOM 1656 O CYS B 42 -4.246 15.943 1.478 1.00 12.68 O ATOM 1657 CB CYS B 42 -5.646 14.354 3.315 1.00 11.20 C ATOM 1658 SG CYS B 42 -6.188 13.107 4.511 1.00 13.59 S ATOM 1659 H CYS B 42 -5.268 16.346 5.014 1.00 0.00 H ATOM 1660 N ASP B 43 -2.411 16.068 2.771 1.00 13.03 N ATOM 1661 CA ASP B 43 -1.621 16.941 1.925 1.00 14.79 C ATOM 1662 C ASP B 43 -1.214 16.258 0.618 1.00 12.52 C ATOM 1663 O ASP B 43 -0.422 15.312 0.659 1.00 13.50 O ATOM 1664 CB ASP B 43 -0.405 17.351 2.768 1.00 18.52 C ATOM 1665 CG ASP B 43 0.497 18.338 2.085 1.00 21.83 C ATOM 1666 OD1 ASP B 43 0.220 18.743 0.935 1.00 22.53 O ATOM 1667 OD2 ASP B 43 1.499 18.712 2.747 1.00 25.99 O ATOM 1668 H ASP B 43 -1.958 15.698 3.631 1.00 0.00 H ATOM 1669 N PRO B 44 -1.728 16.681 -0.541 1.00 14.65 N ATOM 1670 CA PRO B 44 -1.330 16.047 -1.806 1.00 17.65 C ATOM 1671 C PRO B 44 0.154 16.151 -2.092 1.00 18.25 C ATOM 1672 O PRO B 44 0.654 15.403 -2.941 1.00 20.68 O ATOM 1673 CB PRO B 44 -2.147 16.812 -2.858 1.00 20.95 C ATOM 1674 CG PRO B 44 -3.296 17.429 -2.061 1.00 21.93 C ATOM 1675 CD PRO B 44 -2.700 17.762 -0.749 1.00 16.77 C ATOM 1676 N GLU B 45 0.870 17.051 -1.411 1.00 18.43 N ATOM 1677 CA GLU B 45 2.298 17.204 -1.642 1.00 19.95 C ATOM 1678 C GLU B 45 3.115 16.110 -0.966 1.00 20.42 C ATOM 1679 O GLU B 45 4.284 15.927 -1.324 1.00 19.88 O ATOM 1680 CB GLU B 45 2.749 18.597 -1.173 1.00 22.52 C ATOM 1681 CG GLU B 45 2.023 19.721 -1.927 1.00 30.62 C ATOM 1682 CD GLU B 45 2.334 21.139 -1.425 1.00 27.44 C ATOM 1683 OE1 GLU B 45 3.053 21.305 -0.416 1.00 29.69 O ATOM 1684 OE2 GLU B 45 1.849 22.094 -2.065 1.00 31.15 O ATOM 1685 H GLU B 45 0.399 17.651 -0.705 1.00 0.00 H ATOM 1686 N LYS B 46 2.531 15.390 -0.001 1.00 16.42 N ATOM 1687 CA LYS B 46 3.217 14.328 0.722 1.00 15.36 C ATOM 1688 C LYS B 46 3.179 13.025 -0.078 1.00 13.50 C ATOM 1689 O LYS B 46 2.498 12.913 -1.101 1.00 16.46 O ATOM 1690 CB LYS B 46 2.589 14.128 2.104 1.00 16.85 C ATOM 1691 CG LYS B 46 2.893 15.259 3.067 1.00 20.62 C ATOM 1692 CD LYS B 46 2.316 15.026 4.459 1.00 33.39 C ATOM 1693 CE LYS B 46 2.873 16.035 5.462 1.00 43.79 C ATOM 1694 NZ LYS B 46 2.319 15.856 6.841 1.00 47.72 N ATOM 1695 HZ1 LYS B 46 1.286 15.972 6.816 1.00 0.00 H ATOM 1696 HZ2 LYS B 46 2.554 14.904 7.187 1.00 0.00 H ATOM 1697 HZ3 LYS B 46 2.734 16.568 7.475 1.00 0.00 H ATOM 1698 H LYS B 46 1.542 15.598 0.244 1.00 0.00 H ATOM 1699 N GLU B 47 3.910 12.053 0.420 1.00 16.41 N ATOM 1700 CA GLU B 47 3.844 10.696 -0.086 1.00 15.29 C ATOM 1701 C GLU B 47 2.434 10.113 0.187 1.00 13.93 C ATOM 1702 O GLU B 47 1.633 10.735 0.827 1.00 15.10 O ATOM 1703 CB GLU B 47 4.865 9.853 0.619 1.00 19.46 C ATOM 1704 CG GLU B 47 6.283 10.208 0.208 1.00 40.93 C ATOM 1705 CD GLU B 47 7.317 9.518 1.087 1.00 56.79 C ATOM 1706 OE1 GLU B 47 7.409 9.804 2.299 1.00 57.01 O ATOM 1707 OE2 GLU B 47 7.985 8.645 0.540 1.00 63.09 O ATOM 1708 H GLU B 47 4.559 12.265 1.205 1.00 0.00 H ATOM 1709 N ASN B 48 2.185 8.909 -0.297 1.00 11.62 N ATOM 1710 CA ASN B 48 0.859 8.333 -0.091 1.00 12.37 C ATOM 1711 C ASN B 48 0.439 8.229 1.373 1.00 13.49 C ATOM 1712 O ASN B 48 1.118 7.693 2.152 1.00 13.75 O ATOM 1713 CB ASN B 48 0.659 7.017 -0.850 1.00 13.64 C ATOM 1714 CG ASN B 48 1.792 6.020 -0.691 1.00 12.98 C ATOM 1715 OD1 ASN B 48 2.417 5.920 0.324 1.00 16.85 O ATOM 1716 ND2 ASN B 48 1.994 5.287 -1.699 1.00 15.25 N ATOM 1717 HD22 ASN B 48 1.422 5.415 -2.558 1.00 0.00 H ATOM 1718 HD21 ASN B 48 2.732 4.555 -1.670 1.00 0.00 H ATOM 1719 H ASN B 48 2.918 8.383 -0.814 1.00 0.00 H ATOM 1720 N LEU B 49 -0.728 8.766 1.695 1.00 10.11 N ATOM 1721 CA LEU B 49 -1.225 8.757 3.044 1.00 9.54 C ATOM 1722 C LEU B 49 -2.504 7.934 3.231 1.00 10.14 C ATOM 1723 O LEU B 49 -3.198 7.712 2.311 1.00 8.51 O ATOM 1724 CB LEU B 49 -1.540 10.188 3.518 1.00 9.70 C ATOM 1725 CG LEU B 49 -0.365 11.161 3.580 1.00 13.21 C ATOM 1726 CD1 LEU B 49 -0.828 12.579 3.859 1.00 9.78 C ATOM 1727 CD2 LEU B 49 0.661 10.749 4.626 1.00 12.54 C ATOM 1728 H LEU B 49 -1.303 9.208 0.949 1.00 0.00 H ATOM 1729 N CYS B 50 -2.711 7.523 4.499 1.00 10.38 N ATOM 1730 CA CYS B 50 -3.866 6.723 4.889 1.00 10.97 C ATOM 1731 C CYS B 50 -4.529 7.335 6.108 1.00 10.14 C ATOM 1732 O CYS B 50 -3.872 7.987 6.921 1.00 9.73 O ATOM 1733 CB CYS B 50 -3.502 5.291 5.269 1.00 12.55 C ATOM 1734 SG CYS B 50 -2.400 4.429 4.149 1.00 14.87 S ATOM 1735 H CYS B 50 -2.018 7.788 5.228 1.00 0.00 H ATOM 1736 N LEU B 51 -5.818 7.035 6.274 1.00 6.59 N ATOM 1737 CA LEU B 51 -6.572 7.393 7.471 1.00 6.24 C ATOM 1738 C LEU B 51 -6.782 6.147 8.327 1.00 9.15 C ATOM 1739 O LEU B 51 -7.370 5.159 7.861 1.00 9.64 O ATOM 1740 CB LEU B 51 -7.902 8.044 7.090 1.00 10.67 C ATOM 1741 CG LEU B 51 -8.823 8.330 8.292 1.00 7.71 C ATOM 1742 CD1 LEU B 51 -8.252 9.338 9.306 1.00 10.07 C ATOM 1743 CD2 LEU B 51 -10.179 8.799 7.769 1.00 8.64 C ATOM 1744 H LEU B 51 -6.309 6.522 5.514 1.00 0.00 H ATOM 1745 N TYR B 52 -6.251 6.178 9.552 1.00 10.74 N ATOM 1746 CA TYR B 52 -6.377 5.095 10.521 1.00 8.44 C ATOM 1747 C TYR B 52 -7.319 5.496 11.640 1.00 9.90 C ATOM 1748 O TYR B 52 -7.311 6.649 12.090 1.00 11.50 O ATOM 1749 CB TYR B 52 -5.026 4.751 11.167 1.00 9.50 C ATOM 1750 CG TYR B 52 -4.002 4.170 10.232 1.00 10.95 C ATOM 1751 CD1 TYR B 52 -3.156 4.999 9.492 1.00 11.34 C ATOM 1752 CD2 TYR B 52 -3.866 2.800 10.107 1.00 13.48 C ATOM 1753 CE1 TYR B 52 -2.201 4.472 8.659 1.00 15.24 C ATOM 1754 CE2 TYR B 52 -2.923 2.269 9.276 1.00 18.82 C ATOM 1755 CZ TYR B 52 -2.097 3.106 8.546 1.00 18.98 C ATOM 1756 OH TYR B 52 -1.148 2.553 7.717 1.00 20.20 O ATOM 1757 HH TYR B 52 -1.594 1.989 7.036 1.00 0.00 H ATOM 1758 H TYR B 52 -5.716 7.025 9.832 1.00 0.00 H ATOM 1759 N GLY B 53 -8.108 4.539 12.109 1.00 8.91 N ATOM 1760 CA GLY B 53 -8.828 4.731 13.355 1.00 8.17 C ATOM 1761 C GLY B 53 -8.366 3.706 14.370 1.00 9.46 C ATOM 1762 O GLY B 53 -8.254 2.529 14.049 1.00 8.70 O ATOM 1763 H GLY B 53 -8.211 3.648 11.583 1.00 0.00 H ATOM 1764 N HIS B 54 -8.092 4.137 15.591 1.00 12.63 N ATOM 1765 CA HIS B 54 -7.493 3.280 16.603 1.00 11.87 C ATOM 1766 C HIS B 54 -8.471 2.936 17.721 1.00 10.61 C ATOM 1767 O HIS B 54 -9.451 3.654 17.952 1.00 12.10 O ATOM 1768 CB HIS B 54 -6.263 3.976 17.203 1.00 13.25 C ATOM 1769 CG HIS B 54 -5.180 4.243 16.207 1.00 13.50 C ATOM 1770 ND1 HIS B 54 -4.475 3.232 15.596 1.00 15.14 N ATOM 1771 CD2 HIS B 54 -4.672 5.404 15.725 1.00 14.83 C ATOM 1772 CE1 HIS B 54 -3.578 3.758 14.778 1.00 15.55 C ATOM 1773 NE2 HIS B 54 -3.675 5.072 14.841 1.00 13.95 N ATOM 1774 H HIS B 54 -8.313 5.123 15.836 1.00 0.00 H ATOM 1775 N PRO B 55 -8.227 1.833 18.445 1.00 10.43 N ATOM 1776 CA PRO B 55 -9.183 1.392 19.473 1.00 11.15 C ATOM 1777 C PRO B 55 -9.246 2.296 20.696 1.00 12.94 C ATOM 1778 O PRO B 55 -10.148 2.103 21.523 1.00 14.11 O ATOM 1779 CB PRO B 55 -8.693 -0.024 19.844 1.00 12.28 C ATOM 1780 CG PRO B 55 -7.316 -0.101 19.347 1.00 13.74 C ATOM 1781 CD PRO B 55 -7.223 0.801 18.148 1.00 15.00 C ATOM 1782 N ASN B 56 -8.360 3.285 20.827 1.00 12.72 N ATOM 1783 CA ASN B 56 -8.530 4.324 21.840 1.00 12.17 C ATOM 1784 C ASN B 56 -9.319 5.518 21.316 1.00 15.11 C ATOM 1785 O ASN B 56 -9.352 6.570 21.966 1.00 12.95 O ATOM 1786 CB ASN B 56 -7.168 4.795 22.369 1.00 15.84 C ATOM 1787 CG ASN B 56 -6.358 5.562 21.327 1.00 14.36 C ATOM 1788 OD1 ASN B 56 -6.730 5.657 20.148 1.00 12.58 O ATOM 1789 ND2 ASN B 56 -5.258 6.157 21.773 1.00 13.86 N ATOM 1790 HD22 ASN B 56 -4.978 6.054 22.769 1.00 0.00 H ATOM 1791 HD21 ASN B 56 -4.676 6.726 21.126 1.00 0.00 H ATOM 1792 H ASN B 56 -7.533 3.317 20.197 1.00 0.00 H ATOM 1793 N GLU B 57 -9.947 5.379 20.145 1.00 10.79 N ATOM 1794 CA GLU B 57 -10.813 6.380 19.539 1.00 12.45 C ATOM 1795 C GLU B 57 -10.039 7.576 18.997 1.00 8.65 C ATOM 1796 O GLU B 57 -10.632 8.616 18.708 1.00 15.09 O ATOM 1797 CB GLU B 57 -11.917 6.829 20.509 1.00 11.51 C ATOM 1798 CG GLU B 57 -12.827 5.699 20.936 1.00 13.94 C ATOM 1799 CD GLU B 57 -14.084 6.155 21.661 1.00 30.46 C ATOM 1800 OE1 GLU B 57 -14.503 7.318 21.496 1.00 31.88 O ATOM 1801 OE2 GLU B 57 -14.648 5.333 22.407 1.00 39.96 O ATOM 1802 H GLU B 57 -9.807 4.488 19.627 1.00 0.00 H ATOM 1803 N SER B 58 -8.734 7.427 18.782 1.00 10.82 N ATOM 1804 CA SER B 58 -7.961 8.441 18.080 1.00 10.47 C ATOM 1805 C SER B 58 -7.955 8.127 16.586 1.00 11.87 C ATOM 1806 O SER B 58 -7.994 6.962 16.185 1.00 10.90 O ATOM 1807 CB SER B 58 -6.522 8.509 18.606 1.00 12.38 C ATOM 1808 OG SER B 58 -5.748 7.357 18.267 1.00 12.54 O ATOM 1809 HG SER B 58 -6.172 6.550 18.654 1.00 0.00 H ATOM 1810 H SER B 58 -8.257 6.568 19.123 1.00 0.00 H ATOM 1811 N TRP B 59 -7.965 9.179 15.768 1.00 10.31 N ATOM 1812 CA TRP B 59 -7.728 9.035 14.336 1.00 8.70 C ATOM 1813 C TRP B 59 -6.366 9.614 13.976 1.00 11.57 C ATOM 1814 O TRP B 59 -5.822 10.488 14.665 1.00 10.70 O ATOM 1815 CB TRP B 59 -8.842 9.687 13.481 1.00 7.92 C ATOM 1816 CG TRP B 59 -8.997 11.177 13.584 1.00 10.98 C ATOM 1817 CD1 TRP B 59 -9.897 11.843 14.362 1.00 10.23 C ATOM 1818 CD2 TRP B 59 -8.268 12.182 12.851 1.00 9.45 C ATOM 1819 NE1 TRP B 59 -9.767 13.210 14.178 1.00 11.69 N ATOM 1820 CE2 TRP B 59 -8.772 13.440 13.256 1.00 12.62 C ATOM 1821 CE3 TRP B 59 -7.232 12.136 11.895 1.00 7.88 C ATOM 1822 CZ2 TRP B 59 -8.280 14.649 12.735 1.00 10.72 C ATOM 1823 CZ3 TRP B 59 -6.730 13.346 11.388 1.00 12.55 C ATOM 1824 CH2 TRP B 59 -7.270 14.581 11.809 1.00 10.75 C ATOM 1825 HE1 TRP B 59 -10.329 13.942 14.658 1.00 0.00 H ATOM 1826 H TRP B 59 -8.146 10.125 16.160 1.00 0.00 H ATOM 1827 N GLU B 60 -5.800 9.094 12.892 1.00 10.79 N ATOM 1828 CA GLU B 60 -4.423 9.407 12.537 1.00 12.01 C ATOM 1829 C GLU B 60 -4.290 9.341 11.030 1.00 9.83 C ATOM 1830 O GLU B 60 -4.755 8.369 10.429 1.00 10.69 O ATOM 1831 CB GLU B 60 -3.453 8.408 13.189 1.00 12.45 C ATOM 1832 CG GLU B 60 -2.001 8.692 12.905 1.00 18.93 C ATOM 1833 CD GLU B 60 -1.081 7.518 13.240 1.00 22.49 C ATOM 1834 OE1 GLU B 60 -1.567 6.438 13.642 1.00 20.42 O ATOM 1835 OE2 GLU B 60 0.145 7.681 13.105 1.00 19.44 O ATOM 1836 H GLU B 60 -6.350 8.452 12.286 1.00 0.00 H ATOM 1837 N VAL B 61 -3.656 10.350 10.423 1.00 9.29 N ATOM 1838 CA VAL B 61 -3.282 10.296 9.012 1.00 10.06 C ATOM 1839 C VAL B 61 -1.784 10.029 8.969 1.00 12.35 C ATOM 1840 O VAL B 61 -1.014 10.732 9.634 1.00 14.98 O ATOM 1841 CB VAL B 61 -3.648 11.593 8.272 1.00 10.00 C ATOM 1842 CG1 VAL B 61 -2.948 11.659 6.893 1.00 11.09 C ATOM 1843 CG2 VAL B 61 -5.151 11.707 8.107 1.00 9.34 C ATOM 1844 H VAL B 61 -3.422 11.201 10.973 1.00 0.00 H ATOM 1845 N ASN B 62 -1.365 8.987 8.247 1.00 10.09 N ATOM 1846 CA ASN B 62 0.059 8.647 8.236 1.00 8.77 C ATOM 1847 C ASN B 62 0.377 7.813 7.002 1.00 13.94 C ATOM 1848 O ASN B 62 -0.509 7.414 6.245 1.00 13.23 O ATOM 1849 CB ASN B 62 0.462 7.924 9.529 1.00 15.09 C ATOM 1850 CG ASN B 62 1.896 8.251 9.963 1.00 21.67 C ATOM 1851 OD1 ASN B 62 2.777 8.405 9.121 1.00 18.27 O ATOM 1852 ND2 ASN B 62 2.119 8.383 11.266 1.00 24.51 N ATOM 1853 HD22 ASN B 62 1.342 8.243 11.943 1.00 0.00 H ATOM 1854 HD21 ASN B 62 3.070 8.626 11.609 1.00 0.00 H ATOM 1855 H ASN B 62 -2.044 8.422 7.698 1.00 0.00 H ATOM 1856 N LEU B 63 1.678 7.586 6.794 1.00 15.23 N ATOM 1857 CA LEU B 63 2.128 6.698 5.736 1.00 14.93 C ATOM 1858 C LEU B 63 1.649 5.277 6.028 1.00 14.79 C ATOM 1859 O LEU B 63 1.331 4.944 7.172 1.00 18.57 O ATOM 1860 CB LEU B 63 3.655 6.727 5.650 1.00 17.81 C ATOM 1861 CG LEU B 63 4.252 8.073 5.232 1.00 20.26 C ATOM 1862 CD1 LEU B 63 5.763 8.073 5.474 1.00 29.49 C ATOM 1863 CD2 LEU B 63 3.949 8.350 3.766 1.00 25.01 C ATOM 1864 H LEU B 63 2.381 8.054 7.401 1.00 0.00 H ATOM 1865 N PRO B 64 1.608 4.414 5.015 1.00 11.75 N ATOM 1866 CA PRO B 64 1.261 3.016 5.261 1.00 12.51 C ATOM 1867 C PRO B 64 2.318 2.322 6.106 1.00 19.57 C ATOM 1868 O PRO B 64 3.456 2.786 6.264 1.00 17.99 O ATOM 1869 CB PRO B 64 1.174 2.413 3.856 1.00 18.47 C ATOM 1870 CG PRO B 64 2.085 3.278 3.032 1.00 21.86 C ATOM 1871 CD PRO B 64 1.889 4.673 3.590 1.00 16.80 C ATOM 1872 N ALA B 65 1.904 1.175 6.649 1.00 20.89 N ATOM 1873 CA ALA B 65 2.766 0.360 7.496 1.00 23.75 C ATOM 1874 C ALA B 65 4.020 -0.086 6.752 1.00 33.38 C ATOM 1875 O ALA B 65 3.967 -0.466 5.575 1.00 22.02 O ATOM 1876 CB ALA B 65 2.003 -0.871 7.995 1.00 24.03 C ATOM 1877 H ALA B 65 0.933 0.852 6.461 1.00 0.00 H ATOM 1878 N GLU B 66 5.152 -0.055 7.463 1.00 23.35 N ATOM 1879 CA GLU B 66 6.420 -0.517 6.904 1.00 37.00 C ATOM 1880 C GLU B 66 6.576 -2.025 7.013 1.00 31.56 C ATOM 1881 O GLU B 66 7.285 -2.632 6.201 1.00 31.29 O ATOM 1882 CB GLU B 66 7.597 0.155 7.609 1.00 46.70 C ATOM 1883 CG GLU B 66 7.946 1.528 7.082 1.00 56.59 C ATOM 1884 CD GLU B 66 9.198 2.085 7.724 1.00 64.18 C ATOM 1885 OE1 GLU B 66 9.642 1.525 8.751 1.00 67.08 O ATOM 1886 OE2 GLU B 66 9.741 3.079 7.191 1.00 67.22 O ATOM 1887 H GLU B 66 5.129 0.307 8.438 1.00 0.00 H ATOM 1888 N GLU B 67 5.957 -2.633 8.016 1.00 36.99 N ATOM 1889 CA GLU B 67 6.009 -4.079 8.179 1.00 37.05 C ATOM 1890 C GLU B 67 5.128 -4.704 7.103 1.00 37.06 C ATOM 1891 O GLU B 67 3.907 -4.508 7.100 1.00 32.43 O ATOM 1892 CB GLU B 67 5.555 -4.456 9.589 1.00 46.76 C ATOM 1893 CG GLU B 67 4.992 -5.858 9.749 1.00 52.95 C ATOM 1894 CD GLU B 67 6.086 -6.917 9.779 1.00 62.89 C ATOM 1895 OE1 GLU B 67 5.817 -8.066 9.356 1.00 61.18 O ATOM 1896 OE2 GLU B 67 7.218 -6.593 10.215 1.00 66.54 O ATOM 1897 H GLU B 67 5.422 -2.064 8.702 1.00 0.00 H ATOM 1898 N VAL B 68 5.750 -5.402 6.154 1.00 23.24 N ATOM 1899 CA VAL B 68 5.037 -5.991 5.023 1.00 25.32 C ATOM 1900 C VAL B 68 5.375 -7.478 4.955 1.00 24.05 C ATOM 1901 O VAL B 68 6.559 -7.841 4.986 1.00 30.82 O ATOM 1902 CB VAL B 68 5.387 -5.275 3.707 1.00 30.31 C ATOM 1903 CG1 VAL B 68 4.644 -5.909 2.541 1.00 19.32 C ATOM 1904 CG2 VAL B 68 5.066 -3.782 3.792 1.00 24.04 C ATOM 1905 H VAL B 68 6.780 -5.532 6.221 1.00 0.00 H ATOM 1906 N PRO B 69 4.382 -8.380 4.889 1.00 23.57 N ATOM 1907 CA PRO B 69 2.951 -8.065 4.967 1.00 24.53 C ATOM 1908 C PRO B 69 2.549 -7.672 6.391 1.00 30.74 C ATOM 1909 O PRO B 69 3.060 -8.242 7.344 1.00 25.54 O ATOM 1910 CB PRO B 69 2.279 -9.372 4.532 1.00 25.28 C ATOM 1911 CG PRO B 69 3.264 -10.442 4.905 1.00 36.51 C ATOM 1912 CD PRO B 69 4.625 -9.824 4.696 1.00 26.71 C ATOM 1913 N PRO B 70 1.673 -6.683 6.531 1.00 48.29 N ATOM 1914 CA PRO B 70 1.293 -6.224 7.872 1.00 33.19 C ATOM 1915 C PRO B 70 0.396 -7.236 8.575 1.00 24.36 C ATOM 1916 O PRO B 70 -0.217 -8.104 7.954 1.00 26.45 O ATOM 1917 CB PRO B 70 0.555 -4.907 7.603 1.00 41.06 C ATOM 1918 CG PRO B 70 0.028 -5.054 6.210 1.00 46.10 C ATOM 1919 CD PRO B 70 1.033 -5.896 5.462 1.00 44.00 C ATOM 1920 N GLU B 71 0.348 -7.123 9.899 1.00 23.29 N ATOM 1921 CA GLU B 71 -0.545 -7.952 10.703 1.00 23.40 C ATOM 1922 C GLU B 71 -2.010 -7.664 10.369 1.00 21.21 C ATOM 1923 O GLU B 71 -2.717 -8.525 9.839 1.00 28.07 O ATOM 1924 CB GLU B 71 -0.274 -7.719 12.193 1.00 35.65 C ATOM 1925 CG GLU B 71 -1.278 -8.374 13.131 1.00 46.71 C ATOM 1926 CD GLU B 71 -1.067 -9.873 13.286 1.00 55.95 C ATOM 1927 OE1 GLU B 71 0.005 -10.378 12.874 1.00 45.36 O ATOM 1928 OE2 GLU B 71 -1.979 -10.544 13.826 1.00 47.47 O ATOM 1929 H GLU B 71 0.960 -6.428 10.372 1.00 0.00 H ATOM 1930 N LEU B 72 -2.463 -6.473 10.652 1.00 19.96 N ATOM 1931 CA LEU B 72 -3.841 -6.102 10.357 1.00 17.73 C ATOM 1932 C LEU B 72 -3.999 -5.691 8.900 1.00 13.62 C ATOM 1933 O LEU B 72 -3.064 -5.161 8.291 1.00 14.66 O ATOM 1934 CB LEU B 72 -4.266 -4.931 11.221 1.00 19.39 C ATOM 1935 CG LEU B 72 -5.303 -5.069 12.307 1.00 30.05 C ATOM 1936 CD1 LEU B 72 -4.850 -6.108 13.309 1.00 33.43 C ATOM 1937 CD2 LEU B 72 -5.425 -3.695 12.914 1.00 22.25 C ATOM 1938 H LEU B 72 -1.830 -5.777 11.095 1.00 0.00 H ATOM 1939 N PRO B 73 -5.182 -5.898 8.327 1.00 11.81 N ATOM 1940 CA PRO B 73 -5.502 -5.255 7.052 1.00 10.23 C ATOM 1941 C PRO B 73 -5.204 -3.766 7.116 1.00 11.05 C ATOM 1942 O PRO B 73 -5.353 -3.125 8.161 1.00 11.13 O ATOM 1943 CB PRO B 73 -6.996 -5.510 6.899 1.00 9.98 C ATOM 1944 CG PRO B 73 -7.208 -6.823 7.640 1.00 11.60 C ATOM 1945 CD PRO B 73 -6.267 -6.772 8.799 1.00 12.41 C ATOM 1946 N GLU B 74 -4.773 -3.222 5.981 1.00 11.64 N ATOM 1947 CA GLU B 74 -4.336 -1.846 5.826 1.00 13.18 C ATOM 1948 C GLU B 74 -5.413 -0.990 5.177 1.00 9.46 C ATOM 1949 O GLU B 74 -6.153 -1.472 4.309 1.00 10.92 O ATOM 1950 CB GLU B 74 -3.076 -1.810 4.964 1.00 11.90 C ATOM 1951 CG GLU B 74 -1.807 -2.057 5.795 1.00 18.10 C ATOM 1952 CD GLU B 74 -1.408 -0.806 6.571 1.00 32.88 C ATOM 1953 OE1 GLU B 74 -1.212 0.247 5.930 1.00 38.29 O ATOM 1954 OE2 GLU B 74 -1.325 -0.860 7.817 1.00 32.00 O ATOM 1955 H GLU B 74 -4.747 -3.830 5.138 1.00 0.00 H ATOM 1956 N PRO B 75 -5.530 0.281 5.572 1.00 8.78 N ATOM 1957 CA PRO B 75 -6.503 1.166 4.928 1.00 8.54 C ATOM 1958 C PRO B 75 -6.068 1.521 3.521 1.00 10.97 C ATOM 1959 O PRO B 75 -4.929 1.279 3.099 1.00 12.78 O ATOM 1960 CB PRO B 75 -6.543 2.434 5.797 1.00 10.40 C ATOM 1961 CG PRO B 75 -5.544 2.255 6.860 1.00 10.80 C ATOM 1962 CD PRO B 75 -4.767 0.965 6.629 1.00 12.33 C ATOM 1963 N ALA B 76 -7.006 2.149 2.815 1.00 9.04 N ATOM 1964 CA ALA B 76 -6.741 2.667 1.478 1.00 7.96 C ATOM 1965 C ALA B 76 -5.546 3.612 1.487 1.00 8.05 C ATOM 1966 O ALA B 76 -5.408 4.455 2.378 1.00 10.60 O ATOM 1967 CB ALA B 76 -7.968 3.417 0.944 1.00 9.87 C ATOM 1968 H ALA B 76 -7.952 2.273 3.228 1.00 0.00 H ATOM 1969 N LEU B 77 -4.687 3.435 0.490 1.00 10.78 N ATOM 1970 CA LEU B 77 -3.417 4.133 0.327 1.00 12.77 C ATOM 1971 C LEU B 77 -3.577 5.343 -0.586 1.00 9.77 C ATOM 1972 O LEU B 77 -4.199 5.239 -1.646 1.00 10.15 O ATOM 1973 CB LEU B 77 -2.405 3.159 -0.296 1.00 17.01 C ATOM 1974 CG LEU B 77 -1.011 3.681 -0.518 1.00 25.80 C ATOM 1975 CD1 LEU B 77 -0.502 4.064 0.862 1.00 23.27 C ATOM 1976 CD2 LEU B 77 -0.151 2.619 -1.181 1.00 22.59 C ATOM 1977 H LEU B 77 -4.942 2.738 -0.238 1.00 0.00 H ATOM 1978 N GLY B 78 -2.973 6.476 -0.214 1.00 9.63 N ATOM 1979 CA GLY B 78 -2.933 7.597 -1.146 1.00 10.52 C ATOM 1980 C GLY B 78 -4.197 8.438 -1.249 1.00 10.35 C ATOM 1981 O GLY B 78 -4.414 9.106 -2.272 1.00 10.37 O ATOM 1982 H GLY B 78 -2.538 6.557 0.727 1.00 0.00 H ATOM 1983 N ILE B 79 -5.016 8.488 -0.188 1.00 10.38 N ATOM 1984 CA ILE B 79 -6.222 9.312 -0.259 1.00 9.29 C ATOM 1985 C ILE B 79 -5.895 10.785 -0.498 1.00 10.11 C ATOM 1986 O ILE B 79 -6.701 11.513 -1.095 1.00 10.59 O ATOM 1987 CB ILE B 79 -7.088 9.121 1.001 1.00 9.25 C ATOM 1988 CG1 ILE B 79 -6.326 9.490 2.282 1.00 8.96 C ATOM 1989 CG2 ILE B 79 -7.652 7.699 1.019 1.00 12.15 C ATOM 1990 CD1 ILE B 79 -7.245 9.533 3.507 1.00 8.85 C ATOM 1991 H ILE B 79 -4.796 7.948 0.673 1.00 0.00 H ATOM 1992 N ASN B 80 -4.700 11.238 -0.098 1.00 8.89 N ATOM 1993 CA ASN B 80 -4.312 12.619 -0.364 1.00 9.57 C ATOM 1994 C ASN B 80 -4.124 12.898 -1.846 1.00 11.88 C ATOM 1995 O ASN B 80 -4.238 14.055 -2.260 1.00 10.61 O ATOM 1996 CB ASN B 80 -3.037 12.973 0.404 1.00 8.07 C ATOM 1997 CG ASN B 80 -1.896 11.995 0.143 1.00 13.55 C ATOM 1998 OD1 ASN B 80 -2.103 10.789 0.065 1.00 10.91 O ATOM 1999 ND2 ASN B 80 -0.677 12.515 0.042 1.00 11.15 N ATOM 2000 HD22 ASN B 80 -0.543 13.544 0.114 1.00 0.00 H ATOM 2001 HD21 ASN B 80 0.143 11.893 -0.109 1.00 0.00 H ATOM 2002 H ASN B 80 -4.046 10.603 0.404 1.00 0.00 H ATOM 2003 N PHE B 81 -3.861 11.867 -2.657 1.00 11.42 N ATOM 2004 CA PHE B 81 -3.683 12.074 -4.085 1.00 11.02 C ATOM 2005 C PHE B 81 -5.004 12.336 -4.793 1.00 14.42 C ATOM 2006 O PHE B 81 -4.997 12.747 -5.958 1.00 17.51 O ATOM 2007 CB PHE B 81 -3.016 10.856 -4.737 1.00 12.18 C ATOM 2008 CG PHE B 81 -1.607 10.581 -4.254 1.00 12.93 C ATOM 2009 CD1 PHE B 81 -0.902 11.527 -3.531 1.00 12.08 C ATOM 2010 CD2 PHE B 81 -0.985 9.376 -4.559 1.00 19.28 C ATOM 2011 CE1 PHE B 81 0.388 11.280 -3.101 1.00 16.57 C ATOM 2012 CE2 PHE B 81 0.311 9.116 -4.131 1.00 19.50 C ATOM 2013 CZ PHE B 81 0.998 10.072 -3.398 1.00 17.32 C ATOM 2014 H PHE B 81 -3.783 10.908 -2.262 1.00 0.00 H ATOM 2015 N ALA B 82 -6.137 12.089 -4.130 1.00 9.15 N ATOM 2016 CA ALA B 82 -7.447 12.280 -4.723 1.00 14.19 C ATOM 2017 C ALA B 82 -8.133 13.534 -4.226 1.00 11.54 C ATOM 2018 O ALA B 82 -9.212 13.866 -4.716 1.00 14.53 O ATOM 2019 CB ALA B 82 -8.337 11.062 -4.424 1.00 12.29 C ATOM 2020 H ALA B 82 -6.078 11.746 -3.150 1.00 0.00 H ATOM 2021 N ARG B 83 -7.533 14.230 -3.258 1.00 10.29 N ATOM 2022 CA ARG B 83 -8.240 15.282 -2.538 1.00 9.52 C ATOM 2023 C ARG B 83 -8.508 16.491 -3.434 1.00 10.86 C ATOM 2024 O ARG B 83 -9.628 17.000 -3.478 1.00 11.64 O ATOM 2025 CB ARG B 83 -7.434 15.677 -1.303 1.00 9.53 C ATOM 2026 CG ARG B 83 -8.189 16.601 -0.335 1.00 9.38 C ATOM 2027 CD ARG B 83 -7.240 17.348 0.607 1.00 8.99 C ATOM 2028 NE ARG B 83 -6.492 18.393 -0.106 1.00 9.86 N ATOM 2029 CZ ARG B 83 -5.655 19.242 0.486 1.00 14.28 C ATOM 2030 NH1 ARG B 83 -5.469 19.178 1.795 1.00 10.73 N ATOM 2031 NH2 ARG B 83 -5.005 20.159 -0.235 1.00 11.59 N ATOM 2032 HE ARG B 83 -6.625 18.474 -1.134 1.00 0.00 H ATOM 2033 HH12 ARG B 83 -4.816 19.840 2.260 1.00 0.00 H ATOM 2034 HH11 ARG B 83 -5.976 18.466 2.358 1.00 0.00 H ATOM 2035 HH22 ARG B 83 -4.352 20.820 0.232 1.00 0.00 H ATOM 2036 HH21 ARG B 83 -5.152 20.212 -1.263 1.00 0.00 H ATOM 2037 H ARG B 83 -6.545 14.018 -3.013 1.00 0.00 H ATOM 2038 N ASP B 84 -7.502 16.947 -4.184 1.00 12.52 N ATOM 2039 CA ASP B 84 -7.686 18.211 -4.885 1.00 15.61 C ATOM 2040 C ASP B 84 -8.510 18.100 -6.162 1.00 16.15 C ATOM 2041 O ASP B 84 -9.080 19.112 -6.586 1.00 18.43 O ATOM 2042 CB ASP B 84 -6.319 18.841 -5.181 1.00 13.30 C ATOM 2043 CG ASP B 84 -5.673 19.465 -3.936 1.00 18.21 C ATOM 2044 OD1 ASP B 84 -6.270 19.466 -2.833 1.00 12.60 O ATOM 2045 OD2 ASP B 84 -4.547 19.967 -4.059 1.00 18.58 O ATOM 2046 H ASP B 84 -6.612 16.415 -4.266 1.00 0.00 H ATOM 2047 N GLY B 85 -8.603 16.920 -6.773 1.00 9.53 N ATOM 2048 CA GLY B 85 -9.359 16.758 -8.004 1.00 14.30 C ATOM 2049 C GLY B 85 -10.824 16.414 -7.837 1.00 15.42 C ATOM 2050 O GLY B 85 -11.487 16.089 -8.828 1.00 19.21 O ATOM 2051 H GLY B 85 -8.123 16.095 -6.360 1.00 0.00 H ATOM 2052 N MET B 86 -11.354 16.474 -6.617 1.00 11.94 N ATOM 2053 CA MET B 86 -12.735 16.117 -6.324 1.00 16.85 C ATOM 2054 C MET B 86 -13.366 17.216 -5.493 1.00 9.07 C ATOM 2055 O MET B 86 -12.683 17.923 -4.764 1.00 13.30 O ATOM 2056 CB MET B 86 -12.854 14.792 -5.540 1.00 14.97 C ATOM 2057 CG MET B 86 -12.089 13.632 -6.135 1.00 15.23 C ATOM 2058 SD MET B 86 -12.260 12.166 -5.091 1.00 13.58 S ATOM 2059 CE MET B 86 -13.985 11.683 -5.320 1.00 12.78 C ATOM 2060 H MET B 86 -10.750 16.792 -5.832 1.00 0.00 H ATOM 2061 N GLN B 87 -14.690 17.350 -5.601 1.00 11.91 N ATOM 2062 CA GLN B 87 -15.422 18.155 -4.633 1.00 11.24 C ATOM 2063 C GLN B 87 -15.254 17.556 -3.245 1.00 11.39 C ATOM 2064 O GLN B 87 -15.180 16.343 -3.098 1.00 9.99 O ATOM 2065 CB GLN B 87 -16.899 18.195 -5.001 1.00 14.78 C ATOM 2066 CG GLN B 87 -17.142 18.585 -6.453 1.00 29.65 C ATOM 2067 CD GLN B 87 -16.850 20.042 -6.701 1.00 31.22 C ATOM 2068 OE1 GLN B 87 -17.335 20.912 -5.978 1.00 37.11 O ATOM 2069 NE2 GLN B 87 -16.030 20.321 -7.712 1.00 40.46 N ATOM 2070 HE22 GLN B 87 -15.644 19.552 -8.296 1.00 0.00 H ATOM 2071 HE21 GLN B 87 -15.775 21.308 -7.918 1.00 0.00 H ATOM 2072 H GLN B 87 -15.199 16.879 -6.377 1.00 0.00 H ATOM 2073 N ARG B 88 -15.190 18.418 -2.224 1.00 9.12 N ATOM 2074 CA ARG B 88 -14.925 17.933 -0.865 1.00 9.95 C ATOM 2075 C ARG B 88 -15.882 16.813 -0.448 1.00 13.96 C ATOM 2076 O ARG B 88 -15.444 15.791 0.102 1.00 10.21 O ATOM 2077 CB ARG B 88 -15.005 19.083 0.126 1.00 10.20 C ATOM 2078 CG ARG B 88 -14.754 18.659 1.563 1.00 11.37 C ATOM 2079 CD ARG B 88 -14.841 19.838 2.500 1.00 16.80 C ATOM 2080 NE ARG B 88 -13.804 20.817 2.166 1.00 15.79 N ATOM 2081 CZ ARG B 88 -13.109 21.488 3.075 1.00 17.14 C ATOM 2082 NH1 ARG B 88 -13.347 21.286 4.369 1.00 16.14 N ATOM 2083 NH2 ARG B 88 -12.168 22.359 2.685 1.00 16.84 N ATOM 2084 HE ARG B 88 -13.602 20.996 1.162 1.00 0.00 H ATOM 2085 HH12 ARG B 88 -12.805 21.810 5.085 1.00 0.00 H ATOM 2086 HH11 ARG B 88 -14.075 20.604 4.664 1.00 0.00 H ATOM 2087 HH22 ARG B 88 -11.621 22.887 3.395 1.00 0.00 H ATOM 2088 HH21 ARG B 88 -11.984 22.507 1.672 1.00 0.00 H ATOM 2089 H ARG B 88 -15.328 19.435 -2.394 1.00 0.00 H ATOM 2090 N LYS B 89 -17.194 16.975 -0.688 1.00 9.86 N ATOM 2091 CA LYS B 89 -18.109 15.934 -0.222 1.00 12.13 C ATOM 2092 C LYS B 89 -17.840 14.613 -0.934 1.00 10.06 C ATOM 2093 O LYS B 89 -17.926 13.540 -0.324 1.00 10.50 O ATOM 2094 CB LYS B 89 -19.566 16.355 -0.416 1.00 14.02 C ATOM 2095 CG LYS B 89 -20.565 15.192 -0.230 1.00 15.60 C ATOM 2096 CD LYS B 89 -22.001 15.719 -0.147 1.00 17.64 C ATOM 2097 CE LYS B 89 -23.023 14.584 -0.222 1.00 22.69 C ATOM 2098 NZ LYS B 89 -23.057 13.961 -1.575 1.00 33.26 N ATOM 2099 HZ1 LYS B 89 -23.314 14.681 -2.280 1.00 0.00 H ATOM 2100 HZ2 LYS B 89 -22.119 13.573 -1.800 1.00 0.00 H ATOM 2101 HZ3 LYS B 89 -23.762 13.196 -1.586 1.00 0.00 H ATOM 2102 H LYS B 89 -17.548 17.815 -1.190 1.00 0.00 H ATOM 2103 N ASP B 90 -17.496 14.665 -2.224 1.00 9.67 N ATOM 2104 CA ASP B 90 -17.217 13.426 -2.948 1.00 10.91 C ATOM 2105 C ASP B 90 -15.951 12.763 -2.428 1.00 10.09 C ATOM 2106 O ASP B 90 -15.882 11.529 -2.335 1.00 10.71 O ATOM 2107 CB ASP B 90 -17.098 13.700 -4.444 1.00 10.50 C ATOM 2108 CG ASP B 90 -18.382 14.243 -5.031 1.00 17.08 C ATOM 2109 OD1 ASP B 90 -19.457 13.787 -4.592 1.00 17.66 O ATOM 2110 OD2 ASP B 90 -18.307 15.091 -5.951 1.00 22.76 O ATOM 2111 H ASP B 90 -17.427 15.582 -2.710 1.00 0.00 H ATOM 2112 N TRP B 91 -14.936 13.566 -2.109 1.00 8.79 N ATOM 2113 CA TRP B 91 -13.715 13.005 -1.545 1.00 8.26 C ATOM 2114 C TRP B 91 -13.988 12.388 -0.173 1.00 8.14 C ATOM 2115 O TRP B 91 -13.552 11.262 0.109 1.00 7.20 O ATOM 2116 CB TRP B 91 -12.644 14.095 -1.467 1.00 10.16 C ATOM 2117 CG TRP B 91 -11.361 13.572 -0.935 1.00 8.47 C ATOM 2118 CD1 TRP B 91 -10.466 12.780 -1.590 1.00 9.58 C ATOM 2119 CD2 TRP B 91 -10.825 13.794 0.366 1.00 11.13 C ATOM 2120 NE1 TRP B 91 -9.397 12.488 -0.769 1.00 9.83 N ATOM 2121 CE2 TRP B 91 -9.596 13.094 0.437 1.00 7.57 C ATOM 2122 CE3 TRP B 91 -11.260 14.515 1.485 1.00 10.43 C ATOM 2123 CZ2 TRP B 91 -8.791 13.124 1.567 1.00 7.33 C ATOM 2124 CZ3 TRP B 91 -10.475 14.524 2.613 1.00 12.06 C ATOM 2125 CH2 TRP B 91 -9.254 13.824 2.654 1.00 9.29 C ATOM 2126 HE1 TRP B 91 -8.576 11.903 -1.026 1.00 0.00 H ATOM 2127 H TRP B 91 -15.015 14.592 -2.262 1.00 0.00 H ATOM 2128 N LEU B 92 -14.718 13.105 0.693 1.00 9.36 N ATOM 2129 CA LEU B 92 -15.045 12.543 2.001 1.00 7.47 C ATOM 2130 C LEU B 92 -15.830 11.250 1.845 1.00 8.70 C ATOM 2131 O LEU B 92 -15.655 10.323 2.638 1.00 7.86 O ATOM 2132 CB LEU B 92 -15.835 13.547 2.858 1.00 7.27 C ATOM 2133 CG LEU B 92 -15.060 14.802 3.203 1.00 6.57 C ATOM 2134 CD1 LEU B 92 -15.998 15.793 3.849 1.00 7.82 C ATOM 2135 CD2 LEU B 92 -13.925 14.429 4.164 1.00 7.63 C ATOM 2136 H LEU B 92 -15.050 14.056 0.435 1.00 0.00 H ATOM 2137 N SER B 93 -16.710 11.177 0.836 1.00 8.05 N ATOM 2138 CA SER B 93 -17.486 9.957 0.623 1.00 9.38 C ATOM 2139 C SER B 93 -16.579 8.808 0.197 1.00 9.78 C ATOM 2140 O SER B 93 -16.767 7.661 0.632 1.00 8.50 O ATOM 2141 CB SER B 93 -18.589 10.203 -0.419 1.00 11.18 C ATOM 2142 OG SER B 93 -19.518 11.205 0.010 1.00 6.95 O ATOM 2143 HG SER B 93 -20.209 11.332 -0.687 1.00 0.00 H ATOM 2144 H SER B 93 -16.841 11.991 0.203 1.00 0.00 H ATOM 2145 N LEU B 94 -15.578 9.105 -0.639 1.00 8.65 N ATOM 2146 CA LEU B 94 -14.600 8.096 -1.030 1.00 6.55 C ATOM 2147 C LEU B 94 -13.826 7.599 0.190 1.00 9.42 C ATOM 2148 O LEU B 94 -13.701 6.389 0.421 1.00 8.05 O ATOM 2149 CB LEU B 94 -13.654 8.692 -2.071 1.00 7.65 C ATOM 2150 CG LEU B 94 -12.575 7.757 -2.601 1.00 11.51 C ATOM 2151 CD1 LEU B 94 -13.241 6.484 -3.058 1.00 21.44 C ATOM 2152 CD2 LEU B 94 -11.878 8.423 -3.773 1.00 14.57 C ATOM 2153 H LEU B 94 -15.496 10.071 -1.016 1.00 0.00 H ATOM 2154 N VAL B 95 -13.310 8.530 0.999 1.00 7.45 N ATOM 2155 CA VAL B 95 -12.633 8.124 2.225 1.00 4.57 C ATOM 2156 C VAL B 95 -13.569 7.321 3.115 1.00 6.81 C ATOM 2157 O VAL B 95 -13.150 6.343 3.743 1.00 8.35 O ATOM 2158 CB VAL B 95 -12.090 9.347 2.981 1.00 5.75 C ATOM 2159 CG1 VAL B 95 -11.430 8.884 4.291 1.00 8.41 C ATOM 2160 CG2 VAL B 95 -11.072 10.096 2.117 1.00 7.09 C ATOM 2161 H VAL B 95 -13.391 9.538 0.755 1.00 0.00 H ATOM 2162 N ALA B 96 -14.831 7.749 3.218 1.00 5.97 N ATOM 2163 CA ALA B 96 -15.794 7.068 4.085 1.00 7.78 C ATOM 2164 C ALA B 96 -16.000 5.613 3.669 1.00 8.11 C ATOM 2165 O ALA B 96 -15.955 4.708 4.515 1.00 8.19 O ATOM 2166 CB ALA B 96 -17.121 7.814 4.073 1.00 9.18 C ATOM 2167 H ALA B 96 -15.134 8.581 2.672 1.00 0.00 H ATOM 2168 N VAL B 97 -16.237 5.354 2.374 1.00 4.97 N ATOM 2169 CA VAL B 97 -16.481 3.967 1.994 1.00 8.28 C ATOM 2170 C VAL B 97 -15.229 3.119 2.213 1.00 8.90 C ATOM 2171 O VAL B 97 -15.322 2.014 2.760 1.00 8.70 O ATOM 2172 CB VAL B 97 -17.026 3.842 0.559 1.00 9.69 C ATOM 2173 CG1 VAL B 97 -16.066 4.410 -0.471 1.00 7.17 C ATOM 2174 CG2 VAL B 97 -17.310 2.360 0.269 1.00 9.56 C ATOM 2175 H VAL B 97 -16.246 6.116 1.666 1.00 0.00 H ATOM 2176 N HIS B 98 -14.043 3.610 1.809 1.00 6.70 N ATOM 2177 CA HIS B 98 -12.837 2.815 2.064 1.00 7.64 C ATOM 2178 C HIS B 98 -12.633 2.588 3.551 1.00 5.76 C ATOM 2179 O HIS B 98 -12.141 1.524 3.959 1.00 6.82 O ATOM 2180 CB HIS B 98 -11.602 3.485 1.458 1.00 6.33 C ATOM 2181 CG HIS B 98 -11.494 3.302 -0.027 1.00 8.37 C ATOM 2182 ND1 HIS B 98 -11.015 2.147 -0.602 1.00 10.25 N ATOM 2183 CD2 HIS B 98 -11.794 4.139 -1.049 1.00 11.28 C ATOM 2184 CE1 HIS B 98 -11.009 2.283 -1.916 1.00 10.50 C ATOM 2185 NE2 HIS B 98 -11.490 3.479 -2.215 1.00 14.35 N ATOM 2186 H HIS B 98 -13.983 4.530 1.328 1.00 0.00 H ATOM 2187 N SER B 99 -13.032 3.555 4.381 1.00 6.73 N ATOM 2188 CA SER B 99 -12.855 3.393 5.820 1.00 7.16 C ATOM 2189 C SER B 99 -13.852 2.382 6.384 1.00 5.83 C ATOM 2190 O SER B 99 -13.495 1.562 7.237 1.00 6.74 O ATOM 2191 CB SER B 99 -13.002 4.752 6.494 1.00 6.84 C ATOM 2192 OG SER B 99 -11.939 5.602 6.110 1.00 7.59 O ATOM 2193 HG SER B 99 -11.078 5.195 6.382 1.00 0.00 H ATOM 2194 H SER B 99 -13.467 4.421 4.003 1.00 0.00 H ATOM 2195 N ASP B 100 -15.111 2.423 5.918 1.00 5.76 N ATOM 2196 CA ASP B 100 -16.070 1.395 6.299 1.00 7.84 C ATOM 2197 C ASP B 100 -15.559 0.010 5.923 1.00 7.68 C ATOM 2198 O ASP B 100 -15.677 -0.946 6.707 1.00 8.03 O ATOM 2199 CB ASP B 100 -17.394 1.645 5.586 1.00 6.48 C ATOM 2200 CG ASP B 100 -18.194 2.757 6.173 1.00 11.35 C ATOM 2201 OD1 ASP B 100 -18.268 2.839 7.422 1.00 11.35 O ATOM 2202 OD2 ASP B 100 -18.835 3.467 5.354 1.00 10.08 O ATOM 2203 H ASP B 100 -15.403 3.192 5.282 1.00 0.00 H ATOM 2204 N CYS B 101 -14.992 -0.111 4.717 1.00 6.23 N ATOM 2205 CA CYS B 101 -14.471 -1.397 4.268 1.00 6.22 C ATOM 2206 C CYS B 101 -13.316 -1.837 5.136 1.00 7.99 C ATOM 2207 O CYS B 101 -13.178 -3.024 5.437 1.00 7.53 O ATOM 2208 CB CYS B 101 -14.011 -1.314 2.819 1.00 7.65 C ATOM 2209 SG CYS B 101 -15.399 -1.038 1.701 1.00 9.55 S ATOM 2210 H CYS B 101 -14.922 0.719 4.095 1.00 0.00 H ATOM 2211 N TRP B 102 -12.471 -0.882 5.554 1.00 8.02 N ATOM 2212 CA TRP B 102 -11.332 -1.226 6.405 1.00 5.39 C ATOM 2213 C TRP B 102 -11.817 -1.706 7.764 1.00 7.12 C ATOM 2214 O TRP B 102 -11.307 -2.704 8.296 1.00 7.96 O ATOM 2215 CB TRP B 102 -10.407 -0.019 6.530 1.00 6.51 C ATOM 2216 CG TRP B 102 -9.206 -0.274 7.425 1.00 5.93 C ATOM 2217 CD1 TRP B 102 -8.160 -1.108 7.177 1.00 8.46 C ATOM 2218 CD2 TRP B 102 -8.974 0.300 8.715 1.00 7.21 C ATOM 2219 NE1 TRP B 102 -7.281 -1.095 8.228 1.00 7.76 N ATOM 2220 CE2 TRP B 102 -7.760 -0.232 9.190 1.00 5.97 C ATOM 2221 CE3 TRP B 102 -9.696 1.193 9.529 1.00 9.00 C ATOM 2222 CZ2 TRP B 102 -7.224 0.127 10.434 1.00 8.98 C ATOM 2223 CZ3 TRP B 102 -9.173 1.549 10.758 1.00 7.97 C ATOM 2224 CH2 TRP B 102 -7.950 1.015 11.206 1.00 9.37 C ATOM 2225 HE1 TRP B 102 -6.400 -1.644 8.290 1.00 0.00 H ATOM 2226 H TRP B 102 -12.627 0.107 5.272 1.00 0.00 H ATOM 2227 N LEU B 103 -12.820 -1.028 8.325 1.00 5.30 N ATOM 2228 CA LEU B 103 -13.347 -1.450 9.622 1.00 8.33 C ATOM 2229 C LEU B 103 -13.881 -2.875 9.549 1.00 9.36 C ATOM 2230 O LEU B 103 -13.636 -3.697 10.448 1.00 8.28 O ATOM 2231 CB LEU B 103 -14.451 -0.496 10.070 1.00 8.70 C ATOM 2232 CG LEU B 103 -14.066 0.921 10.474 1.00 12.54 C ATOM 2233 CD1 LEU B 103 -15.340 1.793 10.597 1.00 11.83 C ATOM 2234 CD2 LEU B 103 -13.312 0.862 11.812 1.00 10.26 C ATOM 2235 H LEU B 103 -13.226 -0.202 7.841 1.00 0.00 H ATOM 2236 N LEU B 104 -14.627 -3.189 8.481 1.00 6.12 N ATOM 2237 CA LEU B 104 -15.123 -4.552 8.310 1.00 6.74 C ATOM 2238 C LEU B 104 -13.974 -5.536 8.175 1.00 7.15 C ATOM 2239 O LEU B 104 -13.989 -6.625 8.783 1.00 7.88 O ATOM 2240 CB LEU B 104 -16.018 -4.648 7.077 1.00 9.05 C ATOM 2241 CG LEU B 104 -17.436 -4.115 7.152 1.00 14.33 C ATOM 2242 CD1 LEU B 104 -18.086 -4.285 5.782 1.00 8.56 C ATOM 2243 CD2 LEU B 104 -18.215 -4.848 8.235 1.00 9.65 C ATOM 2244 H LEU B 104 -14.853 -2.461 7.773 1.00 0.00 H ATOM 2245 N SER B 105 -12.964 -5.174 7.374 1.00 6.13 N ATOM 2246 CA SER B 105 -11.821 -6.051 7.181 1.00 8.21 C ATOM 2247 C SER B 105 -11.113 -6.335 8.497 1.00 6.60 C ATOM 2248 O SER B 105 -10.769 -7.484 8.784 1.00 7.63 O ATOM 2249 CB SER B 105 -10.843 -5.431 6.189 1.00 12.47 C ATOM 2250 OG SER B 105 -9.881 -6.394 5.827 1.00 8.70 O ATOM 2251 HG SER B 105 -9.243 -5.996 5.183 1.00 0.00 H ATOM 2252 H SER B 105 -12.998 -4.257 6.885 1.00 0.00 H ATOM 2253 N VAL B 106 -10.891 -5.298 9.303 1.00 5.68 N ATOM 2254 CA VAL B 106 -10.207 -5.481 10.581 1.00 5.70 C ATOM 2255 C VAL B 106 -11.021 -6.392 11.490 1.00 5.22 C ATOM 2256 O VAL B 106 -10.491 -7.340 12.083 1.00 6.30 O ATOM 2257 CB VAL B 106 -9.957 -4.117 11.242 1.00 7.91 C ATOM 2258 CG1 VAL B 106 -9.567 -4.316 12.720 1.00 8.39 C ATOM 2259 CG2 VAL B 106 -8.885 -3.345 10.465 1.00 7.29 C ATOM 2260 H VAL B 106 -11.208 -4.349 9.020 1.00 0.00 H ATOM 2261 N SER B 107 -12.328 -6.152 11.582 1.00 6.13 N ATOM 2262 CA SER B 107 -13.150 -6.951 12.496 1.00 5.40 C ATOM 2263 C SER B 107 -13.181 -8.415 12.098 1.00 4.65 C ATOM 2264 O SER B 107 -13.163 -9.298 12.962 1.00 8.33 O ATOM 2265 CB SER B 107 -14.583 -6.421 12.543 1.00 5.81 C ATOM 2266 OG SER B 107 -14.617 -5.117 13.080 1.00 9.25 O ATOM 2267 HG SER B 107 -14.251 -5.130 14.000 1.00 0.00 H ATOM 2268 H SER B 107 -12.763 -5.402 11.008 1.00 0.00 H ATOM 2269 N PHE B 108 -13.282 -8.698 10.792 1.00 5.71 N ATOM 2270 CA PHE B 108 -13.343 -10.097 10.390 1.00 5.80 C ATOM 2271 C PHE B 108 -11.970 -10.725 10.250 1.00 4.91 C ATOM 2272 O PHE B 108 -11.875 -11.956 10.203 1.00 10.47 O ATOM 2273 CB PHE B 108 -14.201 -10.230 9.124 1.00 8.41 C ATOM 2274 CG PHE B 108 -15.653 -10.150 9.458 1.00 7.06 C ATOM 2275 CD1 PHE B 108 -16.324 -11.286 9.925 1.00 9.75 C ATOM 2276 CD2 PHE B 108 -16.313 -8.915 9.499 1.00 7.03 C ATOM 2277 CE1 PHE B 108 -17.645 -11.207 10.330 1.00 11.00 C ATOM 2278 CE2 PHE B 108 -17.648 -8.832 9.896 1.00 8.89 C ATOM 2279 CZ PHE B 108 -18.322 -9.987 10.308 1.00 7.79 C ATOM 2280 H PHE B 108 -13.316 -7.938 10.083 1.00 0.00 H ATOM 2281 N TYR B 109 -10.909 -9.917 10.305 1.00 6.43 N ATOM 2282 CA TYR B 109 -9.578 -10.459 10.545 1.00 7.40 C ATOM 2283 C TYR B 109 -9.497 -10.990 11.966 1.00 10.58 C ATOM 2284 O TYR B 109 -9.130 -12.151 12.191 1.00 9.15 O ATOM 2285 CB TYR B 109 -8.513 -9.382 10.295 1.00 4.97 C ATOM 2286 CG TYR B 109 -7.131 -9.861 10.625 1.00 11.24 C ATOM 2287 CD1 TYR B 109 -6.420 -10.642 9.738 1.00 12.49 C ATOM 2288 CD2 TYR B 109 -6.560 -9.554 11.859 1.00 14.13 C ATOM 2289 CE1 TYR B 109 -5.131 -11.099 10.064 1.00 19.84 C ATOM 2290 CE2 TYR B 109 -5.301 -9.996 12.191 1.00 16.53 C ATOM 2291 CZ TYR B 109 -4.593 -10.765 11.298 1.00 23.27 C ATOM 2292 OH TYR B 109 -3.332 -11.190 11.652 1.00 25.79 O ATOM 2293 HH TYR B 109 -2.755 -10.403 11.822 1.00 0.00 H ATOM 2294 H TYR B 109 -11.033 -8.893 10.176 1.00 0.00 H ATOM 2295 N PHE B 110 -9.839 -10.143 12.939 1.00 7.30 N ATOM 2296 CA PHE B 110 -9.884 -10.608 14.323 1.00 5.72 C ATOM 2297 C PHE B 110 -10.880 -11.746 14.472 1.00 8.96 C ATOM 2298 O PHE B 110 -10.678 -12.660 15.297 1.00 8.83 O ATOM 2299 CB PHE B 110 -10.283 -9.467 15.269 1.00 7.78 C ATOM 2300 CG PHE B 110 -9.277 -8.354 15.389 1.00 5.86 C ATOM 2301 CD1 PHE B 110 -7.916 -8.599 15.426 1.00 11.52 C ATOM 2302 CD2 PHE B 110 -9.731 -7.040 15.539 1.00 9.54 C ATOM 2303 CE1 PHE B 110 -7.013 -7.538 15.592 1.00 9.46 C ATOM 2304 CE2 PHE B 110 -8.843 -5.982 15.696 1.00 10.40 C ATOM 2305 CZ PHE B 110 -7.481 -6.239 15.721 1.00 10.11 C ATOM 2306 H PHE B 110 -10.073 -9.155 12.713 1.00 0.00 H ATOM 2307 N GLY B 111 -11.951 -11.721 13.673 1.00 7.52 N ATOM 2308 CA GLY B 111 -12.976 -12.745 13.720 1.00 7.43 C ATOM 2309 C GLY B 111 -12.742 -13.972 12.852 1.00 7.83 C ATOM 2310 O GLY B 111 -13.689 -14.735 12.631 1.00 12.29 O ATOM 2311 H GLY B 111 -12.053 -10.940 12.994 1.00 0.00 H ATOM 2312 N ALA B 112 -11.513 -14.178 12.359 1.00 7.60 N ATOM 2313 CA ALA B 112 -11.301 -15.295 11.427 1.00 9.04 C ATOM 2314 C ALA B 112 -11.636 -16.637 12.074 1.00 10.55 C ATOM 2315 O ALA B 112 -12.098 -17.560 11.390 1.00 10.95 O ATOM 2316 CB ALA B 112 -9.861 -15.306 10.915 1.00 14.60 C ATOM 2317 H ALA B 112 -10.723 -13.559 12.631 1.00 0.00 H ATOM 2318 N ARG B 113 -11.463 -16.746 13.387 1.00 11.22 N ATOM 2319 CA ARG B 113 -11.666 -18.006 14.086 1.00 11.34 C ATOM 2320 C ARG B 113 -13.090 -18.155 14.620 1.00 10.23 C ATOM 2321 O ARG B 113 -13.416 -19.194 15.205 1.00 9.87 O ATOM 2322 CB ARG B 113 -10.623 -18.146 15.205 1.00 11.99 C ATOM 2323 CG ARG B 113 -9.198 -18.281 14.660 1.00 14.83 C ATOM 2324 CD ARG B 113 -8.173 -18.515 15.767 1.00 25.00 C ATOM 2325 NE ARG B 113 -6.829 -18.692 15.212 1.00 47.08 N ATOM 2326 CZ ARG B 113 -6.377 -19.818 14.653 1.00 55.27 C ATOM 2327 NH1 ARG B 113 -7.156 -20.894 14.555 1.00 48.39 N ATOM 2328 NH2 ARG B 113 -5.136 -19.871 14.182 1.00 46.22 N ATOM 2329 HE ARG B 113 -6.179 -17.881 15.256 1.00 0.00 H ATOM 2330 HH12 ARG B 113 -6.789 -21.763 14.117 1.00 0.00 H ATOM 2331 HH11 ARG B 113 -8.131 -20.865 14.916 1.00 0.00 H ATOM 2332 HH22 ARG B 113 -4.782 -20.747 13.746 1.00 0.00 H ATOM 2333 HH21 ARG B 113 -4.518 -19.037 14.249 1.00 0.00 H ATOM 2334 H ARG B 113 -11.174 -15.907 13.930 1.00 0.00 H ATOM 2335 N LEU B 114 -13.951 -17.172 14.388 1.00 6.22 N ATOM 2336 CA LEU B 114 -15.373 -17.335 14.685 1.00 5.94 C ATOM 2337 C LEU B 114 -16.027 -18.273 13.678 1.00 10.55 C ATOM 2338 O LEU B 114 -15.614 -18.352 12.512 1.00 12.16 O ATOM 2339 CB LEU B 114 -16.094 -15.979 14.661 1.00 10.72 C ATOM 2340 CG LEU B 114 -15.589 -14.896 15.612 1.00 10.93 C ATOM 2341 CD1 LEU B 114 -16.356 -13.590 15.388 1.00 13.36 C ATOM 2342 CD2 LEU B 114 -15.728 -15.382 17.055 1.00 12.52 C ATOM 2343 H LEU B 114 -13.610 -16.274 13.990 1.00 0.00 H ATOM 2344 N ASN B 115 -17.067 -18.986 14.129 1.00 9.30 N ATOM 2345 CA ASN B 115 -17.789 -19.882 13.235 1.00 9.93 C ATOM 2346 C ASN B 115 -18.903 -19.120 12.522 1.00 7.74 C ATOM 2347 O ASN B 115 -19.079 -17.909 12.707 1.00 8.13 O ATOM 2348 CB ASN B 115 -18.317 -21.108 13.998 1.00 10.80 C ATOM 2349 CG ASN B 115 -19.354 -20.762 15.062 1.00 15.13 C ATOM 2350 OD1 ASN B 115 -20.148 -19.827 14.909 1.00 10.78 O ATOM 2351 ND2 ASN B 115 -19.386 -21.565 16.124 1.00 16.22 N ATOM 2352 HD22 ASN B 115 -18.698 -22.340 16.211 1.00 0.00 H ATOM 2353 HD21 ASN B 115 -20.099 -21.417 16.866 1.00 0.00 H ATOM 2354 H ASN B 115 -17.361 -18.900 15.123 1.00 0.00 H ATOM 2355 N ARG B 116 -19.667 -19.842 11.700 1.00 9.83 N ATOM 2356 CA ARG B 116 -20.671 -19.206 10.847 1.00 10.76 C ATOM 2357 C ARG B 116 -21.683 -18.429 11.680 1.00 10.43 C ATOM 2358 O ARG B 116 -22.007 -17.274 11.373 1.00 9.03 O ATOM 2359 CB ARG B 116 -21.373 -20.271 9.985 1.00 10.32 C ATOM 2360 CG ARG B 116 -22.573 -19.789 9.184 1.00 9.96 C ATOM 2361 CD ARG B 116 -23.118 -20.962 8.369 1.00 8.62 C ATOM 2362 NE ARG B 116 -24.341 -20.617 7.662 1.00 9.55 N ATOM 2363 CZ ARG B 116 -25.556 -20.953 8.096 1.00 12.18 C ATOM 2364 NH1 ARG B 116 -25.693 -21.636 9.233 1.00 11.63 N ATOM 2365 NH2 ARG B 116 -26.625 -20.592 7.404 1.00 12.04 N ATOM 2366 HE ARG B 116 -24.264 -20.082 6.774 1.00 0.00 H ATOM 2367 HH12 ARG B 116 -26.641 -21.898 9.571 1.00 0.00 H ATOM 2368 HH11 ARG B 116 -24.852 -21.907 9.782 1.00 0.00 H ATOM 2369 HH22 ARG B 116 -27.574 -20.852 7.740 1.00 0.00 H ATOM 2370 HH21 ARG B 116 -26.516 -20.048 6.524 1.00 0.00 H ATOM 2371 H ARG B 116 -19.547 -20.874 11.665 1.00 0.00 H ATOM 2372 N ASN B 117 -22.190 -19.039 12.751 1.00 8.54 N ATOM 2373 CA ASN B 117 -23.217 -18.346 13.518 1.00 10.52 C ATOM 2374 C ASN B 117 -22.628 -17.191 14.325 1.00 8.83 C ATOM 2375 O ASN B 117 -23.292 -16.160 14.491 1.00 10.14 O ATOM 2376 CB ASN B 117 -23.957 -19.337 14.415 1.00 13.37 C ATOM 2377 CG ASN B 117 -24.959 -20.196 13.635 1.00 14.31 C ATOM 2378 OD1 ASN B 117 -25.329 -19.875 12.500 1.00 15.84 O ATOM 2379 ND2 ASN B 117 -25.409 -21.283 14.249 1.00 26.89 N ATOM 2380 HD22 ASN B 117 -25.072 -21.518 15.205 1.00 0.00 H ATOM 2381 HD21 ASN B 117 -26.099 -21.900 13.775 1.00 0.00 H ATOM 2382 H ASN B 117 -21.861 -19.985 13.032 1.00 0.00 H ATOM 2383 N GLU B 118 -21.374 -17.317 14.785 1.00 7.15 N ATOM 2384 CA GLU B 118 -20.722 -16.208 15.474 1.00 6.10 C ATOM 2385 C GLU B 118 -20.456 -15.041 14.534 1.00 8.61 C ATOM 2386 O GLU B 118 -20.606 -13.880 14.927 1.00 8.35 O ATOM 2387 CB GLU B 118 -19.405 -16.664 16.108 1.00 7.48 C ATOM 2388 CG GLU B 118 -19.655 -17.625 17.288 1.00 11.91 C ATOM 2389 CD GLU B 118 -18.430 -18.436 17.729 1.00 16.31 C ATOM 2390 OE1 GLU B 118 -17.510 -18.700 16.921 1.00 10.71 O ATOM 2391 OE2 GLU B 118 -18.414 -18.852 18.911 1.00 17.77 O ATOM 2392 H GLU B 118 -20.862 -18.212 14.649 1.00 0.00 H ATOM 2393 N ARG B 119 -20.010 -15.322 13.301 1.00 7.50 N ATOM 2394 CA ARG B 119 -19.775 -14.239 12.350 1.00 8.89 C ATOM 2395 C ARG B 119 -21.066 -13.506 12.023 1.00 9.71 C ATOM 2396 O ARG B 119 -21.059 -12.283 11.865 1.00 7.43 O ATOM 2397 CB ARG B 119 -19.136 -14.780 11.071 1.00 8.30 C ATOM 2398 CG ARG B 119 -17.746 -15.339 11.267 1.00 11.37 C ATOM 2399 CD ARG B 119 -17.106 -15.703 9.935 1.00 17.81 C ATOM 2400 NE ARG B 119 -17.827 -16.769 9.253 1.00 15.93 N ATOM 2401 CZ ARG B 119 -17.452 -18.048 9.239 1.00 20.79 C ATOM 2402 NH1 ARG B 119 -16.351 -18.446 9.886 1.00 16.43 N ATOM 2403 NH2 ARG B 119 -18.185 -18.935 8.579 1.00 15.50 N ATOM 2404 HE ARG B 119 -18.696 -16.514 8.741 1.00 0.00 H ATOM 2405 HH12 ARG B 119 -16.070 -19.447 9.867 1.00 0.00 H ATOM 2406 HH11 ARG B 119 -15.776 -17.754 10.408 1.00 0.00 H ATOM 2407 HH22 ARG B 119 -17.901 -19.935 8.562 1.00 0.00 H ATOM 2408 HH21 ARG B 119 -19.044 -18.630 8.078 1.00 0.00 H ATOM 2409 H ARG B 119 -19.832 -16.308 13.023 1.00 0.00 H ATOM 2410 N LYS B 120 -22.178 -14.248 11.906 1.00 8.11 N ATOM 2411 CA LYS B 120 -23.492 -13.637 11.693 1.00 9.02 C ATOM 2412 C LYS B 120 -23.855 -12.702 12.841 1.00 8.37 C ATOM 2413 O LYS B 120 -24.327 -11.579 12.615 1.00 9.24 O ATOM 2414 CB LYS B 120 -24.549 -14.731 11.530 1.00 12.96 C ATOM 2415 CG LYS B 120 -25.934 -14.198 11.179 1.00 20.31 C ATOM 2416 CD LYS B 120 -26.946 -15.337 11.076 1.00 31.16 C ATOM 2417 CE LYS B 120 -28.372 -14.827 11.216 1.00 46.71 C ATOM 2418 NZ LYS B 120 -29.355 -15.952 11.199 1.00 45.71 N ATOM 2419 HZ1 LYS B 120 -29.274 -16.468 10.300 1.00 0.00 H ATOM 2420 HZ2 LYS B 120 -29.155 -16.598 11.989 1.00 0.00 H ATOM 2421 HZ3 LYS B 120 -30.318 -15.571 11.296 1.00 0.00 H ATOM 2422 H LYS B 120 -22.105 -15.284 11.968 1.00 0.00 H ATOM 2423 N ARG B 121 -23.638 -13.151 14.079 1.00 7.81 N ATOM 2424 CA ARG B 121 -23.919 -12.295 15.230 1.00 7.63 C ATOM 2425 C ARG B 121 -23.065 -11.042 15.197 1.00 8.32 C ATOM 2426 O ARG B 121 -23.553 -9.936 15.470 1.00 9.77 O ATOM 2427 CB ARG B 121 -23.684 -13.065 16.530 1.00 9.03 C ATOM 2428 CG ARG B 121 -24.747 -14.146 16.788 1.00 15.59 C ATOM 2429 CD ARG B 121 -24.335 -15.123 17.902 1.00 17.07 C ATOM 2430 NE ARG B 121 -23.635 -14.435 18.985 1.00 18.03 N ATOM 2431 CZ ARG B 121 -22.626 -14.945 19.676 1.00 17.79 C ATOM 2432 NH1 ARG B 121 -22.181 -16.175 19.401 1.00 21.38 N ATOM 2433 NH2 ARG B 121 -22.048 -14.216 20.631 1.00 26.98 N ATOM 2434 HE ARG B 121 -23.952 -13.476 19.231 1.00 0.00 H ATOM 2435 HH12 ARG B 121 -21.389 -16.575 19.944 1.00 0.00 H ATOM 2436 HH11 ARG B 121 -22.627 -16.732 18.644 1.00 0.00 H ATOM 2437 HH22 ARG B 121 -21.256 -14.609 21.178 1.00 0.00 H ATOM 2438 HH21 ARG B 121 -22.390 -13.254 20.829 1.00 0.00 H ATOM 2439 H ARG B 121 -23.268 -14.112 14.225 1.00 0.00 H ATOM 2440 N LEU B 122 -21.771 -11.206 14.913 1.00 7.40 N ATOM 2441 CA LEU B 122 -20.874 -10.056 14.850 1.00 7.40 C ATOM 2442 C LEU B 122 -21.336 -9.054 13.801 1.00 7.76 C ATOM 2443 O LEU B 122 -21.365 -7.844 14.051 1.00 8.14 O ATOM 2444 CB LEU B 122 -19.463 -10.541 14.544 1.00 7.12 C ATOM 2445 CG LEU B 122 -18.473 -9.399 14.281 1.00 6.79 C ATOM 2446 CD1 LEU B 122 -18.415 -8.467 15.509 1.00 7.64 C ATOM 2447 CD2 LEU B 122 -17.087 -9.945 13.919 1.00 10.32 C ATOM 2448 H LEU B 122 -21.399 -12.161 14.735 1.00 0.00 H ATOM 2449 N PHE B 123 -21.689 -9.532 12.606 1.00 7.40 N ATOM 2450 CA PHE B 123 -22.142 -8.589 11.599 1.00 6.02 C ATOM 2451 C PHE B 123 -23.429 -7.904 12.039 1.00 7.22 C ATOM 2452 O PHE B 123 -23.613 -6.713 11.775 1.00 9.57 O ATOM 2453 CB PHE B 123 -22.342 -9.242 10.232 1.00 6.02 C ATOM 2454 CG PHE B 123 -22.598 -8.228 9.146 1.00 6.63 C ATOM 2455 CD1 PHE B 123 -21.536 -7.638 8.471 1.00 9.32 C ATOM 2456 CD2 PHE B 123 -23.899 -7.809 8.846 1.00 8.38 C ATOM 2457 CE1 PHE B 123 -21.775 -6.681 7.480 1.00 11.44 C ATOM 2458 CE2 PHE B 123 -24.130 -6.852 7.886 1.00 7.28 C ATOM 2459 CZ PHE B 123 -23.084 -6.290 7.198 1.00 9.20 C ATOM 2460 H PHE B 123 -21.641 -10.551 12.402 1.00 0.00 H ATOM 2461 N SER B 124 -24.327 -8.627 12.717 1.00 7.96 N ATOM 2462 CA SER B 124 -25.577 -7.997 13.138 1.00 8.43 C ATOM 2463 C SER B 124 -25.301 -6.805 14.048 1.00 10.86 C ATOM 2464 O SER B 124 -25.960 -5.764 13.934 1.00 9.40 O ATOM 2465 CB SER B 124 -26.490 -9.007 13.832 1.00 11.11 C ATOM 2466 OG SER B 124 -26.079 -9.260 15.161 1.00 12.95 O ATOM 2467 HG SER B 124 -25.158 -9.624 15.157 1.00 0.00 H ATOM 2468 H SER B 124 -24.138 -9.625 12.942 1.00 0.00 H ATOM 2469 N LEU B 125 -24.299 -6.926 14.926 1.00 9.46 N ATOM 2470 CA LEU B 125 -23.952 -5.810 15.811 1.00 11.01 C ATOM 2471 C LEU B 125 -23.340 -4.664 15.017 1.00 11.08 C ATOM 2472 O LEU B 125 -23.707 -3.496 15.195 1.00 9.95 O ATOM 2473 CB LEU B 125 -22.987 -6.301 16.898 1.00 8.13 C ATOM 2474 CG LEU B 125 -23.479 -7.442 17.790 1.00 9.07 C ATOM 2475 CD1 LEU B 125 -22.342 -7.893 18.662 1.00 11.17 C ATOM 2476 CD2 LEU B 125 -24.687 -6.993 18.646 1.00 11.18 C ATOM 2477 H LEU B 125 -23.764 -7.816 14.981 1.00 0.00 H ATOM 2478 N ILE B 126 -22.394 -4.983 14.128 1.00 9.67 N ATOM 2479 CA ILE B 126 -21.782 -3.965 13.279 1.00 7.06 C ATOM 2480 C ILE B 126 -22.844 -3.233 12.487 1.00 12.21 C ATOM 2481 O ILE B 126 -22.814 -2.005 12.352 1.00 11.57 O ATOM 2482 CB ILE B 126 -20.743 -4.625 12.348 1.00 8.29 C ATOM 2483 CG1 ILE B 126 -19.495 -4.943 13.167 1.00 11.23 C ATOM 2484 CG2 ILE B 126 -20.438 -3.754 11.142 1.00 13.05 C ATOM 2485 CD1 ILE B 126 -18.444 -5.765 12.398 1.00 11.53 C ATOM 2486 H ILE B 126 -22.089 -5.973 14.040 1.00 0.00 H ATOM 2487 N ASN B 127 -23.808 -3.987 11.965 1.00 10.17 N ATOM 2488 CA ASN B 127 -24.885 -3.483 11.126 1.00 10.04 C ATOM 2489 C ASN B 127 -25.890 -2.644 11.915 1.00 13.38 C ATOM 2490 O ASN B 127 -26.720 -1.963 11.304 1.00 15.19 O ATOM 2491 CB ASN B 127 -25.537 -4.707 10.466 1.00 10.58 C ATOM 2492 CG ASN B 127 -26.594 -4.366 9.413 1.00 17.61 C ATOM 2493 OD1 ASN B 127 -27.759 -4.709 9.581 1.00 20.69 O ATOM 2494 ND2 ASN B 127 -26.183 -3.735 8.338 1.00 18.00 N ATOM 2495 HD22 ASN B 127 -25.183 -3.466 8.244 1.00 0.00 H ATOM 2496 HD21 ASN B 127 -26.857 -3.504 7.581 1.00 0.00 H ATOM 2497 H ASN B 127 -23.791 -5.006 12.171 1.00 0.00 H ATOM 2498 N ASP B 128 -25.813 -2.641 13.244 1.00 11.96 N ATOM 2499 CA ASP B 128 -26.673 -1.775 14.046 1.00 14.10 C ATOM 2500 C ASP B 128 -26.194 -0.326 14.069 1.00 19.88 C ATOM 2501 O ASP B 128 -26.946 0.544 14.521 1.00 21.99 O ATOM 2502 CB ASP B 128 -26.774 -2.279 15.501 1.00 12.84 C ATOM 2503 CG ASP B 128 -27.528 -3.592 15.629 1.00 14.62 C ATOM 2504 OD1 ASP B 128 -28.392 -3.888 14.774 1.00 15.92 O ATOM 2505 OD2 ASP B 128 -27.236 -4.336 16.599 1.00 14.93 O ATOM 2506 H ASP B 128 -25.130 -3.265 13.719 1.00 0.00 H ATOM 2507 N LEU B 129 -24.969 -0.044 13.618 1.00 12.17 N ATOM 2508 CA LEU B 129 -24.488 1.329 13.589 1.00 12.90 C ATOM 2509 C LEU B 129 -24.484 1.849 12.158 1.00 13.52 C ATOM 2510 O LEU B 129 -24.083 1.112 11.253 1.00 14.28 O ATOM 2511 CB LEU B 129 -23.069 1.418 14.145 1.00 14.44 C ATOM 2512 CG LEU B 129 -22.935 0.825 15.539 1.00 17.15 C ATOM 2513 CD1 LEU B 129 -21.482 0.888 16.002 1.00 20.10 C ATOM 2514 CD2 LEU B 129 -23.890 1.513 16.513 1.00 20.58 C ATOM 2515 H LEU B 129 -24.353 -0.813 13.284 1.00 0.00 H ATOM 2516 N PRO B 130 -24.920 3.092 11.916 1.00 10.45 N ATOM 2517 CA PRO B 130 -24.842 3.648 10.556 1.00 9.31 C ATOM 2518 C PRO B 130 -23.408 3.593 10.051 1.00 11.41 C ATOM 2519 O PRO B 130 -22.456 3.757 10.822 1.00 11.03 O ATOM 2520 CB PRO B 130 -25.302 5.098 10.736 1.00 14.85 C ATOM 2521 CG PRO B 130 -26.054 5.100 12.028 1.00 24.41 C ATOM 2522 CD PRO B 130 -25.368 4.102 12.889 1.00 14.14 C ATOM 2523 N THR B 131 -23.254 3.362 8.752 1.00 9.54 N ATOM 2524 CA THR B 131 -21.893 3.378 8.233 1.00 7.18 C ATOM 2525 C THR B 131 -21.379 4.805 8.117 1.00 9.50 C ATOM 2526 O THR B 131 -22.147 5.768 8.082 1.00 9.74 O ATOM 2527 CB THR B 131 -21.806 2.726 6.853 1.00 8.96 C ATOM 2528 OG1 THR B 131 -22.584 3.486 5.931 1.00 10.50 O ATOM 2529 CG2 THR B 131 -22.318 1.299 6.903 1.00 12.20 C ATOM 2530 HG1 THR B 131 -22.532 3.069 5.035 1.00 0.00 H ATOM 2531 H THR B 131 -24.069 3.178 8.133 1.00 0.00 H ATOM 2532 N LEU B 132 -20.055 4.934 8.014 1.00 10.39 N ATOM 2533 CA LEU B 132 -19.470 6.259 7.801 1.00 8.83 C ATOM 2534 C LEU B 132 -19.981 6.875 6.506 1.00 10.29 C ATOM 2535 O LEU B 132 -20.270 8.076 6.444 1.00 12.13 O ATOM 2536 CB LEU B 132 -17.941 6.171 7.778 1.00 7.33 C ATOM 2537 CG LEU B 132 -17.291 5.582 9.023 1.00 8.83 C ATOM 2538 CD1 LEU B 132 -15.808 5.288 8.735 1.00 10.05 C ATOM 2539 CD2 LEU B 132 -17.394 6.552 10.169 1.00 10.32 C ATOM 2540 H LEU B 132 -19.441 4.097 8.085 1.00 0.00 H ATOM 2541 N PHE B 133 -20.133 6.055 5.467 1.00 7.72 N ATOM 2542 CA PHE B 133 -20.680 6.535 4.207 1.00 9.40 C ATOM 2543 C PHE B 133 -22.113 7.021 4.391 1.00 11.52 C ATOM 2544 O PHE B 133 -22.486 8.065 3.841 1.00 15.82 O ATOM 2545 CB PHE B 133 -20.598 5.410 3.172 1.00 11.11 C ATOM 2546 CG PHE B 133 -21.138 5.766 1.825 1.00 13.90 C ATOM 2547 CD1 PHE B 133 -20.373 6.489 0.921 1.00 15.71 C ATOM 2548 CD2 PHE B 133 -22.413 5.351 1.444 1.00 14.37 C ATOM 2549 CE1 PHE B 133 -20.857 6.777 -0.342 1.00 23.06 C ATOM 2550 CE2 PHE B 133 -22.899 5.661 0.192 1.00 20.56 C ATOM 2551 CZ PHE B 133 -22.120 6.368 -0.698 1.00 20.16 C ATOM 2552 H PHE B 133 -19.856 5.057 5.558 1.00 0.00 H ATOM 2553 N ASP B 134 -22.918 6.282 5.178 1.00 11.84 N ATOM 2554 CA ASP B 134 -24.286 6.692 5.521 1.00 12.98 C ATOM 2555 C ASP B 134 -24.279 8.125 6.042 1.00 14.59 C ATOM 2556 O ASP B 134 -25.027 8.991 5.574 1.00 15.17 O ATOM 2557 CB ASP B 134 -24.870 5.784 6.632 1.00 14.78 C ATOM 2558 CG ASP B 134 -25.434 4.435 6.152 1.00 27.86 C ATOM 2559 OD1 ASP B 134 -25.669 4.249 4.938 1.00 18.11 O ATOM 2560 OD2 ASP B 134 -25.673 3.561 7.056 1.00 18.47 O ATOM 2561 H ASP B 134 -22.556 5.384 5.558 1.00 0.00 H ATOM 2562 N VAL B 135 -23.404 8.389 7.012 1.00 12.08 N ATOM 2563 CA VAL B 135 -23.376 9.692 7.670 1.00 12.97 C ATOM 2564 C VAL B 135 -22.853 10.777 6.735 1.00 18.35 C ATOM 2565 O VAL B 135 -23.416 11.876 6.674 1.00 19.37 O ATOM 2566 CB VAL B 135 -22.541 9.617 8.955 1.00 15.44 C ATOM 2567 CG1 VAL B 135 -22.497 10.990 9.607 1.00 17.86 C ATOM 2568 CG2 VAL B 135 -23.130 8.599 9.904 1.00 16.93 C ATOM 2569 H VAL B 135 -22.729 7.654 7.305 1.00 0.00 H ATOM 2570 N VAL B 136 -21.759 10.505 6.013 1.00 13.94 N ATOM 2571 CA VAL B 136 -21.136 11.535 5.190 1.00 15.03 C ATOM 2572 C VAL B 136 -22.050 11.935 4.041 1.00 24.00 C ATOM 2573 O VAL B 136 -22.101 13.107 3.653 1.00 30.82 O ATOM 2574 CB VAL B 136 -19.752 11.057 4.696 1.00 18.56 C ATOM 2575 CG1 VAL B 136 -19.248 11.894 3.529 1.00 25.17 C ATOM 2576 CG2 VAL B 136 -18.777 11.147 5.823 1.00 17.11 C ATOM 2577 H VAL B 136 -21.349 9.549 6.039 1.00 0.00 H ATOM 2578 N THR B 137 -22.800 10.990 3.492 1.00 17.80 N ATOM 2579 CA THR B 137 -23.655 11.288 2.350 1.00 21.46 C ATOM 2580 C THR B 137 -25.041 11.769 2.746 1.00 26.69 C ATOM 2581 O THR B 137 -25.848 12.073 1.860 1.00 32.01 O ATOM 2582 CB THR B 137 -23.775 10.064 1.432 1.00 22.71 C ATOM 2583 OG1 THR B 137 -24.392 8.981 2.140 1.00 19.32 O ATOM 2584 CG2 THR B 137 -22.401 9.638 0.932 1.00 24.13 C ATOM 2585 HG1 THR B 137 -23.840 8.746 2.928 1.00 0.00 H ATOM 2586 H THR B 137 -22.778 10.025 3.880 1.00 0.00 H ATOM 2587 N GLY B 138 -25.335 11.844 4.042 1.00 25.43 N ATOM 2588 CA GLY B 138 -26.630 12.308 4.503 1.00 30.70 C ATOM 2589 C GLY B 138 -27.742 11.287 4.443 1.00 39.61 C ATOM 2590 O GLY B 138 -28.917 11.666 4.485 1.00 41.42 O ATOM 2591 H GLY B 138 -24.619 11.563 4.742 1.00 0.00 H ATOM 2592 N ARG B 139 -27.417 10.003 4.328 1.00 30.32 N ATOM 2593 CA ARG B 139 -28.433 8.957 4.322 1.00 29.54 C ATOM 2594 C ARG B 139 -28.926 8.653 5.737 1.00 41.05 C ATOM 2595 O ARG B 139 -28.336 9.099 6.728 1.00 42.52 O ATOM 2596 CB ARG B 139 -27.887 7.686 3.664 1.00 32.99 C ATOM 2597 CG ARG B 139 -27.817 7.751 2.131 1.00 25.02 C ATOM 2598 CD ARG B 139 -26.835 6.724 1.558 1.00 31.38 C ATOM 2599 NE ARG B 139 -27.018 6.499 0.122 1.00 44.33 N ATOM 2600 CZ ARG B 139 -26.383 7.165 -0.840 1.00 36.03 C ATOM 2601 NH1 ARG B 139 -25.504 8.111 -0.538 1.00 38.23 N ATOM 2602 NH2 ARG B 139 -26.622 6.879 -2.112 1.00 37.62 N ATOM 2603 HE ARG B 139 -27.695 5.764 -0.168 1.00 0.00 H ATOM 2604 HH12 ARG B 139 -25.013 8.626 -1.297 1.00 0.00 H ATOM 2605 HH11 ARG B 139 -25.306 8.338 0.457 1.00 0.00 H ATOM 2606 HH22 ARG B 139 -26.126 7.399 -2.864 1.00 0.00 H ATOM 2607 HH21 ARG B 139 -27.305 6.135 -2.358 1.00 0.00 H ATOM 2608 H ARG B 139 -26.415 9.738 4.240 1.00 0.00 H TER 2609 ARG B 139 HETATM 2610 O HOH 1 17.736 -13.709 -7.125 1.00 25.70 O HETATM 2611 O HOH 2 -11.674 -27.685 12.743 1.00 38.63 O HETATM 2612 O HOH 3 8.702 -6.464 -10.051 1.00 35.75 O HETATM 2613 O HOH 4 -32.802 -4.074 8.148 1.00 33.59 O HETATM 2614 O HOH 5 -14.356 -35.097 15.020 1.00 19.33 O HETATM 2615 O HOH 6 -14.485 -16.424 2.193 1.00 37.28 O HETATM 2616 O HOH 7 -18.071 -16.861 3.879 1.00 25.87 O HETATM 2617 O HOH 8 -32.365 -11.269 -11.035 1.00 33.75 O HETATM 2618 O HOH 9 3.575 -8.936 -11.252 1.00 29.09 O HETATM 2619 O HOH 10 -8.068 -4.482 -6.101 1.00 21.59 O HETATM 2620 O HOH 11 -18.771 1.017 -6.773 1.00 26.92 O HETATM 2621 O HOH 12 -23.211 1.039 -3.732 1.00 24.76 O HETATM 2622 O HOH 13 -13.302 -20.398 11.668 1.00 23.83 O HETATM 2623 O HOH 14 -1.579 -1.957 -1.733 1.00 30.80 O HETATM 2624 O HOH 15 6.734 -23.570 3.117 1.00 28.28 O HETATM 2625 O HOH 16 -18.010 -32.475 16.905 1.00 31.05 O HETATM 2626 O HOH 17 -27.604 -6.978 -13.563 1.00 27.64 O HETATM 2627 O HOH 18 -31.938 -1.495 -3.800 1.00 34.51 O HETATM 2628 O HOH 19 -33.363 -5.830 2.032 1.00 23.74 O HETATM 2629 O HOH 20 -27.573 -18.774 0.809 1.00 13.27 O HETATM 2630 O HOH 21 13.503 -17.589 -0.062 1.00 11.09 O HETATM 2631 O HOH 22 14.021 -19.153 5.367 1.00 35.80 O HETATM 2632 O HOH 23 -16.680 -17.051 1.830 1.00 19.83 O HETATM 2633 O HOH 24 -4.193 -29.270 -4.077 1.00 32.66 O HETATM 2634 O HOH 25 -31.660 -8.776 -8.513 1.00 12.53 O HETATM 2635 O HOH 26 -14.325 -21.296 -13.109 1.00 17.71 O HETATM 2636 O HOH 27 5.478 -21.646 3.706 1.00 13.07 O HETATM 2637 O HOH 28 -10.955 -26.588 -5.273 1.00 26.15 O HETATM 2638 O HOH 29 -22.584 2.093 3.499 1.00 12.06 O HETATM 2639 O HOH 30 4.598 -1.016 -2.649 1.00 31.27 O HETATM 2640 O HOH 31 -0.338 -15.388 -11.471 1.00 7.94 O HETATM 2641 O HOH 32 -32.163 -11.823 1.206 1.00 18.78 O HETATM 2642 O HOH 33 -4.522 -26.270 -0.019 1.00 25.50 O HETATM 2643 O HOH 34 -11.369 -15.772 7.531 1.00 12.25 O HETATM 2644 O HOH 35 -28.823 -16.747 4.060 1.00 13.96 O HETATM 2645 O HOH 36 -23.899 -2.310 7.522 1.00 19.86 O HETATM 2646 O HOH 37 -5.180 -7.815 -13.827 1.00 33.53 O HETATM 2647 O HOH 38 3.427 -23.629 -11.635 1.00 17.76 O HETATM 2648 O HOH 39 2.711 -23.486 13.587 1.00 34.78 O HETATM 2649 O HOH 40 -0.970 -18.349 9.939 1.00 18.74 O HETATM 2650 O HOH 41 -25.462 -0.478 -4.169 1.00 25.32 O HETATM 2651 O HOH 42 -18.614 -8.219 -4.711 1.00 10.29 O HETATM 2652 O HOH 43 -4.905 0.859 -1.096 1.00 27.17 O HETATM 2653 O HOH 44 -18.980 -16.550 -13.229 1.00 30.21 O HETATM 2654 O HOH 45 9.713 -22.999 -0.172 1.00 19.58 O HETATM 2655 O HOH 46 -6.490 -12.636 -13.633 1.00 21.09 O HETATM 2656 O HOH 47 5.360 -14.445 -9.700 1.00 19.63 O HETATM 2657 O HOH 48 -29.753 -7.345 -10.108 1.00 12.69 O HETATM 2658 O HOH 49 12.940 -7.991 -5.954 1.00 8.51 O HETATM 2659 O HOH 50 -11.044 -28.286 3.608 1.00 38.64 O HETATM 2660 O HOH 51 -18.793 -12.468 -12.180 1.00 23.00 O HETATM 2661 O HOH 52 -5.605 -11.895 -1.372 1.00 12.11 O HETATM 2662 O HOH 53 -13.263 -22.774 -7.174 1.00 20.65 O HETATM 2663 O HOH 54 -3.582 -10.052 -15.377 1.00 28.08 O HETATM 2664 O HOH 55 -3.400 -24.372 6.280 1.00 34.35 O HETATM 2665 O HOH 56 -2.165 -4.491 -2.386 1.00 23.53 O HETATM 2666 O HOH 57 -28.487 -2.977 -12.095 1.00 32.20 O HETATM 2667 O HOH 58 6.022 -20.186 -10.794 1.00 19.69 O HETATM 2668 O HOH 59 -24.858 -2.361 -11.567 1.00 18.80 O HETATM 2669 O HOH 60 -2.699 -10.910 -1.238 1.00 7.81 O HETATM 2670 O HOH 61 -15.278 -13.336 3.024 1.00 14.19 O HETATM 2671 O HOH 62 -18.182 -7.572 -11.562 1.00 16.07 O HETATM 2672 O HOH 63 2.955 -14.102 -10.528 1.00 19.32 O HETATM 2673 O HOH 64 9.231 -20.095 -6.149 1.00 25.39 O HETATM 2674 O HOH 65 10.597 -15.871 3.171 1.00 9.61 O HETATM 2675 O HOH 66 -1.682 -27.597 -7.233 1.00 10.27 O HETATM 2676 O HOH 67 -7.557 -6.446 1.803 1.00 25.97 O HETATM 2677 O HOH 68 -17.574 -14.981 -14.483 1.00 24.87 O HETATM 2678 O HOH 69 -16.973 -21.804 -10.385 1.00 24.21 O HETATM 2679 O HOH 70 -19.222 2.037 -4.320 1.00 21.91 O HETATM 2680 O HOH 71 -11.908 -20.528 -10.915 1.00 17.33 O HETATM 2681 O HOH 72 -10.870 -7.051 -10.006 1.00 21.61 O HETATM 2682 O HOH 73 -32.504 -5.242 -2.517 1.00 19.17 O HETATM 2683 O HOH 74 2.863 -1.573 -8.203 1.00 26.68 O HETATM 2684 O HOH 75 11.745 -20.522 -4.400 1.00 31.13 O HETATM 2685 O HOH 76 -1.220 -20.386 11.494 1.00 36.40 O HETATM 2686 O HOH 77 8.459 -17.529 -8.931 1.00 39.50 O HETATM 2687 O HOH 78 -4.552 -30.172 -8.297 1.00 14.66 O HETATM 2688 O HOH 79 -28.467 4.581 -1.640 1.00 33.74 O HETATM 2689 O HOH 80 10.713 -17.733 -8.967 1.00 32.79 O HETATM 2690 O HOH 81 5.129 -21.754 10.893 1.00 17.80 O HETATM 2691 O HOH 82 11.153 -3.192 -10.132 1.00 29.61 O HETATM 2692 O HOH 83 0.697 -3.129 -11.226 1.00 31.13 O HETATM 2693 O HOH 84 1.183 -27.024 -12.893 1.00 30.22 O HETATM 2694 O HOH 85 -20.691 -15.850 -9.674 1.00 14.88 O HETATM 2695 O HOH 86 -11.708 4.025 -5.053 1.00 25.43 O HETATM 2696 O HOH 87 -2.932 -3.980 1.251 1.00 26.57 O HETATM 2697 O HOH 88 -26.045 -16.962 6.611 1.00 17.18 O HETATM 2698 O HOH 89 4.497 -26.093 -3.695 1.00 25.07 O HETATM 2699 O HOH 90 -17.530 -18.999 -4.571 1.00 14.41 O HETATM 2700 O HOH 91 -5.591 -28.490 5.959 1.00 38.02 O HETATM 2701 O HOH 92 -30.622 -11.321 6.729 1.00 35.66 O HETATM 2702 O HOH 93 -25.276 -18.017 -0.376 1.00 11.55 O HETATM 2703 O HOH 94 -30.148 0.680 -2.082 1.00 30.03 O HETATM 2704 O HOH 95 -22.022 -9.076 -11.032 1.00 14.45 O HETATM 2705 O HOH 96 -18.766 -0.358 3.133 1.00 19.96 O HETATM 2706 O HOH 97 -18.197 0.611 -13.575 1.00 37.77 O HETATM 2707 O HOH 98 -4.310 -18.173 -13.096 1.00 10.14 O HETATM 2708 O HOH 99 -20.701 -21.053 5.656 1.00 26.89 O HETATM 2709 O HOH 100 -22.468 -18.506 -4.516 1.00 14.95 O HETATM 2710 O HOH 101 -30.097 1.947 6.336 1.00 25.26 O HETATM 2711 O HOH 102 -7.123 -0.866 -0.202 1.00 14.94 O HETATM 2712 O HOH 103 -1.027 -27.253 0.198 1.00 27.16 O HETATM 2713 O HOH 104 -12.887 -5.863 -10.842 1.00 21.06 O HETATM 2714 O HOH 105 -5.782 -10.168 0.707 1.00 7.93 O HETATM 2715 O HOH 106 8.453 -4.454 -3.107 1.00 15.49 O HETATM 2716 O HOH 107 -9.421 -18.518 -14.838 1.00 13.24 O HETATM 2717 O HOH 108 -26.435 -11.432 7.958 1.00 13.60 O HETATM 2718 O HOH 109 -15.933 -17.022 -15.767 1.00 28.29 O HETATM 2719 O HOH 110 13.202 -21.964 -0.370 1.00 24.54 O HETATM 2720 O HOH 111 -6.579 -23.100 12.360 1.00 35.17 O HETATM 2721 O HOH 112 -7.248 -8.153 3.658 1.00 34.25 O HETATM 2722 O HOH 113 -2.710 -5.132 -9.632 1.00 29.50 O HETATM 2723 O HOH 114 -19.069 -17.946 -9.248 1.00 18.53 O HETATM 2724 O HOH 115 -5.139 -7.387 4.079 1.00 20.34 O HETATM 2725 O HOH 116 3.854 -11.672 -10.408 1.00 29.78 O HETATM 2726 O HOH 117 4.890 -2.125 -5.934 1.00 19.37 O HETATM 2727 O HOH 118 -9.444 6.158 -7.645 1.00 38.52 O HETATM 2728 O HOH 119 2.858 -27.274 6.507 1.00 19.48 O HETATM 2729 O HOH 120 -14.567 -15.808 -17.597 1.00 25.27 O HETATM 2730 O HOH 121 -29.988 -13.018 2.432 1.00 13.36 O HETATM 2731 O HOH 122 -20.661 -1.629 7.677 1.00 32.61 O HETATM 2732 O HOH 123 -29.198 -20.669 4.331 1.00 29.58 O HETATM 2733 O HOH 124 -1.247 -5.108 3.060 1.00 23.56 O HETATM 2734 O HOH 125 -32.735 -0.826 5.907 1.00 21.01 O HETATM 2735 O HOH 126 3.480 -6.885 -13.341 1.00 41.18 O HETATM 2736 O HOH 127 9.329 -8.593 -8.800 1.00 16.51 O HETATM 2737 O HOH 128 -4.492 -6.894 -10.803 1.00 29.89 O HETATM 2738 O HOH 129 -15.866 -9.613 -3.535 1.00 11.85 O HETATM 2739 O HOH 130 6.625 -26.280 5.299 1.00 12.38 O HETATM 2740 O HOH 131 6.654 -17.406 -11.149 1.00 25.27 O HETATM 2741 O HOH 132 13.919 -16.909 -2.599 1.00 18.92 O HETATM 2742 O HOH 133 -4.516 -26.562 2.557 1.00 26.59 O HETATM 2743 O HOH 134 -30.900 -5.752 -4.472 1.00 23.52 O HETATM 2744 O HOH 135 -5.370 1.810 -10.008 1.00 36.66 O HETATM 2745 O HOH 136 -8.380 -1.651 -7.908 1.00 34.12 O HETATM 2746 O HOH 137 -3.998 -21.651 10.873 1.00 28.73 O HETATM 2747 O HOH 138 -2.428 -1.037 -11.951 1.00 30.84 O HETATM 2748 O HOH 139 5.962 -25.696 0.948 1.00 21.05 O HETATM 2749 O HOH 140 -3.957 -17.617 9.947 1.00 26.43 O HETATM 2750 O HOH 141 -12.703 -9.933 -14.434 1.00 18.49 O HETATM 2751 O HOH 142 -14.818 -21.918 13.317 1.00 35.61 O HETATM 2752 O HOH 143 9.930 -11.264 5.356 1.00 30.43 O HETATM 2753 O HOH 144 -14.196 -25.480 4.569 1.00 30.36 O HETATM 2754 O HOH 145 -30.147 -17.274 6.206 1.00 25.03 O HETATM 2755 O HOH 146 9.581 -22.918 7.709 1.00 17.12 O HETATM 2756 O HOH 147 -29.035 -1.285 -5.704 1.00 31.89 O HETATM 2757 O HOH 148 12.870 -2.947 -4.961 1.00 36.31 O HETATM 2758 O HOH 149 12.196 -18.662 10.264 1.00 37.96 O HETATM 2759 O HOH 150 -28.732 3.608 1.944 1.00 23.93 O HETATM 2760 O HOH 151 -28.266 0.535 -3.859 1.00 35.19 O HETATM 2761 O HOH 152 11.446 -19.676 -7.499 1.00 45.76 O HETATM 2762 O HOH 153 -29.349 -12.403 8.220 1.00 29.41 O HETATM 2763 O HOH 154 -10.165 -9.100 -14.587 1.00 35.58 O HETATM 2764 O HOH 155 -34.565 -3.495 1.762 1.00 31.37 O HETATM 2765 O HOH 156 -17.594 5.109 -3.935 1.00 35.26 O HETATM 2766 O HOH 157 -3.721 -25.288 9.007 1.00 36.12 O HETATM 2767 O HOH 158 -23.967 -15.953 -7.232 1.00 43.12 O HETATM 2768 O HOH 159 -15.719 -25.553 6.450 1.00 41.47 O HETATM 2769 O HOH 160 12.362 -12.896 4.933 1.00 23.48 O HETATM 2770 O HOH 161 11.496 -15.292 5.834 1.00 20.07 O HETATM 2771 O HOH 162 -28.115 -21.366 0.908 1.00 27.41 O HETATM 2772 O HOH 163 -16.749 -11.990 -16.367 1.00 32.99 O HETATM 2773 O HOH 164 -19.995 -11.742 -14.884 1.00 44.31 O HETATM 2774 O HOH 165 -2.574 -26.571 4.297 1.00 31.04 O HETATM 2775 O HOH 166 -22.427 -6.392 -12.026 1.00 23.40 O HETATM 2776 O HOH 167 -24.222 -9.254 -12.641 1.00 27.18 O HETATM 2777 O HOH 168 -14.829 -9.533 -15.663 1.00 30.95 O HETATM 2778 O HOH 169 -20.153 -5.926 -12.894 1.00 30.63 O HETATM 2779 O HOH 170 8.493 -2.209 -4.266 1.00 27.87 O HETATM 2780 O HOH 171 -26.341 -10.523 -11.304 1.00 20.16 O HETATM 2781 O HOH 172 -2.276 -1.703 0.746 1.00 24.45 O HETATM 2782 O HOH 173 -30.746 -5.311 -11.582 1.00 29.90 O HETATM 2783 O HOH 174 -19.666 -9.931 -11.697 1.00 21.00 O HETATM 2784 O HOH 175 -11.378 -25.171 -7.454 1.00 26.20 O HETATM 2785 O HOH 176 -28.614 -9.041 -11.880 1.00 19.35 O HETATM 2786 O HOH 177 -20.113 -19.925 -5.030 1.00 14.38 O HETATM 2787 O HOH 178 -32.548 -9.316 -12.343 1.00 57.72 O HETATM 2788 O HOH 179 -16.690 -22.049 -5.982 1.00 38.14 O HETATM 2789 O HOH 180 -20.558 -14.929 -12.238 1.00 28.71 O HETATM 2790 O HOH 181 -19.746 -19.922 -7.845 1.00 24.79 O HETATM 2791 O HOH 182 1.880 -31.353 11.479 1.00 37.05 O HETATM 2792 O HOH 183 -26.694 2.128 -6.187 1.00 45.92 O HETATM 2793 O HOH 184 9.469 -22.737 10.479 1.00 19.66 O HETATM 2794 O HOH 185 5.775 -11.523 -10.661 1.00 45.53 O HETATM 2795 O HOH 186 -16.294 -5.113 -11.784 1.00 37.00 O HETATM 2796 O HOH 187 9.331 -14.170 7.217 1.00 26.94 O HETATM 2797 O HOH 188 -6.736 -5.794 -10.104 1.00 24.88 O HETATM 2798 O HOH 189 -30.431 -15.840 2.155 1.00 12.05 O HETATM 2799 O HOH 190 -8.541 -5.867 -8.334 1.00 20.90 O HETATM 2800 O HOH 191 -20.358 -33.552 15.511 1.00 38.37 O HETATM 2801 O HOH 192 8.295 -10.451 -10.480 1.00 31.99 O HETATM 2802 O HOH 193 5.951 -24.510 -12.372 1.00 26.06 O HETATM 2803 O HOH 194 -10.819 -28.706 -6.644 1.00 38.61 O HETATM 2804 O HOH 195 -23.003 -16.815 -9.213 1.00 30.48 O HETATM 2805 O HOH 196 -17.913 -22.085 -8.335 1.00 37.12 O HETATM 2806 O HOH 197 14.038 -0.332 -7.881 1.00 41.71 O HETATM 2807 O HOH 198 -29.098 -0.932 -10.069 1.00 37.04 O HETATM 2808 O HOH 199 -24.286 -19.403 -2.499 1.00 19.71 O HETATM 2809 O HOH 200 -13.385 8.141 -7.178 1.00 28.85 O HETATM 2810 O HOH 201 1.527 22.548 -3.718 1.00 37.99 O HETATM 2811 O HOH 202 10.860 2.075 5.736 1.00 43.22 O HETATM 2812 O HOH 203 -16.188 22.298 -4.750 1.00 27.20 O HETATM 2813 O HOH 204 -16.649 -0.662 26.455 1.00 37.71 O HETATM 2814 O HOH 205 -6.391 22.814 4.611 1.00 31.60 O HETATM 2815 O HOH 206 -26.134 -16.260 14.157 1.00 23.09 O HETATM 2816 O HOH 207 -1.850 21.394 6.877 1.00 30.28 O HETATM 2817 O HOH 208 -23.121 -11.574 21.478 1.00 37.99 O HETATM 2818 O HOH 209 -18.767 1.739 9.531 1.00 28.91 O HETATM 2819 O HOH 210 7.777 -7.420 7.979 1.00 41.54 O HETATM 2820 O HOH 211 -19.721 20.259 -5.618 1.00 27.00 O HETATM 2821 O HOH 212 -25.576 -18.271 10.529 1.00 40.32 O HETATM 2822 O HOH 213 -20.274 15.830 -7.410 1.00 26.24 O HETATM 2823 O HOH 214 3.665 19.620 1.712 1.00 31.34 O HETATM 2824 O HOH 215 -16.222 15.660 -7.338 1.00 18.61 O HETATM 2825 O HOH 216 -8.103 -12.196 17.417 1.00 20.23 O HETATM 2826 O HOH 217 -2.883 19.413 -5.951 1.00 28.65 O HETATM 2827 O HOH 218 -19.830 -19.564 6.689 1.00 22.37 O HETATM 2828 O HOH 219 -2.829 12.461 12.062 1.00 15.82 O HETATM 2829 O HOH 220 -10.928 -18.562 18.787 1.00 43.62 O HETATM 2830 O HOH 221 8.303 -1.744 3.986 1.00 28.38 O HETATM 2831 O HOH 222 -17.075 9.659 -4.020 1.00 17.74 O HETATM 2832 O HOH 223 -25.789 12.293 -0.729 1.00 41.14 O HETATM 2833 O HOH 224 -16.217 0.949 21.925 1.00 18.36 O HETATM 2834 O HOH 225 -20.035 13.411 13.955 1.00 27.34 O HETATM 2835 O HOH 226 -28.134 2.738 15.280 1.00 28.66 O HETATM 2836 O HOH 227 -9.500 23.016 12.532 1.00 22.19 O HETATM 2837 O HOH 228 0.996 5.315 12.299 1.00 32.80 O HETATM 2838 O HOH 229 -16.435 -19.298 20.613 1.00 20.18 O HETATM 2839 O HOH 230 -3.757 22.734 4.937 1.00 31.12 O HETATM 2840 O HOH 231 -18.080 19.338 -1.513 1.00 27.69 O HETATM 2841 O HOH 232 -19.753 2.212 3.191 1.00 13.26 O HETATM 2842 O HOH 233 -15.574 -11.064 25.702 1.00 22.31 O HETATM 2843 O HOH 234 -9.102 -5.725 3.364 1.00 28.17 O HETATM 2844 O HOH 235 -17.212 9.978 16.857 1.00 22.16 O HETATM 2845 O HOH 236 -24.490 15.810 -2.863 1.00 20.21 O HETATM 2846 O HOH 237 -2.454 20.372 8.892 1.00 41.17 O HETATM 2847 O HOH 238 3.522 3.110 -1.434 1.00 23.61 O HETATM 2848 O HOH 239 -17.996 -12.299 25.586 1.00 27.59 O HETATM 2849 O HOH 240 -27.973 2.896 8.265 1.00 33.21 O HETATM 2850 O HOH 241 -16.260 3.396 21.485 1.00 34.13 O HETATM 2851 O HOH 242 -11.757 17.835 -2.056 1.00 14.22 O HETATM 2852 O HOH 243 -8.802 -3.489 20.618 1.00 18.29 O HETATM 2853 O HOH 244 -25.522 -0.214 9.394 1.00 25.57 O HETATM 2854 O HOH 245 -12.860 -4.959 15.343 1.00 10.06 O HETATM 2855 O HOH 246 -10.503 16.349 -11.339 1.00 27.63 O HETATM 2856 O HOH 247 -3.340 22.005 -2.735 1.00 23.42 O HETATM 2857 O HOH 248 -8.360 21.067 -2.152 1.00 28.13 O HETATM 2858 O HOH 249 -0.153 14.757 7.132 1.00 24.78 O HETATM 2859 O HOH 250 -27.930 -6.980 16.664 1.00 14.74 O HETATM 2860 O HOH 251 -4.678 0.515 15.498 1.00 22.06 O HETATM 2861 O HOH 252 -13.032 -17.560 8.827 1.00 14.59 O HETATM 2862 O HOH 253 -3.007 20.547 3.164 1.00 29.18 O HETATM 2863 O HOH 254 -12.071 -5.038 22.503 1.00 13.62 O HETATM 2864 O HOH 255 -14.748 20.930 15.467 1.00 41.87 O HETATM 2865 O HOH 256 -11.251 -13.269 25.625 1.00 33.11 O HETATM 2866 O HOH 257 -6.882 -13.287 13.263 1.00 23.87 O HETATM 2867 O HOH 258 -29.738 -8.386 12.766 1.00 29.13 O HETATM 2868 O HOH 259 -20.992 11.871 -2.211 1.00 31.12 O HETATM 2869 O HOH 260 -4.941 15.644 -4.390 1.00 19.13 O HETATM 2870 O HOH 261 -19.586 -14.185 22.697 1.00 19.44 O HETATM 2871 O HOH 262 -3.223 13.983 -7.659 1.00 28.27 O HETATM 2872 O HOH 263 -12.709 23.277 6.485 1.00 15.51 O HETATM 2873 O HOH 264 -15.151 -20.240 17.079 1.00 16.82 O HETATM 2874 O HOH 265 -12.058 -14.640 16.983 1.00 31.20 O HETATM 2875 O HOH 266 -2.195 1.248 3.502 1.00 21.82 O HETATM 2876 O HOH 267 -1.421 -10.913 9.325 1.00 32.49 O HETATM 2877 O HOH 268 -13.563 20.788 11.600 1.00 12.26 O HETATM 2878 O HOH 269 -9.334 4.697 5.900 1.00 9.51 O HETATM 2879 O HOH 270 -16.414 0.826 24.992 1.00 38.40 O HETATM 2880 O HOH 271 -9.613 0.140 0.689 1.00 16.31 O HETATM 2881 O HOH 272 -9.613 14.024 17.686 1.00 28.09 O HETATM 2882 O HOH 273 -3.369 8.139 17.060 1.00 21.29 O HETATM 2883 O HOH 274 1.368 19.025 5.507 1.00 37.79 O HETATM 2884 O HOH 275 -7.197 5.759 4.064 1.00 8.88 O HETATM 2885 O HOH 276 -8.629 -2.740 4.209 1.00 22.26 O HETATM 2886 O HOH 277 -21.114 1.318 10.890 1.00 36.94 O HETATM 2887 O HOH 278 -9.408 2.623 4.142 1.00 8.25 O HETATM 2888 O HOH 279 -2.870 21.572 0.864 1.00 23.84 O HETATM 2889 O HOH 280 -0.777 20.933 -0.470 1.00 27.80 O HETATM 2890 O HOH 281 -12.478 -13.298 7.789 1.00 23.89 O HETATM 2891 O HOH 282 -21.516 7.363 16.164 1.00 23.42 O HETATM 2892 O HOH 283 -0.719 14.126 9.316 1.00 27.84 O HETATM 2893 O HOH 284 8.949 -9.220 5.443 1.00 30.20 O HETATM 2894 O HOH 285 -9.040 -11.319 23.594 1.00 25.99 O HETATM 2895 O HOH 286 -6.133 -8.539 23.825 1.00 39.19 O HETATM 2896 O HOH 287 -8.402 9.207 21.820 1.00 23.09 O HETATM 2897 O HOH 288 -18.909 3.969 16.800 1.00 10.82 O HETATM 2898 O HOH 289 -16.573 -14.152 5.268 1.00 33.01 O HETATM 2899 O HOH 290 -12.227 17.335 18.446 1.00 37.09 O HETATM 2900 O HOH 291 -15.395 10.420 19.157 1.00 35.00 O HETATM 2901 O HOH 292 -8.866 26.384 10.529 1.00 29.37 O HETATM 2902 O HOH 293 -11.632 -0.245 22.121 1.00 26.41 O HETATM 2903 O HOH 294 -4.637 -0.665 1.047 1.00 30.94 O HETATM 2904 O HOH 295 0.625 11.608 11.785 1.00 33.33 O HETATM 2905 O HOH 296 -25.845 3.871 2.120 1.00 25.26 O HETATM 2906 O HOH 297 -24.098 -22.896 11.230 1.00 18.31 O HETATM 2907 O HOH 298 -30.608 -4.678 9.782 1.00 31.28 O HETATM 2908 O HOH 299 -9.130 22.287 5.624 1.00 20.52 O HETATM 2909 O HOH 300 -11.161 20.313 -4.307 1.00 37.80 O HETATM 2910 O HOH 301 -23.522 7.421 14.340 1.00 23.09 O HETATM 2911 O HOH 302 -19.530 -16.939 20.743 1.00 23.69 O HETATM 2912 O HOH 303 -30.021 -2.275 13.038 1.00 39.72 O HETATM 2913 O HOH 304 -17.608 -14.859 20.736 1.00 14.86 O HETATM 2914 O HOH 305 -3.589 10.493 16.499 1.00 27.06 O HETATM 2915 O HOH 306 -7.699 11.726 17.429 1.00 16.91 O HETATM 2916 O HOH 307 -11.385 19.872 15.458 1.00 29.78 O HETATM 2917 O HOH 308 -18.236 -0.976 8.227 1.00 22.23 O HETATM 2918 O HOH 309 -30.272 -8.858 15.515 1.00 28.99 O HETATM 2919 O HOH 310 -18.563 -22.358 10.755 1.00 18.08 O HETATM 2920 O HOH 311 -9.224 -15.032 14.454 1.00 19.76 O HETATM 2921 O HOH 312 -22.141 -21.932 13.167 1.00 14.82 O HETATM 2922 O HOH 313 -26.125 -10.489 10.603 1.00 13.38 O HETATM 2923 O HOH 314 -18.965 15.160 6.484 1.00 29.20 O HETATM 2924 O HOH 315 1.426 10.185 13.892 1.00 32.04 O HETATM 2925 O HOH 316 4.677 4.144 0.966 1.00 26.31 O HETATM 2926 O HOH 317 -4.341 -5.020 3.677 1.00 22.59 O HETATM 2927 O HOH 318 4.768 8.702 12.539 1.00 24.87 O HETATM 2928 O HOH 319 -2.837 20.014 11.118 1.00 42.17 O HETATM 2929 O HOH 320 -8.659 17.730 15.239 1.00 27.61 O HETATM 2930 O HOH 321 -8.440 21.943 -5.907 1.00 36.81 O HETATM 2931 O HOH 322 -3.700 -1.284 9.834 1.00 25.23 O HETATM 2932 O HOH 323 -10.986 26.648 8.273 1.00 41.04 O HETATM 2933 O HOH 324 -4.518 6.124 24.675 1.00 31.20 O HETATM 2934 O HOH 325 -28.541 -5.835 12.392 1.00 19.41 O HETATM 2935 O HOH 326 -18.933 -21.623 7.476 1.00 37.92 O HETATM 2936 O HOH 327 -14.899 21.385 -2.625 1.00 17.99 O HETATM 2937 O HOH 328 -16.101 21.040 5.581 1.00 16.20 O HETATM 2938 O HOH 329 -13.519 18.912 -8.620 1.00 36.65 O HETATM 2939 O HOH 330 -15.728 22.996 3.620 1.00 34.99 O HETATM 2940 O HOH 331 -13.112 13.880 -10.154 1.00 32.59 O HETATM 2941 O HOH 332 -12.755 -2.539 13.126 1.00 13.99 O HETATM 2942 O HOH 333 -19.745 10.759 -4.376 1.00 35.73 O HETATM 2943 O HOH 334 -4.566 -1.539 16.662 1.00 28.52 O HETATM 2944 O HOH 335 -18.221 7.508 -3.123 1.00 33.27 O HETATM 2945 O HOH 336 -6.408 13.115 16.149 1.00 37.54 O HETATM 2946 O HOH 337 -20.330 16.672 -3.932 1.00 29.08 O HETATM 2947 O HOH 338 -21.856 14.486 7.421 1.00 29.54 O HETATM 2948 O HOH 339 6.416 13.618 -1.649 1.00 40.13 O HETATM 2949 O HOH 340 -0.738 3.789 12.114 1.00 32.40 O HETATM 2950 O HOH 341 -13.451 1.113 23.593 1.00 32.47 O HETATM 2951 O HOH 342 -5.226 2.775 20.328 1.00 14.93 O HETATM 2952 O HOH 343 -21.979 -21.589 18.032 1.00 34.50 O HETATM 2953 O HOH 344 6.742 5.690 0.856 1.00 42.29 O HETATM 2954 O HOH 345 -11.064 20.611 12.775 1.00 22.33 O HETATM 2955 O HOH 346 -22.926 -22.953 15.755 1.00 30.52 O HETATM 2956 O HOH 347 -19.791 15.519 3.954 1.00 30.88 O HETATM 2957 O HOH 348 -7.076 22.835 0.125 1.00 35.09 O HETATM 2958 O HOH 349 -1.794 3.693 17.734 1.00 27.00 O HETATM 2959 O HOH 350 5.811 -11.462 8.215 1.00 31.30 O HETATM 2960 O HOH 351 -17.863 8.548 20.809 1.00 35.71 O HETATM 2961 O HOH 352 -14.097 -12.677 27.513 1.00 34.48 O HETATM 2962 O HOH 353 -8.061 -16.282 25.113 1.00 39.54 O HETATM 2963 O HOH 354 -9.981 -7.232 23.081 1.00 23.07 O HETATM 2964 O HOH 355 -26.480 3.464 16.731 1.00 38.55 O HETATM 2965 O HOH 356 -0.462 -0.493 2.384 1.00 34.76 O HETATM 2966 O HOH 357 -2.272 4.574 23.357 1.00 39.01 O HETATM 2967 O HOH 358 6.891 14.284 0.883 1.00 44.22 O HETATM 2968 O HOH 359 -5.637 1.511 22.739 1.00 33.72 O HETATM 2969 O HOH 360 -18.477 17.966 2.719 1.00 17.85 O HETATM 2970 O HOH 361 -17.973 12.386 15.876 1.00 29.76 O HETATM 2971 O HOH 362 -5.063 23.518 -2.064 1.00 46.91 O HETATM 2972 O HOH 363 -7.571 15.334 16.750 1.00 39.47 O HETATM 2973 O HOH 364 -6.429 -11.953 15.316 1.00 23.50 O HETATM 2974 O HOH 365 -28.615 -11.056 11.725 1.00 28.18 O HETATM 2975 O HOH 366 -20.346 -23.653 12.386 1.00 25.49 O HETATM 2976 O HOH 367 -3.497 0.950 18.680 1.00 36.12 O HETATM 2977 O HOH 368 -10.871 -2.597 22.279 1.00 20.64 O HETATM 2978 O HOH 369 5.488 18.679 -3.938 1.00 36.03 O HETATM 2979 O HOH 370 -15.530 13.127 -8.058 1.00 34.55 O HETATM 2980 O HOH 371 -1.283 22.903 -4.427 1.00 25.69 O HETATM 2981 O HOH 372 -5.152 -22.546 17.649 1.00 39.77 O HETATM 2982 O HOH 373 -24.148 5.184 16.576 1.00 26.00 O HETATM 2983 O HOH 374 -20.029 5.364 18.904 1.00 29.06 O HETATM 2984 O HOH 375 -15.715 -16.702 21.469 1.00 21.75 O HETATM 2985 O HOH 376 -3.794 0.044 12.189 1.00 42.34 O HETATM 2986 O HOH 377 -13.181 -5.835 25.102 1.00 27.24 O HETATM 2987 O HOH 378 -22.267 12.392 13.339 1.00 37.50 O HETATM 2988 O HOH 379 -15.572 8.440 -5.968 1.00 31.10 O HETATM 2989 O HOH 380 -19.209 8.411 18.364 1.00 34.05 O HETATM 2990 O HOH 381 3.379 -13.106 7.568 1.00 39.89 O HETATM 2991 O HOH 382 -25.874 8.497 13.472 1.00 41.91 O HETATM 2992 O HOH 383 -8.050 15.528 -11.941 1.00 38.87 O HETATM 2993 O HOH 384 -6.524 14.978 -6.950 1.00 25.30 O HETATM 2994 O HOH 385 3.101 13.549 -3.774 1.00 30.25 O HETATM 2995 O HOH 386 5.520 3.265 -7.567 1.00 35.13 O HETATM 2996 O HOH 387 4.840 9.904 -3.719 1.00 27.79 O HETATM 2997 O HOH 388 3.725 9.568 -6.484 1.00 27.62 O HETATM 2998 O HOH 389 2.860 0.403 -1.323 1.00 24.77 O HETATM 2999 O HOH 390 -4.833 16.935 -8.600 1.00 38.90 O HETATM 3000 O HOH 391 -9.322 8.520 -7.204 1.00 23.32 O HETATM 3001 O HOH 392 -1.453 11.485 -12.112 1.00 42.71 O HETATM 3002 O HOH 393 3.207 12.377 -5.838 1.00 40.79 O HETATM 3003 O HOH 394 -3.189 16.732 -6.303 1.00 26.83 O HETATM 3004 O HOH 395 1.734 9.903 -11.021 1.00 34.82 O HETATM 3005 O HOH 396 -11.481 9.828 -7.343 1.00 25.81 O HETATM 3006 O HOH 397 2.043 0.375 1.093 1.00 27.69 O HETATM 3007 N THR A 398 -5.858 15.557 -11.753 1.00 0.24 N HETATM 3008 CA THR A 398 -5.718 14.126 -11.494 1.00 0.09 C HETATM 3009 C THR A 398 -6.264 13.773 -10.108 1.00 0.23 C HETATM 3010 O THR A 398 -6.184 14.569 -9.171 1.00 -0.39 O HETATM 3011 N THR A 398 -6.824 12.569 -9.994 1.00 -0.26 N HETATM 3012 CA THR A 398 -7.304 12.034 -8.725 1.00 0.16 C HETATM 3013 C THR A 398 -6.583 10.747 -8.346 1.00 0.21 C HETATM 3014 O THR A 398 -7.000 10.061 -7.403 1.00 -0.39 O HETATM 3015 N THR A 398 -5.516 10.406 -9.067 1.00 -0.26 N HETATM 3016 CA THR A 398 -4.639 9.294 -8.735 1.00 0.13 C HETATM 3017 C THR A 398 -3.223 9.690 -9.113 1.00 0.20 C HETATM 3018 O THR A 398 -3.022 10.501 -10.020 1.00 -0.39 O HETATM 3019 N THR A 398 -2.246 9.105 -8.417 1.00 -0.26 N HETATM 3020 CA THR A 398 -0.843 9.197 -8.805 1.00 0.13 C HETATM 3021 C THR A 398 -0.169 7.847 -8.601 1.00 0.20 C HETATM 3022 O THR A 398 -0.714 6.946 -7.955 1.00 -0.39 O HETATM 3023 N THR A 398 1.039 7.718 -9.149 1.00 -0.26 N HETATM 3024 CA THR A 398 1.813 6.504 -8.936 1.00 0.13 C HETATM 3025 C THR A 398 2.098 6.314 -7.449 1.00 0.20 C HETATM 3026 O THR A 398 2.371 7.276 -6.721 1.00 -0.39 O HETATM 3027 N THR A 398 2.014 5.069 -6.989 1.00 -0.26 N HETATM 3028 CA THR A 398 2.244 4.812 -5.575 1.00 0.13 C HETATM 3029 C THR A 398 3.675 5.188 -5.201 1.00 0.20 C HETATM 3030 O THR A 398 4.605 5.077 -6.006 1.00 -0.39 O HETATM 3031 N THR A 398 3.831 5.695 -3.985 1.00 -0.26 N HETATM 3032 CA THR A 398 5.129 6.171 -3.531 1.00 0.15 C HETATM 3033 C THR A 398 6.114 5.013 -3.435 1.00 0.21 C HETATM 3034 O THR A 398 5.744 3.895 -3.068 1.00 -0.39 O HETATM 3035 N THR A 398 7.371 5.288 -3.782 1.00 -0.27 N HETATM 3036 CA THR A 398 8.427 4.272 -3.760 1.00 0.09 C HETATM 3037 C THR A 398 8.717 3.782 -2.342 1.00 0.06 C HETATM 3038 O THR A 398 8.885 4.582 -1.418 1.00 -0.57 O HETATM 3039 OXT THR A 398 8.789 2.576 -2.092 1.00 -0.57 O HETATM 3040 CB THR A 398 9.700 4.820 -4.395 1.00 -0.03 C HETATM 3041 H71 THR A 398 10.483 4.048 -4.372 1.00 0.03 H HETATM 3042 H72 THR A 398 10.039 5.703 -3.834 1.00 0.03 H HETATM 3043 H73 THR A 398 9.496 5.104 -5.438 1.00 0.03 H HETATM 3044 H70 THR A 398 8.085 3.412 -4.355 1.00 0.07 H HETATM 3045 H69 THR A 398 7.601 6.218 -4.067 1.00 0.19 H HETATM 3046 CB THR A 398 4.989 6.869 -2.178 1.00 0.08 C HETATM 3047 OG THR A 398 3.962 7.859 -2.258 1.00 -0.39 O HETATM 3048 H68 THR A 398 4.191 8.498 -2.923 1.00 0.21 H HETATM 3049 H66 THR A 398 5.942 7.350 -1.913 1.00 0.06 H HETATM 3050 H67 THR A 398 4.725 6.128 -1.409 1.00 0.06 H HETATM 3051 H65 THR A 398 5.513 6.897 -4.263 1.00 0.08 H HETATM 3052 H64 THR A 398 3.044 5.751 -3.371 1.00 0.19 H HETATM 3053 CB THR A 398 1.938 3.351 -5.226 1.00 -0.01 C HETATM 3054 CG THR A 398 3.018 2.337 -5.445 1.00 -0.02 C HETATM 3055 CD THR A 398 2.623 1.048 -4.715 1.00 0.06 C HETATM 3056 NE THR A 398 1.225 0.742 -4.985 1.00 -0.27 N HETATM 3057 CZ THR A 398 0.391 0.128 -4.152 1.00 0.29 C HETATM 3058 NH1 THR A 398 0.790 -0.297 -2.951 1.00 -0.28 N HETATM 3059 H60 THR A 398 0.123 -0.770 -2.325 1.00 0.26 H HETATM 3060 H61 THR A 398 1.765 -0.152 -2.651 1.00 0.26 H HETATM 3061 NH2 THR A 398 -0.857 -0.067 -4.540 1.00 -0.28 N HETATM 3062 H62 THR A 398 -1.165 0.261 -5.466 1.00 0.26 H HETATM 3063 H63 THR A 398 -1.521 -0.547 -3.916 1.00 0.26 H HETATM 3064 H59 THR A 398 0.850 1.026 -5.901 1.00 0.26 H HETATM 3065 H57 THR A 398 2.766 1.182 -3.633 1.00 0.07 H HETATM 3066 H58 THR A 398 3.254 0.219 -5.068 1.00 0.07 H HETATM 3067 H55 THR A 398 3.970 2.715 -5.044 1.00 0.03 H HETATM 3068 H56 THR A 398 3.127 2.136 -6.521 1.00 0.03 H HETATM 3069 H53 THR A 398 1.073 3.044 -5.832 1.00 0.03 H HETATM 3070 H54 THR A 398 1.669 3.318 -4.160 1.00 0.03 H HETATM 3071 H52 THR A 398 1.560 5.449 -4.994 1.00 0.08 H HETATM 3072 H51 THR A 398 1.795 4.316 -7.609 1.00 0.19 H HETATM 3073 CB THR A 398 3.120 6.561 -9.731 1.00 -0.01 C HETATM 3074 CG THR A 398 2.996 6.079 -11.164 1.00 -0.04 C HETATM 3075 CD THR A 398 4.357 6.067 -11.857 1.00 -0.01 C HETATM 3076 CE THR A 398 5.441 5.465 -10.959 1.00 -0.04 C HETATM 3077 NZ THR A 398 5.198 4.029 -10.611 1.00 0.22 N HETATM 3078 H48 THR A 398 5.944 3.695 -10.021 1.00 0.20 H HETATM 3079 H49 THR A 398 5.166 3.479 -11.455 1.00 0.20 H HETATM 3080 H50 THR A 398 4.320 3.946 -10.122 1.00 0.20 H HETATM 3081 H46 THR A 398 5.484 6.047 -10.027 1.00 0.08 H HETATM 3082 H47 THR A 398 6.406 5.538 -11.481 1.00 0.08 H HETATM 3083 H44 THR A 398 4.637 7.100 -12.111 1.00 0.03 H HETATM 3084 H45 THR A 398 4.284 5.470 -12.778 1.00 0.03 H HETATM 3085 H42 THR A 398 2.319 6.751 -11.712 1.00 0.03 H HETATM 3086 H43 THR A 398 2.582 5.060 -11.166 1.00 0.03 H HETATM 3087 H40 THR A 398 3.864 5.933 -9.219 1.00 0.03 H HETATM 3088 H41 THR A 398 3.469 7.604 -9.747 1.00 0.03 H HETATM 3089 H39 THR A 398 1.224 5.646 -9.292 1.00 0.08 H HETATM 3090 H38 THR A 398 1.415 8.457 -9.708 1.00 0.19 H HETATM 3091 CB THR A 398 -0.090 10.256 -8.003 1.00 -0.01 C HETATM 3092 CG THR A 398 -0.620 11.654 -8.129 1.00 -0.02 C HETATM 3093 CD THR A 398 0.274 12.566 -7.331 1.00 0.06 C HETATM 3094 NE THR A 398 -0.447 13.712 -6.815 1.00 -0.27 N HETATM 3095 CZ THR A 398 -0.042 14.411 -5.763 1.00 0.29 C HETATM 3096 NH1 THR A 398 1.078 14.069 -5.141 1.00 -0.28 N HETATM 3097 H34 THR A 398 1.398 14.608 -4.324 1.00 0.26 H HETATM 3098 H35 THR A 398 1.628 13.265 -5.475 1.00 0.26 H HETATM 3099 NH2 THR A 398 -0.751 15.447 -5.342 1.00 -0.28 N HETATM 3100 H36 THR A 398 -1.620 15.708 -5.829 1.00 0.26 H HETATM 3101 H37 THR A 398 -0.433 15.992 -4.528 1.00 0.26 H HETATM 3102 H33 THR A 398 -1.316 13.998 -7.288 1.00 0.26 H HETATM 3103 H31 THR A 398 1.089 12.921 -7.979 1.00 0.07 H HETATM 3104 H32 THR A 398 0.696 12.001 -6.487 1.00 0.07 H HETATM 3105 H29 THR A 398 -1.646 11.701 -7.736 1.00 0.03 H HETATM 3106 H30 THR A 398 -0.617 11.960 -9.185 1.00 0.03 H HETATM 3107 H27 THR A 398 0.957 10.258 -8.341 1.00 0.03 H HETATM 3108 H28 THR A 398 -0.132 9.971 -6.941 1.00 0.03 H HETATM 3109 H26 THR A 398 -0.794 9.466 -9.871 1.00 0.08 H HETATM 3110 H25 THR A 398 -2.485 8.584 -7.598 1.00 0.19 H HETATM 3111 CB THR A 398 -5.001 8.015 -9.493 1.00 0.00 C HETATM 3112 CG THR A 398 -6.213 7.295 -9.004 1.00 0.04 C HETATM 3113 CD THR A 398 -6.512 6.091 -9.873 1.00 0.17 C HETATM 3114 OE1 THR A 398 -6.450 6.175 -11.102 1.00 -0.40 O HETATM 3115 NE2 THR A 398 -6.822 4.963 -9.245 1.00 -0.30 N HETATM 3116 H23 THR A 398 -7.028 4.138 -9.771 1.00 0.18 H HETATM 3117 H24 THR A 398 -6.849 4.938 -8.246 1.00 0.18 H HETATM 3118 H21 THR A 398 -7.074 7.980 -9.029 1.00 0.05 H HETATM 3119 H22 THR A 398 -6.041 6.960 -7.971 1.00 0.05 H HETATM 3120 H19 THR A 398 -4.146 7.326 -9.421 1.00 0.03 H HETATM 3121 H20 THR A 398 -5.169 8.282 -10.547 1.00 0.03 H HETATM 3122 H18 THR A 398 -4.698 9.099 -7.654 1.00 0.08 H HETATM 3123 H17 THR A 398 -5.306 10.945 -9.883 1.00 0.19 H HETATM 3124 CB THR A 398 -8.814 11.800 -8.784 1.00 0.09 C HETATM 3125 OG1 THR A 398 -9.128 11.023 -9.941 1.00 -0.39 O HETATM 3126 H13 THR A 398 -10.066 10.877 -9.978 1.00 0.21 H HETATM 3127 CG2 THR A 398 -9.564 13.127 -8.849 1.00 -0.03 C HETATM 3128 H14 THR A 398 -10.646 12.935 -8.891 1.00 0.03 H HETATM 3129 H15 THR A 398 -9.255 13.679 -9.749 1.00 0.03 H HETATM 3130 H16 THR A 398 -9.332 13.724 -7.955 1.00 0.03 H HETATM 3131 H12 THR A 398 -9.128 11.254 -7.882 1.00 0.06 H HETATM 3132 H11 THR A 398 -7.101 12.780 -7.943 1.00 0.08 H HETATM 3133 H10 THR A 398 -6.919 12.007 -10.816 1.00 0.19 H HETATM 3134 CB THR A 398 -4.246 13.656 -11.587 1.00 0.11 C HETATM 3135 OG1 THR A 398 -3.426 14.452 -10.714 1.00 -0.38 O HETATM 3136 H6 THR A 398 -3.732 14.356 -9.820 1.00 0.21 H HETATM 3137 CG2 THR A 398 -3.735 13.771 -13.027 1.00 -0.03 C HETATM 3138 H7 THR A 398 -2.689 13.433 -13.073 1.00 0.03 H HETATM 3139 H8 THR A 398 -3.796 14.819 -13.355 1.00 0.03 H HETATM 3140 H9 THR A 398 -4.352 13.143 -13.686 1.00 0.03 H HETATM 3141 H5 THR A 398 -4.188 12.604 -11.272 1.00 0.07 H HETATM 3142 H4 THR A 398 -6.303 13.584 -12.252 1.00 0.11 H HETATM 3143 H1 THR A 398 -6.829 15.818 -11.682 1.00 0.20 H HETATM 3144 H2 THR A 398 -5.521 15.765 -12.680 1.00 0.20 H HETATM 3145 H3 THR A 398 -5.321 16.075 -11.076 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 3007 3008 3143 3144 3145 CONECT 3008 3007 3009 3134 3142 CONECT 3009 3008 3010 3011 CONECT 3010 3009 CONECT 3011 3009 3012 3133 CONECT 3012 3011 3013 3124 3132 CONECT 3013 3012 3014 3015 CONECT 3014 3013 CONECT 3015 3013 3016 3123 CONECT 3016 3015 3017 3111 3122 CONECT 3017 3016 3018 3019 CONECT 3018 3017 CONECT 3019 3017 3020 3110 CONECT 3020 3019 3021 3091 3109 CONECT 3021 3020 3022 3023 CONECT 3022 3021 CONECT 3023 3021 3024 3090 CONECT 3024 3023 3025 3073 3089 CONECT 3025 3024 3026 3027 CONECT 3026 3025 CONECT 3027 3025 3028 3072 CONECT 3028 3027 3029 3053 3071 CONECT 3029 3028 3030 3031 CONECT 3030 3029 CONECT 3031 3029 3032 3052 CONECT 3032 3031 3033 3046 3051 CONECT 3033 3032 3034 3035 CONECT 3034 3033 CONECT 3035 3033 3036 3045 CONECT 3036 3035 3037 3040 3044 CONECT 3037 3036 3038 3039 CONECT 3038 3037 CONECT 3039 3037 CONECT 3040 3036 3041 3042 3043 CONECT 3041 3040 CONECT 3042 3040 CONECT 3043 3040 CONECT 3044 3036 CONECT 3045 3035 CONECT 3046 3032 3047 3049 3050 CONECT 3047 3046 3048 CONECT 3048 3047 CONECT 3049 3046 CONECT 3050 3046 CONECT 3051 3032 CONECT 3052 3031 CONECT 3053 3028 3054 3069 3070 CONECT 3054 3053 3055 3067 3068 CONECT 3055 3054 3056 3065 3066 CONECT 3056 3055 3057 3064 CONECT 3057 3056 3058 3061 CONECT 3058 3057 3059 3060 CONECT 3059 3058 CONECT 3060 3058 CONECT 3061 3057 3062 3063 CONECT 3062 3061 CONECT 3063 3061 CONECT 3064 3056 CONECT 3065 3055 CONECT 3066 3055 CONECT 3067 3054 CONECT 3068 3054 CONECT 3069 3053 CONECT 3070 3053 CONECT 3071 3028 CONECT 3072 3027 CONECT 3073 3024 3074 3087 3088 CONECT 3074 3073 3075 3085 3086 CONECT 3075 3074 3076 3083 3084 CONECT 3076 3075 3077 3081 3082 CONECT 3077 3076 3078 3079 3080 CONECT 3078 3077 CONECT 3079 3077 CONECT 3080 3077 CONECT 3081 3076 CONECT 3082 3076 CONECT 3083 3075 CONECT 3084 3075 CONECT 3085 3074 CONECT 3086 3074 CONECT 3087 3073 CONECT 3088 3073 CONECT 3089 3024 CONECT 3090 3023 CONECT 3091 3020 3092 3107 3108 CONECT 3092 3091 3093 3105 3106 CONECT 3093 3092 3094 3103 3104 CONECT 3094 3093 3095 3102 CONECT 3095 3094 3096 3099 CONECT 3096 3095 3097 3098 CONECT 3097 3096 CONECT 3098 3096 CONECT 3099 3095 3100 3101 CONECT 3100 3099 CONECT 3101 3099 CONECT 3102 3094 CONECT 3103 3093 CONECT 3104 3093 CONECT 3105 3092 CONECT 3106 3092 CONECT 3107 3091 CONECT 3108 3091 CONECT 3109 3020 CONECT 3110 3019 CONECT 3111 3016 3112 3120 3121 CONECT 3112 3111 3113 3118 3119 CONECT 3113 3112 3114 3115 CONECT 3114 3113 CONECT 3115 3113 3116 3117 CONECT 3116 3115 CONECT 3117 3115 CONECT 3118 3112 CONECT 3119 3112 CONECT 3120 3111 CONECT 3121 3111 CONECT 3122 3016 CONECT 3123 3015 CONECT 3124 3012 3125 3127 3131 CONECT 3125 3124 3126 CONECT 3126 3125 CONECT 3127 3124 3128 3129 3130 CONECT 3128 3127 CONECT 3129 3127 CONECT 3130 3127 CONECT 3131 3124 CONECT 3132 3012 CONECT 3133 3011 CONECT 3134 3008 3135 3137 3141 CONECT 3135 3134 3136 CONECT 3136 3135 CONECT 3137 3134 3138 3139 3140 CONECT 3138 3137 CONECT 3139 3137 CONECT 3140 3137 CONECT 3141 3134 CONECT 3142 3008 CONECT 3143 3007 CONECT 3144 3007 CONECT 3145 3007 MASTER 0 0 0 0 0 0 0 0 3143 2 147 22 END
Display Options:
Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
Goto PDB code:
3D presentation of molecule is powered by
3Dmol
, which supports all modern browsers and mobile devices via WebGL.
Hold mouse button:
left to rotate,middle to shift,right to zoom
Related entries of code: 5y53
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
No similar entries are found!
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
1a3e
RCSB PDB
PDBbind
18-mer
1guw
RCSB PDB
PDBbind
18-mer
1l0a
RCSB PDB
PDBbind
18-mer
1n4m
RCSB PDB
PDBbind
18-mer
1o9k
RCSB PDB
PDBbind
18-mer
1ov3
RCSB PDB
PDBbind
18-mer
1pdq
RCSB PDB
PDBbind
18-mer
2df6
RCSB PDB
PDBbind
18-mer
2emt
RCSB PDB
PDBbind
18-mer
2h2d
RCSB PDB
PDBbind
18-mer
2kbr
RCSB PDB
PDBbind
18-mer
2knh
RCSB PDB
PDBbind
18-mer
2kzu
RCSB PDB
PDBbind
18-mer
2l8j
RCSB PDB
PDBbind
18-mer
2lp8
RCSB PDB
PDBbind
18-mer
2rvn
RCSB PDB
PDBbind
18-mer
2vpg
RCSB PDB
PDBbind
18-mer
2xs8
RCSB PDB
PDBbind
18-mer
2y9q
RCSB PDB
PDBbind
18-mer
3c3q
RCSB PDB
PDBbind
18-mer
3cfv
RCSB PDB
PDBbind
18-mer
3isw
RCSB PDB
PDBbind
18-mer
3iux
RCSB PDB
PDBbind
18-mer
3kl8
RCSB PDB
PDBbind
18-mer
3l6x
RCSB PDB
PDBbind
18-mer
3pdh
RCSB PDB
PDBbind
18-mer
3rtx
RCSB PDB
PDBbind
18-mer
3uat
RCSB PDB
PDBbind
18-mer
3v31
RCSB PDB
PDBbind
18-mer
3v43
RCSB PDB
PDBbind
18-mer
4aom
RCSB PDB
PDBbind
18-mer
4ejf
RCSB PDB
PDBbind
18-mer
4glr
RCSB PDB
PDBbind
18-mer
4jk5
RCSB PDB
PDBbind
18-mer
4jk6
RCSB PDB
PDBbind
18-mer
4mzl
RCSB PDB
PDBbind
18-mer
4pn1
RCSB PDB
PDBbind
18-mer
4pz8
RCSB PDB
PDBbind
18-mer
4ris
RCSB PDB
PDBbind
18-mer
4rqi
RCSB PDB
PDBbind
18-mer
4wrq
RCSB PDB
PDBbind
18-mer
4xh2
RCSB PDB
PDBbind
18-mer
5b4w
RCSB PDB
PDBbind
18-mer
5e2v
RCSB PDB
PDBbind
18-mer
5e2w
RCSB PDB
PDBbind
18-mer
5jek
RCSB PDB
PDBbind
18-mer
5mk1
RCSB PDB
PDBbind
18-mer
5mk3
RCSB PDB
PDBbind
18-mer
5ods
RCSB PDB
PDBbind
18-mer
5sve
RCSB PDB
PDBbind
18-mer
5t90
RCSB PDB
PDBbind
18-mer
5uwi
RCSB PDB
PDBbind
18-mer
5v3r
RCSB PDB
PDBbind
18-mer
5wa1
RCSB PDB
PDBbind
18-mer
5xyf
RCSB PDB
PDBbind
18-mer
5yc2
RCSB PDB
PDBbind
18-mer
5yv5
RCSB PDB
PDBbind
18-mer
6bhd
RCSB PDB
PDBbind
18-mer
6bhe
RCSB PDB
PDBbind
18-mer
6bhh
RCSB PDB
PDBbind
18-mer
6h41
RCSB PDB
PDBbind
18-mer
6jjz
RCSB PDB
PDBbind
18-mer
6iqg
RCSB PDB
PDBbind
18-mer
6esa
RCSB PDB
PDBbind
18-mer
6erw
RCSB PDB
PDBbind
18-mer
6erv
RCSB PDB
PDBbind
18-mer
6eru
RCSB PDB
PDBbind
18-mer
6em7
RCSB PDB
PDBbind
18-mer
6em6
RCSB PDB
PDBbind
18-mer
6eh2
RCSB PDB
PDBbind
18-mer
6egw
RCSB PDB
PDBbind
18-mer
5szc
RCSB PDB
PDBbind
18-mer
5szb
RCSB PDB
PDBbind
18-mer
5ous
RCSB PDB
PDBbind
18-mer
5oua
RCSB PDB
PDBbind
18-mer
5ol3
RCSB PDB
PDBbind
18-mer
5ok3
RCSB PDB
PDBbind
18-mer
5o0e
RCSB PDB
PDBbind
18-mer
5nw8
RCSB PDB
PDBbind
18-mer
6ema
RCSB PDB
PDBbind
18-mer
6sen
RCSB PDB
PDBbind
18-mer
6seo
RCSB PDB
PDBbind
18-mer
Entry Information
PDB ID
5y53
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
PHD finger protein ALFIN-LIKE 2
Ligand Name
18-mer
EC.Number
E.C.-.-.-.-
Resolution
1.6(Å)
Affinity (Kd/Ki/IC50)
Kd=0.43uM
Release Year
2018
Protein/NA Sequence
Check fasta file
Primary Reference
(2018) J. Mol. Biol. Vol. 430: pp. 4245-4259
Ligand Properties
Formula
C
3
7
H
7
4
N
1
6
O
1
3
Molecular Weight
951.083
Exact Mass
950.562
No. of atoms
140
No. of bonds
139
Polar Surface Area
532.08
LOGP Value
-5.76 (
Computed with XLOGP3
)
-7.97 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 13
No. of Hydrogen Bond Acceptors: 13
No. of Rotatable Bonds: 42
No. of Nitrogen and Oxygen Atoms: 29
No. of Rings: 0
Canonical SMILES
[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)CO)CCC[NH+]=C(N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H]([C@H](O)C)[NH3+])CCC(=O)N)CCC[NH+]=C(N)N
InChI String
InChI=1S/C37H70N16O13/c1-17(35(65)66)47-32(62)24(16-54)52-30(60)22(10-7-15-46-37(43)44)49-28(58)20(8-4-5-13-38)48-29(59)21(9-6-14-45-36(41)42)50-31(61)23(11-12-25(39)57)51-34(64)27(19(3)56)53-33(63)26(40)18(2)55/h17-24,26-27,54-56H,4-16,38,40H2,1-3H3,(H2,39,57)(H,47,62)(H,48,59)(H,49,58)(H,50,61)(H,51,64)(H,52,60)(H,53,63)(H,65,66)(H4,41,42,45)(H4,43,44,46)/p+4/t17-,18+,19+,20-,21-,22-,23-,24-,26-,27-/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):
Q9M9Y4
Q9SRM4
Entrez Gene ID
NCBI Entrez Gene ID:
837188
820290
ASD
Information of known allosteric effects of PDB entries
This site has been visited
times since Nov 2007.
Copyright ©2007-2024 涓婃捣鐩堣禌鎬濅俊鎭鎶鏈夐檺鍏徃 缃戠珯澶囨鍙凤細
娌狪CP澶2021015625鍙-3
娌叕缃戝畨澶囷細
姝e湪鐢宠涓
Technical Support锛堟妧鏈敮鎸侊級:
yingsaisi@foxmail.com