Browse entries in the PDBbind-CN Database
HEADER 5ZAF_COMPLEX COMPND 5ZAF_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 U 245 ILE ILE GLY GLY GLU PHE THR THR ILE GLU ASN GLN PRO SEQRES 2 U 245 TRP PHE ALA ALA ILE TYR ARG ARG HIS ARG GLY GLY SER SEQRES 3 U 245 VAL THR TYR VAL CYS GLY GLY SER LEU ILE SER PRO CYS SEQRES 4 U 245 TRP VAL ILE SER ALA THR HIS CYS PHE ILE ASP TYR PRO SEQRES 5 U 245 LYS LYS GLU ASP TYR ILE VAL TYR LEU GLY ARG SER ARG SEQRES 6 U 245 LEU ASN SER ASN THR GLN GLY GLU MET LYS PHE GLU VAL SEQRES 7 U 245 GLU ASN LEU ILE LEU HIS LYS ASP TYR SER ALA ASP THR SEQRES 8 U 245 LEU ALA HIS HIS ASN ASP ILE ALA LEU LEU LYS ILE ARG SEQRES 9 U 245 SER LYS GLU GLY ARG CYS ALA GLN PRO SER ARG THR ILE SEQRES 10 U 245 GLN THR ILE ALA LEU PRO SER MET TYR ASN ASP PRO GLN SEQRES 11 U 245 PHE GLY THR SER CYS GLU ILE THR GLY PHE GLY LYS GLU SEQRES 12 U 245 GLN SER THR ASP TYR LEU TYR PRO GLU GLN LEU LYS MET SEQRES 13 U 245 THR VAL VAL LYS LEU ILE SER HIS ARG GLU CYS GLN GLN SEQRES 14 U 245 PRO HIS TYR TYR GLY SER GLU VAL THR THR LYS MET LEU SEQRES 15 U 245 CYS ALA ALA ASP PRO GLN TRP LYS THR ASP SER CYS GLN SEQRES 16 U 245 GLY ASP SER GLY GLY PRO LEU VAL CYS SER LEU GLN GLY SEQRES 17 U 245 ARG MET THR LEU THR GLY ILE VAL SER TRP GLY ARG GLY SEQRES 18 U 245 CYS ALA LEU LYS ASP LYS PRO GLY VAL TYR THR ARG VAL SEQRES 19 U 245 SER HIS PHE LEU PRO TRP ILE ARG SER HIS THR HET UNN A 373 47 SSBOND 1 CYS U 42 CYS U 58 SSBOND 2 CYS U 50 CYS U 111 SSBOND 3 CYS U 168 CYS U 182 SSBOND 4 CYS U 136 CYS U 201 SSBOND 5 CYS U 191 CYS U 220 ATOM 1 N ILE U 16 -9.470 34.578 22.345 1.00 15.61 N ATOM 2 CA ILE U 16 -9.682 36.055 22.270 1.00 16.34 C ATOM 3 C ILE U 16 -10.524 36.493 23.461 1.00 16.40 C ATOM 4 O ILE U 16 -11.639 35.993 23.637 1.00 16.66 O ATOM 5 CB ILE U 16 -10.392 36.473 20.956 1.00 16.41 C ATOM 6 CG1 ILE U 16 -9.609 36.001 19.715 1.00 16.54 C ATOM 7 CG2 ILE U 16 -10.641 37.976 20.912 1.00 16.36 C ATOM 8 CD1 ILE U 16 -8.330 36.765 19.424 1.00 16.65 C ATOM 9 HN3 ILE U 16 -10.391 34.095 22.322 1.00 0.00 H ATOM 10 HN2 ILE U 16 -8.977 34.344 23.230 1.00 0.00 H ATOM 11 HN1 ILE U 16 -8.895 34.270 21.535 1.00 0.00 H ATOM 12 N ILE U 17 -9.973 37.395 24.275 1.00 16.29 N ATOM 13 CA ILE U 17 -10.682 37.994 25.402 1.00 16.75 C ATOM 14 C ILE U 17 -11.447 39.178 24.834 1.00 16.67 C ATOM 15 O ILE U 17 -10.859 39.999 24.138 1.00 17.00 O ATOM 16 CB ILE U 17 -9.739 38.541 26.503 1.00 16.93 C ATOM 17 CG1 ILE U 17 -8.670 37.515 26.908 1.00 17.42 C ATOM 18 CG2 ILE U 17 -10.546 39.049 27.699 1.00 17.11 C ATOM 19 CD1 ILE U 17 -9.195 36.180 27.384 1.00 17.34 C ATOM 20 H ILE U 17 -8.990 37.686 24.098 1.00 0.00 H ATOM 21 N GLY U 18 -12.742 39.263 25.124 1.00 16.81 N ATOM 22 CA GLY U 18 -13.574 40.327 24.589 1.00 17.07 C ATOM 23 C GLY U 18 -13.758 40.189 23.087 1.00 17.43 C ATOM 24 O GLY U 18 -13.833 39.078 22.558 1.00 17.00 O ATOM 25 H GLY U 18 -13.170 38.550 25.749 1.00 0.00 H ATOM 26 N GLY U 19 -13.812 41.317 22.390 1.00 17.57 N ATOM 27 CA GLY U 19 -14.050 41.300 20.954 1.00 18.14 C ATOM 28 C GLY U 19 -15.401 40.729 20.581 1.00 18.81 C ATOM 29 O GLY U 19 -16.381 40.858 21.327 1.00 19.07 O ATOM 30 H GLY U 19 -13.682 42.227 22.877 1.00 0.00 H ATOM 31 N GLU U 20 -15.448 40.048 19.446 1.00 19.09 N ATOM 32 CA GLU U 20 -16.718 39.640 18.867 1.00 19.85 C ATOM 33 C GLU U 20 -16.582 38.308 18.167 1.00 18.79 C ATOM 34 O GLU U 20 -15.512 37.976 17.651 1.00 17.70 O ATOM 35 CB GLU U 20 -17.199 40.722 17.892 1.00 21.61 C ATOM 36 CG GLU U 20 -16.207 41.054 16.777 1.00 23.03 C ATOM 37 CD GLU U 20 -16.389 42.446 16.187 1.00 24.55 C ATOM 38 OE1 GLU U 20 -16.598 42.537 14.964 1.00 26.37 O ATOM 39 OE2 GLU U 20 -16.312 43.449 16.932 1.00 26.63 O ATOM 40 H GLU U 20 -14.562 39.801 18.961 1.00 0.00 H ATOM 41 N PHE U 21 -17.670 37.544 18.136 1.00 17.98 N ATOM 42 CA PHE U 21 -17.700 36.342 17.322 1.00 17.71 C ATOM 43 C PHE U 21 -17.691 36.731 15.855 1.00 18.16 C ATOM 44 O PHE U 21 -18.080 37.846 15.487 1.00 18.65 O ATOM 45 CB PHE U 21 -18.885 35.455 17.669 1.00 17.82 C ATOM 46 CG PHE U 21 -18.752 34.819 19.011 1.00 17.31 C ATOM 47 CD1 PHE U 21 -17.925 33.718 19.182 1.00 17.36 C ATOM 48 CD2 PHE U 21 -19.401 35.352 20.117 1.00 17.90 C ATOM 49 CE1 PHE U 21 -17.764 33.138 20.430 1.00 17.62 C ATOM 50 CE2 PHE U 21 -19.255 34.772 21.367 1.00 17.97 C ATOM 51 CZ PHE U 21 -18.436 33.667 21.524 1.00 17.89 C ATOM 52 H PHE U 21 -18.504 37.809 18.698 1.00 0.00 H ATOM 53 N THR U 22 -17.197 35.812 15.038 1.00 18.28 N ATOM 54 CA THR U 22 -17.028 36.053 13.617 1.00 18.23 C ATOM 55 C THR U 22 -17.124 34.726 12.881 1.00 18.41 C ATOM 56 O THR U 22 -17.374 33.678 13.488 1.00 18.58 O ATOM 57 CB THR U 22 -15.685 36.782 13.342 1.00 18.70 C ATOM 58 OG1 THR U 22 -15.674 37.299 12.010 1.00 19.56 O ATOM 59 CG2 THR U 22 -14.471 35.870 13.541 1.00 18.75 C ATOM 60 HG1 THR U 22 -15.778 36.553 11.367 1.00 0.00 H ATOM 61 H THR U 22 -16.921 34.888 15.428 1.00 0.00 H ATOM 62 N THR U 23 -16.949 34.787 11.570 1.00 18.98 N ATOM 63 CA THR U 23 -16.870 33.599 10.735 1.00 19.10 C ATOM 64 C THR U 23 -15.678 33.746 9.811 1.00 18.74 C ATOM 65 O THR U 23 -15.087 34.819 9.681 1.00 18.69 O ATOM 66 CB THR U 23 -18.132 33.391 9.874 1.00 19.90 C ATOM 67 OG1 THR U 23 -18.420 34.600 9.163 1.00 20.51 O ATOM 68 CG2 THR U 23 -19.309 32.992 10.725 1.00 20.66 C ATOM 69 HG1 THR U 23 -18.575 35.333 9.810 1.00 0.00 H ATOM 70 H THR U 23 -16.865 35.721 11.120 1.00 0.00 H ATOM 71 N ILE U 24 -15.349 32.644 9.158 1.00 18.50 N ATOM 72 CA ILE U 24 -14.147 32.562 8.333 1.00 18.66 C ATOM 73 C ILE U 24 -14.149 33.530 7.140 1.00 18.27 C ATOM 74 O ILE U 24 -13.091 33.918 6.679 1.00 17.68 O ATOM 75 CB ILE U 24 -13.880 31.101 7.894 1.00 18.83 C ATOM 76 CG1 ILE U 24 -12.434 30.903 7.414 1.00 19.18 C ATOM 77 CG2 ILE U 24 -14.867 30.653 6.822 1.00 19.60 C ATOM 78 CD1 ILE U 24 -11.384 31.114 8.474 1.00 19.34 C ATOM 79 H ILE U 24 -15.966 31.810 9.234 1.00 0.00 H ATOM 80 N GLU U 25 -15.319 33.961 6.672 1.00 18.75 N ATOM 81 CA GLU U 25 -15.381 34.969 5.595 1.00 18.95 C ATOM 82 C GLU U 25 -14.696 36.293 5.950 1.00 19.11 C ATOM 83 O GLU U 25 -14.223 37.009 5.061 1.00 19.66 O ATOM 84 CB GLU U 25 -16.835 35.260 5.184 1.00 19.84 C ATOM 85 CG GLU U 25 -17.557 34.092 4.529 1.00 20.42 C ATOM 86 CD GLU U 25 -18.208 33.127 5.495 1.00 21.20 C ATOM 87 OE1 GLU U 25 -17.943 33.205 6.721 1.00 21.99 O ATOM 88 OE2 GLU U 25 -18.985 32.271 5.031 1.00 22.25 O ATOM 89 H GLU U 25 -16.202 33.582 7.071 1.00 0.00 H ATOM 90 N ASN U 26 -14.666 36.624 7.242 1.00 18.66 N ATOM 91 CA ASN U 26 -14.007 37.827 7.744 1.00 18.55 C ATOM 92 C ASN U 26 -12.504 37.687 8.042 1.00 18.78 C ATOM 93 O ASN U 26 -11.852 38.665 8.431 1.00 19.47 O ATOM 94 CB ASN U 26 -14.726 38.297 9.001 1.00 18.51 C ATOM 95 CG ASN U 26 -16.156 38.701 8.730 1.00 18.44 C ATOM 96 OD1 ASN U 26 -16.450 39.280 7.687 1.00 18.13 O ATOM 97 ND2 ASN U 26 -17.051 38.395 9.664 1.00 18.03 N ATOM 98 HD22 ASN U 26 -16.751 37.904 10.530 1.00 0.00 H ATOM 99 HD21 ASN U 26 -18.051 38.647 9.528 1.00 0.00 H ATOM 100 H ASN U 26 -15.135 35.995 7.925 1.00 0.00 H ATOM 101 N GLN U 27 -11.972 36.477 7.877 1.00 18.50 N ATOM 102 CA GLN U 27 -10.542 36.214 8.025 1.00 18.12 C ATOM 103 C GLN U 27 -10.212 34.919 7.255 1.00 17.64 C ATOM 104 O GLN U 27 -9.783 33.931 7.842 1.00 17.14 O ATOM 105 CB GLN U 27 -10.180 36.108 9.517 1.00 18.57 C ATOM 106 CG GLN U 27 -8.698 36.308 9.839 1.00 18.90 C ATOM 107 CD GLN U 27 -8.234 37.764 9.926 1.00 19.08 C ATOM 108 OE1 GLN U 27 -7.053 38.025 10.193 1.00 19.74 O ATOM 109 NE2 GLN U 27 -9.132 38.710 9.683 1.00 19.47 N ATOM 110 HE22 GLN U 27 -10.115 38.450 9.462 1.00 0.00 H ATOM 111 HE21 GLN U 27 -8.853 39.712 9.713 1.00 0.00 H ATOM 112 H GLN U 27 -12.601 35.686 7.632 1.00 0.00 H ATOM 113 N PRO U 28 -10.415 34.923 5.916 1.00 17.65 N ATOM 114 CA PRO U 28 -10.375 33.683 5.105 1.00 17.47 C ATOM 115 C PRO U 28 -8.990 33.037 4.914 1.00 17.74 C ATOM 116 O PRO U 28 -8.896 31.947 4.350 1.00 17.17 O ATOM 117 CB PRO U 28 -10.962 34.128 3.758 1.00 17.61 C ATOM 118 CG PRO U 28 -10.662 35.578 3.687 1.00 17.51 C ATOM 119 CD PRO U 28 -10.789 36.090 5.094 1.00 17.52 C ATOM 120 N TRP U 29 -7.949 33.715 5.376 1.00 17.42 N ATOM 121 CA TRP U 29 -6.592 33.149 5.483 1.00 17.47 C ATOM 122 C TRP U 29 -6.363 32.375 6.783 1.00 17.32 C ATOM 123 O TRP U 29 -5.310 31.748 6.935 1.00 17.25 O ATOM 124 CB TRP U 29 -5.533 34.253 5.358 1.00 17.96 C ATOM 125 CG TRP U 29 -5.803 35.457 6.202 1.00 18.91 C ATOM 126 CD1 TRP U 29 -5.443 35.652 7.504 1.00 19.19 C ATOM 127 CD2 TRP U 29 -6.502 36.638 5.793 1.00 19.23 C ATOM 128 NE1 TRP U 29 -5.875 36.884 7.930 1.00 19.95 N ATOM 129 CE2 TRP U 29 -6.532 37.508 6.898 1.00 19.75 C ATOM 130 CE3 TRP U 29 -7.114 37.039 4.595 1.00 19.72 C ATOM 131 CZ2 TRP U 29 -7.149 38.761 6.844 1.00 19.92 C ATOM 132 CZ3 TRP U 29 -7.725 38.277 4.541 1.00 19.79 C ATOM 133 CH2 TRP U 29 -7.738 39.125 5.659 1.00 19.70 C ATOM 134 HE1 TRP U 29 -5.728 37.280 8.880 1.00 0.00 H ATOM 135 H TRP U 29 -8.097 34.699 5.679 1.00 0.00 H ATOM 136 N PHE U 30 -7.311 32.413 7.719 1.00 16.63 N ATOM 137 CA PHE U 30 -7.105 31.776 9.023 1.00 16.04 C ATOM 138 C PHE U 30 -7.074 30.251 8.897 1.00 15.90 C ATOM 139 O PHE U 30 -7.972 29.645 8.324 1.00 15.58 O ATOM 140 CB PHE U 30 -8.179 32.191 10.035 1.00 15.79 C ATOM 141 CG PHE U 30 -7.953 31.612 11.396 1.00 15.71 C ATOM 142 CD1 PHE U 30 -6.990 32.161 12.226 1.00 15.56 C ATOM 143 CD2 PHE U 30 -8.668 30.497 11.837 1.00 15.53 C ATOM 144 CE1 PHE U 30 -6.747 31.621 13.475 1.00 15.75 C ATOM 145 CE2 PHE U 30 -8.425 29.955 13.089 1.00 15.72 C ATOM 146 CZ PHE U 30 -7.461 30.516 13.905 1.00 15.34 C ATOM 147 H PHE U 30 -8.208 32.901 7.522 1.00 0.00 H ATOM 148 N ALA U 31 -6.035 29.642 9.467 1.00 15.85 N ATOM 149 CA ALA U 31 -5.856 28.203 9.445 1.00 16.18 C ATOM 150 C ALA U 31 -6.008 27.690 10.859 1.00 16.09 C ATOM 151 O ALA U 31 -5.440 28.261 11.796 1.00 16.02 O ATOM 152 CB ALA U 31 -4.478 27.851 8.908 1.00 16.56 C ATOM 153 H ALA U 31 -5.321 30.224 9.949 1.00 0.00 H ATOM 154 N ALA U 32 -6.785 26.623 10.994 1.00 16.18 N ATOM 155 CA ALA U 32 -7.028 25.951 12.265 1.00 16.51 C ATOM 156 C ALA U 32 -6.193 24.669 12.299 1.00 16.82 C ATOM 157 O ALA U 32 -6.390 23.770 11.466 1.00 16.75 O ATOM 158 CB ALA U 32 -8.507 25.629 12.398 1.00 16.78 C ATOM 159 H ALA U 32 -7.248 26.244 10.143 1.00 0.00 H ATOM 160 N ILE U 33 -5.259 24.597 13.255 1.00 16.78 N ATOM 161 CA ILE U 33 -4.285 23.498 13.342 1.00 17.28 C ATOM 162 C ILE U 33 -4.569 22.596 14.554 1.00 17.58 C ATOM 163 O ILE U 33 -4.692 23.078 15.689 1.00 17.69 O ATOM 164 CB ILE U 33 -2.837 24.034 13.392 1.00 16.98 C ATOM 165 CG1 ILE U 33 -2.595 25.033 12.238 1.00 17.04 C ATOM 166 CG2 ILE U 33 -1.842 22.877 13.335 1.00 16.96 C ATOM 167 CD1 ILE U 33 -1.308 25.829 12.340 1.00 17.28 C ATOM 168 H ILE U 33 -5.220 25.352 13.969 1.00 0.00 H ATOM 169 N TYR U 34 -4.685 21.293 14.291 1.00 18.44 N ATOM 170 CA TYR U 34 -5.025 20.287 15.295 1.00 19.27 C ATOM 171 C TYR U 34 -3.950 19.201 15.336 1.00 20.71 C ATOM 172 O TYR U 34 -3.211 19.021 14.371 1.00 20.50 O ATOM 173 CB TYR U 34 -6.361 19.618 14.960 1.00 19.40 C ATOM 174 CG TYR U 34 -7.570 20.534 14.833 1.00 18.92 C ATOM 175 CD1 TYR U 34 -7.744 21.346 13.712 1.00 18.89 C ATOM 176 CD2 TYR U 34 -8.567 20.541 15.809 1.00 18.83 C ATOM 177 CE1 TYR U 34 -8.858 22.166 13.584 1.00 18.90 C ATOM 178 CE2 TYR U 34 -9.680 21.361 15.690 1.00 19.18 C ATOM 179 CZ TYR U 34 -9.823 22.167 14.576 1.00 19.07 C ATOM 180 OH TYR U 34 -10.930 22.978 14.443 1.00 19.24 O ATOM 181 HH TYR U 34 -11.748 22.420 14.439 1.00 0.00 H ATOM 182 H TYR U 34 -4.524 20.975 13.314 1.00 0.00 H ATOM 183 N ARG U 35 -3.887 18.466 16.442 1.00 23.01 N ATOM 184 CA ARG U 35 -2.946 17.347 16.580 1.00 26.28 C ATOM 185 C ARG U 35 -3.687 16.044 16.830 1.00 28.02 C ATOM 186 O ARG U 35 -4.616 16.010 17.632 1.00 26.27 O ATOM 187 CB ARG U 35 -1.961 17.598 17.723 1.00 28.45 C ATOM 188 CG ARG U 35 -0.913 16.500 17.893 1.00 30.89 C ATOM 189 CD ARG U 35 0.214 16.926 18.818 1.00 32.39 C ATOM 190 NE ARG U 35 -0.239 17.052 20.205 1.00 35.41 N ATOM 191 CZ ARG U 35 -0.374 16.048 21.077 1.00 37.75 C ATOM 192 NH1 ARG U 35 -0.103 14.784 20.742 1.00 38.47 N ATOM 193 NH2 ARG U 35 -0.795 16.314 22.313 1.00 39.71 N ATOM 194 HE ARG U 35 -0.477 18.007 20.541 1.00 0.00 H ATOM 195 HH12 ARG U 35 -0.218 14.024 21.443 1.00 0.00 H ATOM 196 HH11 ARG U 35 0.223 14.559 19.780 1.00 0.00 H ATOM 197 HH22 ARG U 35 -0.905 15.543 23.002 1.00 0.00 H ATOM 198 HH21 ARG U 35 -1.014 17.293 22.588 1.00 0.00 H ATOM 199 H ARG U 35 -4.523 18.690 17.233 1.00 0.00 H ATOM 200 N ARG U 36 -3.257 14.992 16.160 1.00 31.22 N ATOM 201 CA ARG U 36 -3.777 13.654 16.402 1.00 35.45 C ATOM 202 C ARG U 36 -3.071 13.021 17.530 1.00 37.36 C ATOM 203 O ARG U 36 -1.894 13.091 17.631 1.00 38.42 O ATOM 204 CB ARG U 36 -3.613 12.713 15.227 1.00 37.64 C ATOM 205 CG ARG U 36 -3.602 13.326 13.857 1.00 38.77 C ATOM 206 CD ARG U 36 -3.045 12.364 12.815 1.00 40.35 C ATOM 207 NE ARG U 36 -3.891 12.405 11.646 1.00 41.18 N ATOM 208 CZ ARG U 36 -3.532 12.829 10.467 1.00 42.15 C ATOM 209 NH1 ARG U 36 -2.317 13.227 10.260 1.00 42.78 N ATOM 210 NH2 ARG U 36 -4.405 12.860 9.494 1.00 43.20 N ATOM 211 HE ARG U 36 -4.869 12.068 11.754 1.00 0.00 H ATOM 212 HH12 ARG U 36 -2.034 13.565 9.318 1.00 0.00 H ATOM 213 HH11 ARG U 36 -1.625 13.209 11.036 1.00 0.00 H ATOM 214 HH22 ARG U 36 -4.122 13.198 8.552 1.00 0.00 H ATOM 215 HH21 ARG U 36 -5.382 12.547 9.662 1.00 0.00 H ATOM 216 H ARG U 36 -2.523 15.123 15.435 1.00 0.00 H ATOM 217 N HIS U 37 -3.817 12.339 18.365 1.00 40.85 N ATOM 218 CA HIS U 37 -3.244 11.654 19.480 1.00 43.60 C ATOM 219 C HIS U 37 -3.106 10.168 19.205 1.00 46.62 C ATOM 220 O HIS U 37 -3.848 9.566 18.434 1.00 45.18 O ATOM 221 CB HIS U 37 -4.126 11.811 20.695 1.00 44.31 C ATOM 222 CG HIS U 37 -4.025 13.141 21.344 1.00 44.59 C ATOM 223 ND1 HIS U 37 -4.353 14.305 20.701 1.00 45.12 N ATOM 224 CD2 HIS U 37 -3.662 13.489 22.594 1.00 45.66 C ATOM 225 CE1 HIS U 37 -4.190 15.318 21.523 1.00 45.23 C ATOM 226 NE2 HIS U 37 -3.759 14.851 22.677 1.00 46.28 N ATOM 227 H HIS U 37 -4.845 12.296 18.213 1.00 0.00 H ATOM 228 N ARG U 37A -2.163 9.594 19.929 1.00 50.11 N ATOM 229 CA ARG U 37A -2.078 8.175 20.140 1.00 52.73 C ATOM 230 C ARG U 37A -3.384 7.810 20.778 1.00 52.51 C ATOM 231 O ARG U 37A -3.711 8.263 21.842 1.00 54.32 O ATOM 232 CB ARG U 37A -1.013 7.963 21.195 1.00 54.16 C ATOM 233 CG ARG U 37A -1.150 8.947 22.369 1.00 56.12 C ATOM 234 CD ARG U 37A -0.657 10.370 22.065 1.00 56.51 C ATOM 235 NE ARG U 37A -1.140 11.354 23.012 1.00 56.90 N ATOM 236 CZ ARG U 37A -0.380 12.102 23.785 1.00 57.77 C ATOM 237 NH1 ARG U 37A 0.921 11.978 23.750 1.00 58.74 N ATOM 238 NH2 ARG U 37A -0.921 12.979 24.605 1.00 58.22 N ATOM 239 HE ARG U 37A -2.170 11.480 23.088 1.00 0.00 H ATOM 240 HH12 ARG U 37A 1.517 12.571 24.362 1.00 0.00 H ATOM 241 HH11 ARG U 37A 1.360 11.286 23.110 1.00 0.00 H ATOM 242 HH22 ARG U 37A -0.314 13.566 25.212 1.00 0.00 H ATOM 243 HH21 ARG U 37A -1.955 13.084 24.645 1.00 0.00 H ATOM 244 H ARG U 37A -1.443 10.201 20.370 1.00 0.00 H ATOM 245 N GLY U 37B -4.107 6.925 20.142 1.00 52.08 N ATOM 246 CA GLY U 37B -5.483 6.682 20.490 1.00 51.77 C ATOM 247 C GLY U 37B -6.503 7.285 19.559 1.00 50.99 C ATOM 248 O GLY U 37B -7.598 6.776 19.444 1.00 52.24 O ATOM 249 H GLY U 37B -3.677 6.383 19.365 1.00 0.00 H ATOM 250 N GLY U 37C -6.084 8.265 18.792 1.00 49.35 N ATOM 251 CA GLY U 37C -6.884 8.813 17.712 1.00 47.97 C ATOM 252 C GLY U 37C -7.785 10.013 17.956 1.00 45.63 C ATOM 253 O GLY U 37C -8.448 10.475 17.050 1.00 45.75 O ATOM 254 H GLY U 37C -5.140 8.665 18.966 1.00 0.00 H ATOM 255 N SER U 37D -7.800 10.510 19.171 1.00 43.14 N ATOM 256 CA SER U 37D -8.524 11.730 19.442 1.00 41.63 C ATOM 257 C SER U 37D -7.762 12.892 18.784 1.00 38.75 C ATOM 258 O SER U 37D -6.580 12.822 18.674 1.00 39.74 O ATOM 259 CB SER U 37D -8.656 11.913 20.924 1.00 41.64 C ATOM 260 OG SER U 37D -7.427 12.157 21.488 1.00 43.49 O ATOM 261 HG SER U 37D -7.531 12.275 22.465 1.00 0.00 H ATOM 262 H SER U 37D -7.291 10.026 19.938 1.00 0.00 H ATOM 263 N VAL U 38 -8.472 13.923 18.350 1.00 35.16 N ATOM 264 CA VAL U 38 -7.893 15.103 17.749 1.00 32.83 C ATOM 265 C VAL U 38 -8.229 16.344 18.575 1.00 30.29 C ATOM 266 O VAL U 38 -9.348 16.555 18.909 1.00 31.07 O ATOM 267 CB VAL U 38 -8.452 15.276 16.350 1.00 33.01 C ATOM 268 CG1 VAL U 38 -8.003 16.554 15.730 1.00 32.38 C ATOM 269 CG2 VAL U 38 -8.066 14.111 15.476 1.00 33.84 C ATOM 270 H VAL U 38 -9.507 13.881 18.448 1.00 0.00 H ATOM 271 N THR U 39 -7.222 17.124 18.914 1.00 27.12 N ATOM 272 CA THR U 39 -7.397 18.319 19.744 1.00 25.61 C ATOM 273 C THR U 39 -6.816 19.527 19.038 1.00 22.81 C ATOM 274 O THR U 39 -5.886 19.396 18.238 1.00 21.63 O ATOM 275 CB THR U 39 -6.701 18.176 21.111 1.00 26.33 C ATOM 276 OG1 THR U 39 -5.300 17.967 20.919 1.00 27.46 O ATOM 277 CG2 THR U 39 -7.281 17.006 21.894 1.00 27.13 C ATOM 278 HG1 THR U 39 -4.916 18.740 20.434 1.00 0.00 H ATOM 279 H THR U 39 -6.267 16.882 18.580 1.00 0.00 H ATOM 280 N TYR U 40 -7.354 20.702 19.352 1.00 20.74 N ATOM 281 CA TYR U 40 -6.866 21.949 18.760 1.00 19.39 C ATOM 282 C TYR U 40 -5.507 22.330 19.331 1.00 19.64 C ATOM 283 O TYR U 40 -5.267 22.178 20.532 1.00 19.64 O ATOM 284 CB TYR U 40 -7.849 23.086 19.017 1.00 18.65 C ATOM 285 CG TYR U 40 -7.559 24.336 18.222 1.00 17.60 C ATOM 286 CD1 TYR U 40 -7.710 24.348 16.835 1.00 17.00 C ATOM 287 CD2 TYR U 40 -7.162 25.516 18.848 1.00 16.95 C ATOM 288 CE1 TYR U 40 -7.454 25.492 16.096 1.00 16.63 C ATOM 289 CE2 TYR U 40 -6.906 26.667 18.115 1.00 16.75 C ATOM 290 CZ TYR U 40 -7.063 26.649 16.738 1.00 16.31 C ATOM 291 OH TYR U 40 -6.820 27.772 15.998 1.00 16.09 O ATOM 292 HH TYR U 40 -7.424 28.498 16.295 1.00 0.00 H ATOM 293 H TYR U 40 -8.139 20.736 20.033 1.00 0.00 H ATOM 294 N VAL U 41 -4.635 22.834 18.461 1.00 18.87 N ATOM 295 CA VAL U 41 -3.285 23.249 18.837 1.00 19.07 C ATOM 296 C VAL U 41 -3.186 24.768 18.806 1.00 18.48 C ATOM 297 O VAL U 41 -3.025 25.413 19.846 1.00 18.44 O ATOM 298 CB VAL U 41 -2.222 22.616 17.904 1.00 19.81 C ATOM 299 CG1 VAL U 41 -0.816 23.114 18.244 1.00 20.18 C ATOM 300 CG2 VAL U 41 -2.284 21.098 17.982 1.00 20.60 C ATOM 301 H VAL U 41 -4.928 22.937 17.468 1.00 0.00 H ATOM 302 N CYS U 42 -3.293 25.334 17.607 1.00 17.56 N ATOM 303 CA CYS U 42 -2.952 26.731 17.374 1.00 17.38 C ATOM 304 C CYS U 42 -3.575 27.229 16.081 1.00 16.17 C ATOM 305 O CYS U 42 -4.023 26.438 15.257 1.00 15.96 O ATOM 306 CB CYS U 42 -1.436 26.888 17.267 1.00 18.16 C ATOM 307 SG CYS U 42 -0.547 26.994 18.833 1.00 19.86 S ATOM 308 H CYS U 42 -3.632 24.760 16.809 1.00 0.00 H ATOM 309 N GLY U 43 -3.583 28.549 15.933 1.00 15.53 N ATOM 310 CA GLY U 43 -3.928 29.204 14.678 1.00 15.33 C ATOM 311 C GLY U 43 -2.746 29.282 13.722 1.00 15.30 C ATOM 312 O GLY U 43 -1.607 28.966 14.073 1.00 15.55 O ATOM 313 H GLY U 43 -3.332 29.142 16.750 1.00 0.00 H ATOM 314 N GLY U 44 -3.032 29.709 12.504 1.00 15.43 N ATOM 315 CA GLY U 44 -2.015 29.976 11.490 1.00 15.38 C ATOM 316 C GLY U 44 -2.618 30.859 10.409 1.00 16.03 C ATOM 317 O GLY U 44 -3.810 31.140 10.451 1.00 16.08 O ATOM 318 H GLY U 44 -4.030 29.862 12.256 1.00 0.00 H ATOM 319 N SER U 45 -1.805 31.266 9.435 1.00 16.54 N ATOM 320 CA SER U 45 -2.267 32.095 8.318 1.00 17.16 C ATOM 321 C SER U 45 -1.777 31.558 6.977 1.00 18.42 C ATOM 322 O SER U 45 -0.598 31.225 6.827 1.00 18.59 O ATOM 323 CB SER U 45 -1.786 33.533 8.493 1.00 16.98 C ATOM 324 OG SER U 45 -2.183 34.060 9.747 1.00 17.22 O ATOM 325 HG SER U 45 -1.797 33.508 10.473 1.00 0.00 H ATOM 326 H SER U 45 -0.804 30.985 9.469 1.00 0.00 H ATOM 327 N LEU U 46 -2.677 31.491 6.001 1.00 18.72 N ATOM 328 CA LEU U 46 -2.339 31.020 4.660 1.00 19.92 C ATOM 329 C LEU U 46 -1.660 32.153 3.891 1.00 20.32 C ATOM 330 O LEU U 46 -2.294 33.164 3.579 1.00 20.37 O ATOM 331 CB LEU U 46 -3.596 30.554 3.923 1.00 20.37 C ATOM 332 CG LEU U 46 -3.378 29.825 2.595 1.00 20.52 C ATOM 333 CD1 LEU U 46 -2.858 28.416 2.833 1.00 20.55 C ATOM 334 CD2 LEU U 46 -4.668 29.779 1.795 1.00 20.79 C ATOM 335 H LEU U 46 -3.655 31.784 6.199 1.00 0.00 H ATOM 336 N ILE U 47 -0.373 31.978 3.593 1.00 20.36 N ATOM 337 CA ILE U 47 0.415 32.983 2.872 1.00 21.66 C ATOM 338 C ILE U 47 0.597 32.638 1.384 1.00 22.30 C ATOM 339 O ILE U 47 0.937 33.504 0.595 1.00 23.12 O ATOM 340 CB ILE U 47 1.778 33.278 3.556 1.00 22.08 C ATOM 341 CG1 ILE U 47 2.627 32.009 3.734 1.00 22.30 C ATOM 342 CG2 ILE U 47 1.548 33.956 4.904 1.00 21.85 C ATOM 343 CD1 ILE U 47 4.063 32.290 4.128 1.00 22.66 C ATOM 344 H ILE U 47 0.091 31.094 3.883 1.00 0.00 H ATOM 345 N SER U 48 0.377 31.378 1.021 1.00 23.47 N ATOM 346 CA SER U 48 0.261 30.959 -0.374 1.00 24.19 C ATOM 347 C SER U 48 -0.552 29.665 -0.389 1.00 24.68 C ATOM 348 O SER U 48 -0.806 29.095 0.675 1.00 23.43 O ATOM 349 CB SER U 48 1.653 30.768 -0.991 1.00 25.03 C ATOM 350 OG SER U 48 2.274 29.616 -0.470 1.00 25.52 O ATOM 351 HG SER U 48 1.720 28.822 -0.676 1.00 0.00 H ATOM 352 H SER U 48 0.283 30.657 1.765 1.00 0.00 H ATOM 353 N PRO U 49 -0.969 29.188 -1.578 1.00 25.22 N ATOM 354 CA PRO U 49 -1.791 27.977 -1.616 1.00 25.59 C ATOM 355 C PRO U 49 -1.247 26.781 -0.827 1.00 25.52 C ATOM 356 O PRO U 49 -2.029 26.060 -0.213 1.00 26.17 O ATOM 357 CB PRO U 49 -1.856 27.660 -3.110 1.00 25.98 C ATOM 358 CG PRO U 49 -1.833 29.008 -3.742 1.00 25.96 C ATOM 359 CD PRO U 49 -0.877 29.814 -2.912 1.00 25.88 C ATOM 360 N CYS U 50 0.070 26.582 -0.831 1.00 26.14 N ATOM 361 CA CYS U 50 0.678 25.419 -0.177 1.00 26.61 C ATOM 362 C CYS U 50 1.301 25.704 1.191 1.00 24.68 C ATOM 363 O CYS U 50 1.772 24.771 1.831 1.00 23.84 O ATOM 364 CB CYS U 50 1.746 24.815 -1.087 1.00 28.89 C ATOM 365 SG CYS U 50 1.130 24.440 -2.745 1.00 31.11 S ATOM 366 H CYS U 50 0.684 27.270 -1.311 1.00 0.00 H ATOM 367 N TRP U 51 1.282 26.955 1.651 1.00 23.73 N ATOM 368 CA TRP U 51 2.027 27.345 2.857 1.00 23.16 C ATOM 369 C TRP U 51 1.202 28.077 3.914 1.00 22.28 C ATOM 370 O TRP U 51 0.589 29.108 3.632 1.00 21.73 O ATOM 371 CB TRP U 51 3.218 28.208 2.462 1.00 23.87 C ATOM 372 CG TRP U 51 4.280 27.422 1.757 1.00 24.54 C ATOM 373 CD1 TRP U 51 4.487 27.332 0.408 1.00 25.41 C ATOM 374 CD2 TRP U 51 5.269 26.596 2.371 1.00 24.45 C ATOM 375 NE1 TRP U 51 5.558 26.503 0.146 1.00 25.57 N ATOM 376 CE2 TRP U 51 6.060 26.044 1.335 1.00 25.31 C ATOM 377 CE3 TRP U 51 5.572 26.274 3.700 1.00 24.78 C ATOM 378 CZ2 TRP U 51 7.134 25.183 1.590 1.00 24.59 C ATOM 379 CZ3 TRP U 51 6.648 25.421 3.956 1.00 24.59 C ATOM 380 CH2 TRP U 51 7.416 24.888 2.902 1.00 24.85 C ATOM 381 HE1 TRP U 51 5.924 26.266 -0.798 1.00 0.00 H ATOM 382 H TRP U 51 0.726 27.673 1.144 1.00 0.00 H ATOM 383 N VAL U 52 1.237 27.543 5.136 1.00 20.94 N ATOM 384 CA VAL U 52 0.654 28.187 6.311 1.00 20.01 C ATOM 385 C VAL U 52 1.771 28.616 7.258 1.00 19.67 C ATOM 386 O VAL U 52 2.712 27.860 7.492 1.00 19.92 O ATOM 387 CB VAL U 52 -0.334 27.247 7.028 1.00 19.63 C ATOM 388 CG1 VAL U 52 -0.793 27.832 8.364 1.00 19.64 C ATOM 389 CG2 VAL U 52 -1.533 26.966 6.122 1.00 19.83 C ATOM 390 H VAL U 52 1.703 26.621 5.259 1.00 0.00 H ATOM 391 N ILE U 53 1.655 29.822 7.810 1.00 18.40 N ATOM 392 CA ILE U 53 2.639 30.349 8.751 1.00 17.87 C ATOM 393 C ILE U 53 2.044 30.398 10.164 1.00 17.47 C ATOM 394 O ILE U 53 0.871 30.732 10.341 1.00 16.90 O ATOM 395 CB ILE U 53 3.204 31.719 8.291 1.00 18.28 C ATOM 396 CG1 ILE U 53 4.553 32.010 8.977 1.00 18.06 C ATOM 397 CG2 ILE U 53 2.208 32.853 8.506 1.00 18.19 C ATOM 398 CD1 ILE U 53 5.309 33.169 8.355 1.00 18.38 C ATOM 399 H ILE U 53 0.834 30.410 7.562 1.00 0.00 H ATOM 400 N SER U 54 2.851 30.036 11.159 1.00 16.81 N ATOM 401 CA SER U 54 2.373 29.902 12.536 1.00 16.47 C ATOM 402 C SER U 54 3.528 30.186 13.509 1.00 16.24 C ATOM 403 O SER U 54 4.485 30.869 13.131 1.00 16.30 O ATOM 404 CB SER U 54 1.752 28.505 12.733 1.00 16.43 C ATOM 405 OG SER U 54 1.058 28.407 13.964 1.00 16.00 O ATOM 406 HG SER U 54 0.330 29.077 13.985 1.00 0.00 H ATOM 407 H SER U 54 3.852 29.843 10.952 1.00 0.00 H ATOM 408 N ALA U 55 3.426 29.701 14.747 1.00 16.16 N ATOM 409 CA ALA U 55 4.447 29.906 15.779 1.00 16.28 C ATOM 410 C ALA U 55 5.130 28.574 16.121 1.00 16.69 C ATOM 411 O ALA U 55 4.460 27.567 16.318 1.00 16.81 O ATOM 412 CB ALA U 55 3.805 30.487 17.026 1.00 16.37 C ATOM 413 H ALA U 55 2.579 29.149 14.993 1.00 0.00 H ATOM 414 N THR U 56 6.458 28.582 16.213 1.00 16.57 N ATOM 415 CA THR U 56 7.222 27.376 16.593 1.00 16.92 C ATOM 416 C THR U 56 6.787 26.779 17.938 1.00 16.80 C ATOM 417 O THR U 56 6.719 25.563 18.055 1.00 17.25 O ATOM 418 CB THR U 56 8.754 27.639 16.558 1.00 16.79 C ATOM 419 OG1 THR U 56 9.200 27.583 15.202 1.00 16.57 O ATOM 420 CG2 THR U 56 9.570 26.602 17.363 1.00 16.78 C ATOM 421 HG1 THR U 56 8.728 28.273 14.672 1.00 0.00 H ATOM 422 H THR U 56 6.973 29.463 16.011 1.00 0.00 H ATOM 423 N HIS U 57 6.471 27.608 18.933 1.00 17.30 N ATOM 424 CA HIS U 57 6.135 27.079 20.274 1.00 17.85 C ATOM 425 C HIS U 57 4.928 26.130 20.264 1.00 18.18 C ATOM 426 O HIS U 57 4.809 25.264 21.131 1.00 18.70 O ATOM 427 CB HIS U 57 5.986 28.196 21.329 1.00 17.89 C ATOM 428 CG HIS U 57 4.604 28.766 21.465 1.00 17.81 C ATOM 429 ND1 HIS U 57 4.279 30.021 21.008 1.00 17.89 N ATOM 430 CD2 HIS U 57 3.487 28.283 22.062 1.00 17.69 C ATOM 431 CE1 HIS U 57 3.016 30.279 21.291 1.00 18.02 C ATOM 432 NE2 HIS U 57 2.509 29.239 21.927 1.00 17.90 N ATOM 433 H HIS U 57 6.460 28.634 18.766 1.00 0.00 H ATOM 434 N CYS U 58 4.055 26.280 19.266 1.00 18.58 N ATOM 435 CA CYS U 58 2.915 25.386 19.079 1.00 19.30 C ATOM 436 C CYS U 58 3.294 23.928 18.820 1.00 20.27 C ATOM 437 O CYS U 58 2.526 23.027 19.153 1.00 21.32 O ATOM 438 CB CYS U 58 2.058 25.880 17.911 1.00 19.28 C ATOM 439 SG CYS U 58 1.315 27.495 18.213 1.00 19.50 S ATOM 440 H CYS U 58 4.191 27.063 18.596 1.00 0.00 H ATOM 441 N PHE U 59 4.464 23.711 18.218 1.00 21.44 N ATOM 442 CA PHE U 59 4.868 22.399 17.708 1.00 22.21 C ATOM 443 C PHE U 59 6.105 21.790 18.372 1.00 23.46 C ATOM 444 O PHE U 59 6.395 20.616 18.150 1.00 22.48 O ATOM 445 CB PHE U 59 5.143 22.531 16.213 1.00 22.42 C ATOM 446 CG PHE U 59 4.046 23.226 15.465 1.00 22.48 C ATOM 447 CD1 PHE U 59 2.888 22.543 15.135 1.00 22.67 C ATOM 448 CD2 PHE U 59 4.156 24.570 15.115 1.00 22.48 C ATOM 449 CE1 PHE U 59 1.857 23.173 14.457 1.00 23.15 C ATOM 450 CE2 PHE U 59 3.128 25.205 14.439 1.00 22.44 C ATOM 451 CZ PHE U 59 1.980 24.505 14.107 1.00 22.93 C ATOM 452 H PHE U 59 5.120 24.510 18.106 1.00 0.00 H ATOM 453 N ILE U 60 6.823 22.569 19.175 1.00 25.00 N ATOM 454 CA ILE U 60 8.169 22.183 19.635 1.00 27.53 C ATOM 455 C ILE U 60 8.164 20.911 20.502 1.00 29.34 C ATOM 456 O ILE U 60 9.095 20.099 20.411 1.00 29.78 O ATOM 457 CB ILE U 60 8.886 23.370 20.341 1.00 28.25 C ATOM 458 CG1 ILE U 60 10.401 23.127 20.463 1.00 28.90 C ATOM 459 CG2 ILE U 60 8.268 23.669 21.703 1.00 28.26 C ATOM 460 CD1 ILE U 60 11.159 23.245 19.157 1.00 29.46 C ATOM 461 H ILE U 60 6.423 23.477 19.488 1.00 0.00 H ATOM 462 N ASP U 60A 7.110 20.719 21.296 1.00 30.69 N ATOM 463 CA ASP U 60A 6.971 19.518 22.138 1.00 32.77 C ATOM 464 C ASP U 60A 6.606 18.247 21.363 1.00 33.34 C ATOM 465 O ASP U 60A 6.877 17.139 21.837 1.00 32.87 O ATOM 466 CB ASP U 60A 5.934 19.754 23.244 1.00 34.29 C ATOM 467 CG ASP U 60A 6.359 20.825 24.241 1.00 35.27 C ATOM 468 OD1 ASP U 60A 7.501 21.333 24.172 1.00 37.63 O ATOM 469 OD2 ASP U 60A 5.535 21.161 25.111 1.00 38.35 O ATOM 470 H ASP U 60A 6.362 21.441 21.322 1.00 0.00 H ATOM 471 N TYR U 60B 5.974 18.400 20.198 1.00 32.56 N ATOM 472 CA TYR U 60B 5.640 17.274 19.321 1.00 33.02 C ATOM 473 C TYR U 60B 6.013 17.630 17.882 1.00 31.82 C ATOM 474 O TYR U 60B 5.131 17.881 17.057 1.00 30.22 O ATOM 475 CB TYR U 60B 4.147 16.954 19.414 1.00 34.97 C ATOM 476 CG TYR U 60B 3.696 16.474 20.770 1.00 36.91 C ATOM 477 CD1 TYR U 60B 3.267 17.376 21.742 1.00 37.93 C ATOM 478 CD2 TYR U 60B 3.688 15.114 21.083 1.00 38.59 C ATOM 479 CE1 TYR U 60B 2.847 16.937 22.991 1.00 39.25 C ATOM 480 CE2 TYR U 60B 3.269 14.667 22.326 1.00 39.25 C ATOM 481 CZ TYR U 60B 2.851 15.581 23.276 1.00 39.98 C ATOM 482 OH TYR U 60B 2.434 15.144 24.512 1.00 42.73 O ATOM 483 HH TYR U 60B 2.172 15.922 25.065 1.00 0.00 H ATOM 484 H TYR U 60B 5.707 19.360 19.899 1.00 0.00 H ATOM 485 N PRO U 60C 7.323 17.641 17.558 1.00 31.17 N ATOM 486 CA PRO U 60C 7.768 18.180 16.260 1.00 31.83 C ATOM 487 C PRO U 60C 7.579 17.277 15.021 1.00 32.31 C ATOM 488 O PRO U 60C 8.167 17.551 13.972 1.00 36.15 O ATOM 489 CB PRO U 60C 9.259 18.487 16.496 1.00 32.04 C ATOM 490 CG PRO U 60C 9.640 17.822 17.779 1.00 31.91 C ATOM 491 CD PRO U 60C 8.452 17.110 18.344 1.00 31.64 C ATOM 492 N LYS U 61 6.750 16.242 15.123 1.00 32.04 N ATOM 493 CA LYS U 61 6.540 15.298 14.036 1.00 32.32 C ATOM 494 C LYS U 61 5.355 15.762 13.180 1.00 30.41 C ATOM 495 O LYS U 61 4.228 15.851 13.671 1.00 29.64 O ATOM 496 CB LYS U 61 6.297 13.909 14.626 1.00 34.07 C ATOM 497 CG LYS U 61 6.218 12.779 13.616 1.00 37.12 C ATOM 498 CD LYS U 61 6.245 11.426 14.315 1.00 38.32 C ATOM 499 CE LYS U 61 5.629 10.323 13.468 1.00 40.21 C ATOM 500 NZ LYS U 61 5.154 9.195 14.314 1.00 40.81 N ATOM 501 HZ1 LYS U 61 5.957 8.798 14.843 1.00 0.00 H ATOM 502 HZ2 LYS U 61 4.435 9.542 14.981 1.00 0.00 H ATOM 503 HZ3 LYS U 61 4.739 8.459 13.707 1.00 0.00 H ATOM 504 H LYS U 61 6.232 16.102 16.014 1.00 0.00 H ATOM 505 N LYS U 62 5.629 16.065 11.912 1.00 29.32 N ATOM 506 CA LYS U 62 4.615 16.564 10.960 1.00 29.45 C ATOM 507 C LYS U 62 3.392 15.664 10.781 1.00 28.86 C ATOM 508 O LYS U 62 2.297 16.167 10.548 1.00 27.95 O ATOM 509 CB LYS U 62 5.249 16.827 9.590 1.00 30.54 C ATOM 510 CG LYS U 62 5.797 15.571 8.911 1.00 32.09 C ATOM 511 CD LYS U 62 7.082 15.833 8.135 1.00 34.25 C ATOM 512 CE LYS U 62 6.871 15.822 6.640 1.00 35.21 C ATOM 513 NZ LYS U 62 6.914 14.454 6.063 1.00 37.06 N ATOM 514 HZ1 LYS U 62 7.842 14.026 6.257 1.00 0.00 H ATOM 515 HZ2 LYS U 62 6.167 13.874 6.494 1.00 0.00 H ATOM 516 HZ3 LYS U 62 6.763 14.508 5.035 1.00 0.00 H ATOM 517 H LYS U 62 6.606 15.944 11.575 1.00 0.00 H ATOM 518 N GLU U 62A 3.564 14.347 10.920 1.00 28.88 N ATOM 519 CA GLU U 62A 2.456 13.393 10.737 1.00 29.84 C ATOM 520 C GLU U 62A 1.391 13.481 11.846 1.00 29.44 C ATOM 521 O GLU U 62A 0.279 12.970 11.682 1.00 29.58 O ATOM 522 CB GLU U 62A 2.971 11.945 10.641 1.00 30.50 C ATOM 523 CG GLU U 62A 3.799 11.628 9.396 1.00 31.57 C ATOM 524 CD GLU U 62A 5.258 12.066 9.477 1.00 31.87 C ATOM 525 OE1 GLU U 62A 5.726 12.468 10.563 1.00 31.23 O ATOM 526 OE2 GLU U 62A 5.950 12.006 8.438 1.00 34.49 O ATOM 527 H GLU U 62A 4.507 13.984 11.165 1.00 0.00 H ATOM 528 N ASP U 63 1.729 14.123 12.963 1.00 28.76 N ATOM 529 CA ASP U 63 0.795 14.302 14.068 1.00 28.94 C ATOM 530 C ASP U 63 -0.247 15.398 13.825 1.00 27.75 C ATOM 531 O ASP U 63 -1.199 15.477 14.590 1.00 28.09 O ATOM 532 CB ASP U 63 1.538 14.640 15.370 1.00 30.91 C ATOM 533 CG ASP U 63 2.526 13.560 15.798 1.00 32.63 C ATOM 534 OD1 ASP U 63 2.496 12.437 15.253 1.00 34.32 O ATOM 535 OD2 ASP U 63 3.336 13.853 16.702 1.00 35.99 O ATOM 536 H ASP U 63 2.691 14.509 13.050 1.00 0.00 H ATOM 537 N TYR U 64 -0.083 16.230 12.792 1.00 25.48 N ATOM 538 CA TYR U 64 -0.918 17.434 12.636 1.00 24.01 C ATOM 539 C TYR U 64 -1.898 17.404 11.475 1.00 23.95 C ATOM 540 O TYR U 64 -1.653 16.772 10.451 1.00 24.17 O ATOM 541 CB TYR U 64 -0.028 18.665 12.519 1.00 23.60 C ATOM 542 CG TYR U 64 0.766 18.871 13.767 1.00 22.66 C ATOM 543 CD1 TYR U 64 0.205 19.506 14.867 1.00 22.37 C ATOM 544 CD2 TYR U 64 2.065 18.379 13.876 1.00 22.59 C ATOM 545 CE1 TYR U 64 0.923 19.679 16.038 1.00 22.41 C ATOM 546 CE2 TYR U 64 2.790 18.538 15.040 1.00 22.62 C ATOM 547 CZ TYR U 64 2.221 19.185 16.120 1.00 22.24 C ATOM 548 OH TYR U 64 2.924 19.358 17.282 1.00 22.34 O ATOM 549 HH TYR U 64 3.178 18.474 17.647 1.00 0.00 H ATOM 550 H TYR U 64 0.649 16.023 12.083 1.00 0.00 H ATOM 551 N ILE U 65 -3.010 18.113 11.669 1.00 22.72 N ATOM 552 CA ILE U 65 -4.052 18.295 10.668 1.00 23.22 C ATOM 553 C ILE U 65 -4.311 19.798 10.573 1.00 22.41 C ATOM 554 O ILE U 65 -4.388 20.476 11.601 1.00 23.06 O ATOM 555 CB ILE U 65 -5.370 17.593 11.081 1.00 24.24 C ATOM 556 CG1 ILE U 65 -5.148 16.099 11.368 1.00 25.90 C ATOM 557 CG2 ILE U 65 -6.436 17.773 10.001 1.00 24.53 C ATOM 558 CD1 ILE U 65 -6.188 15.493 12.286 1.00 27.00 C ATOM 559 H ILE U 65 -3.142 18.566 12.596 1.00 0.00 H ATOM 560 N VAL U 66 -4.451 20.308 9.351 1.00 21.12 N ATOM 561 CA VAL U 66 -4.727 21.727 9.121 1.00 20.63 C ATOM 562 C VAL U 66 -6.046 21.867 8.369 1.00 20.69 C ATOM 563 O VAL U 66 -6.229 21.252 7.316 1.00 20.68 O ATOM 564 CB VAL U 66 -3.597 22.408 8.313 1.00 20.30 C ATOM 565 CG1 VAL U 66 -3.912 23.877 8.059 1.00 20.25 C ATOM 566 CG2 VAL U 66 -2.266 22.273 9.048 1.00 20.44 C ATOM 567 H VAL U 66 -4.361 19.675 8.530 1.00 0.00 H ATOM 568 N TYR U 67 -6.953 22.677 8.914 1.00 20.30 N ATOM 569 CA TYR U 67 -8.169 23.074 8.205 1.00 20.96 C ATOM 570 C TYR U 67 -8.086 24.521 7.723 1.00 20.35 C ATOM 571 O TYR U 67 -7.560 25.401 8.418 1.00 18.90 O ATOM 572 CB TYR U 67 -9.401 22.903 9.092 1.00 21.81 C ATOM 573 CG TYR U 67 -9.782 21.469 9.357 1.00 23.31 C ATOM 574 CD1 TYR U 67 -9.207 20.765 10.416 1.00 24.54 C ATOM 575 CD2 TYR U 67 -10.721 20.808 8.556 1.00 24.59 C ATOM 576 CE1 TYR U 67 -9.557 19.449 10.678 1.00 25.64 C ATOM 577 CE2 TYR U 67 -11.076 19.489 8.812 1.00 25.42 C ATOM 578 CZ TYR U 67 -10.492 18.817 9.873 1.00 26.15 C ATOM 579 OH TYR U 67 -10.832 17.509 10.136 1.00 29.44 O ATOM 580 HH TYR U 67 -11.802 17.453 10.324 1.00 0.00 H ATOM 581 H TYR U 67 -6.791 23.039 9.875 1.00 0.00 H ATOM 582 N LEU U 68 -8.598 24.748 6.515 1.00 19.83 N ATOM 583 CA LEU U 68 -8.886 26.086 6.004 1.00 20.45 C ATOM 584 C LEU U 68 -10.397 26.189 5.786 1.00 20.10 C ATOM 585 O LEU U 68 -11.081 25.175 5.633 1.00 21.24 O ATOM 586 CB LEU U 68 -8.157 26.338 4.688 1.00 20.74 C ATOM 587 CG LEU U 68 -6.625 26.206 4.707 1.00 21.32 C ATOM 588 CD1 LEU U 68 -6.059 26.338 3.298 1.00 21.39 C ATOM 589 CD2 LEU U 68 -6.000 27.236 5.633 1.00 21.19 C ATOM 590 H LEU U 68 -8.803 23.932 5.904 1.00 0.00 H ATOM 591 N GLY U 69 -10.910 27.415 5.785 1.00 20.27 N ATOM 592 CA GLY U 69 -12.345 27.647 5.599 1.00 20.18 C ATOM 593 C GLY U 69 -13.206 27.200 6.769 1.00 20.63 C ATOM 594 O GLY U 69 -14.390 26.914 6.595 1.00 20.07 O ATOM 595 H GLY U 69 -10.278 28.230 5.919 1.00 0.00 H ATOM 596 N ARG U 70 -12.623 27.139 7.965 1.00 21.28 N ATOM 597 CA ARG U 70 -13.320 26.633 9.150 1.00 22.41 C ATOM 598 C ARG U 70 -13.675 27.777 10.112 1.00 22.13 C ATOM 599 O ARG U 70 -12.802 28.555 10.504 1.00 22.57 O ATOM 600 CB ARG U 70 -12.452 25.579 9.839 1.00 24.16 C ATOM 601 CG ARG U 70 -13.209 24.660 10.770 1.00 25.67 C ATOM 602 CD ARG U 70 -12.390 23.422 11.092 1.00 26.36 C ATOM 603 NE ARG U 70 -12.951 22.654 12.207 1.00 28.01 N ATOM 604 CZ ARG U 70 -13.459 21.419 12.151 1.00 28.97 C ATOM 605 NH1 ARG U 70 -13.545 20.731 11.011 1.00 29.77 N ATOM 606 NH2 ARG U 70 -13.910 20.860 13.271 1.00 30.47 N ATOM 607 HE ARG U 70 -12.954 23.118 13.138 1.00 0.00 H ATOM 608 HH12 ARG U 70 -13.947 19.772 11.012 1.00 0.00 H ATOM 609 HH11 ARG U 70 -13.210 21.154 10.122 1.00 0.00 H ATOM 610 HH22 ARG U 70 -14.309 19.900 13.249 1.00 0.00 H ATOM 611 HH21 ARG U 70 -13.863 21.383 14.169 1.00 0.00 H ATOM 612 H ARG U 70 -11.639 27.462 8.061 1.00 0.00 H ATOM 613 N SER U 71 -14.958 27.878 10.464 1.00 21.54 N ATOM 614 CA SER U 71 -15.476 28.901 11.386 1.00 20.91 C ATOM 615 C SER U 71 -15.774 28.365 12.784 1.00 20.26 C ATOM 616 O SER U 71 -16.001 29.159 13.699 1.00 18.96 O ATOM 617 CB SER U 71 -16.766 29.517 10.828 1.00 21.24 C ATOM 618 OG SER U 71 -16.546 30.174 9.591 1.00 21.67 O ATOM 619 HG SER U 71 -17.399 30.556 9.266 1.00 0.00 H ATOM 620 H SER U 71 -15.631 27.194 10.063 1.00 0.00 H ATOM 621 N ARG U 72 -15.806 27.039 12.948 1.00 20.74 N ATOM 622 CA ARG U 72 -16.116 26.416 14.232 1.00 22.13 C ATOM 623 C ARG U 72 -15.085 25.365 14.625 1.00 22.37 C ATOM 624 O ARG U 72 -14.489 24.705 13.773 1.00 21.22 O ATOM 625 CB ARG U 72 -17.535 25.829 14.225 1.00 23.53 C ATOM 626 CG ARG U 72 -18.601 26.916 14.285 1.00 24.29 C ATOM 627 CD ARG U 72 -20.015 26.366 14.271 1.00 25.91 C ATOM 628 NE ARG U 72 -20.373 25.642 15.491 1.00 26.93 N ATOM 629 CZ ARG U 72 -20.688 26.190 16.673 1.00 27.81 C ATOM 630 NH1 ARG U 72 -20.671 27.513 16.875 1.00 26.55 N ATOM 631 NH2 ARG U 72 -21.025 25.391 17.682 1.00 28.20 N ATOM 632 HE ARG U 72 -20.384 24.604 15.436 1.00 0.00 H ATOM 633 HH12 ARG U 72 -20.922 27.900 17.807 1.00 0.00 H ATOM 634 HH11 ARG U 72 -20.407 28.154 16.100 1.00 0.00 H ATOM 635 HH22 ARG U 72 -21.273 25.797 18.607 1.00 0.00 H ATOM 636 HH21 ARG U 72 -21.041 24.360 17.546 1.00 0.00 H ATOM 637 H ARG U 72 -15.603 26.428 12.131 1.00 0.00 H ATOM 638 N LEU U 73 -14.914 25.202 15.934 1.00 22.86 N ATOM 639 CA LEU U 73 -13.773 24.468 16.494 1.00 24.81 C ATOM 640 C LEU U 73 -13.921 22.955 16.332 1.00 25.54 C ATOM 641 O LEU U 73 -13.011 22.276 15.869 1.00 24.85 O ATOM 642 CB LEU U 73 -13.606 24.808 17.989 1.00 25.53 C ATOM 643 CG LEU U 73 -12.216 25.030 18.601 1.00 27.00 C ATOM 644 CD1 LEU U 73 -12.194 24.542 20.045 1.00 26.94 C ATOM 645 CD2 LEU U 73 -11.074 24.417 17.811 1.00 27.79 C ATOM 646 H LEU U 73 -15.615 25.610 16.585 1.00 0.00 H ATOM 647 N ASN U 74 -15.085 22.436 16.709 1.00 27.57 N ATOM 648 CA ASN U 74 -15.317 20.996 16.785 1.00 30.47 C ATOM 649 C ASN U 74 -16.479 20.531 15.911 1.00 31.37 C ATOM 650 O ASN U 74 -16.995 19.431 16.108 1.00 33.18 O ATOM 651 CB ASN U 74 -15.519 20.583 18.250 1.00 32.14 C ATOM 652 CG ASN U 74 -14.311 20.904 19.116 1.00 33.47 C ATOM 653 OD1 ASN U 74 -13.203 20.451 18.840 1.00 36.89 O ATOM 654 ND2 ASN U 74 -14.519 21.685 20.169 1.00 35.12 N ATOM 655 HD22 ASN U 74 -15.473 22.048 20.367 1.00 0.00 H ATOM 656 HD21 ASN U 74 -13.728 21.934 20.796 1.00 0.00 H ATOM 657 H ASN U 74 -15.861 23.081 16.960 1.00 0.00 H ATOM 658 N SER U 75 -16.879 21.361 14.944 1.00 31.71 N ATOM 659 CA SER U 75 -17.844 20.970 13.917 1.00 33.12 C ATOM 660 C SER U 75 -17.354 21.450 12.559 1.00 32.60 C ATOM 661 O SER U 75 -16.579 22.409 12.470 1.00 33.55 O ATOM 662 CB SER U 75 -19.240 21.526 14.223 1.00 33.82 C ATOM 663 OG SER U 75 -19.303 22.926 14.027 1.00 36.13 O ATOM 664 HG SER U 75 -20.217 23.246 14.234 1.00 0.00 H ATOM 665 H SER U 75 -16.488 22.325 14.920 1.00 0.00 H ATOM 666 N ASN U 76 -17.801 20.775 11.506 1.00 32.87 N ATOM 667 CA ASN U 76 -17.360 21.091 10.151 1.00 33.03 C ATOM 668 C ASN U 76 -18.110 22.324 9.654 1.00 31.21 C ATOM 669 O ASN U 76 -19.288 22.510 9.975 1.00 32.37 O ATOM 670 CB ASN U 76 -17.570 19.901 9.205 1.00 35.19 C ATOM 671 CG ASN U 76 -16.885 18.631 9.693 1.00 37.02 C ATOM 672 OD1 ASN U 76 -15.671 18.605 9.909 1.00 37.95 O ATOM 673 ND2 ASN U 76 -17.670 17.572 9.881 1.00 39.27 N ATOM 674 HD22 ASN U 76 -18.689 17.639 9.686 1.00 0.00 H ATOM 675 HD21 ASN U 76 -17.264 16.678 10.223 1.00 0.00 H ATOM 676 H ASN U 76 -18.482 20.002 11.651 1.00 0.00 H ATOM 677 N THR U 77 -17.399 23.184 8.928 1.00 27.85 N ATOM 678 CA THR U 77 -17.967 24.342 8.254 1.00 25.76 C ATOM 679 C THR U 77 -18.102 24.001 6.779 1.00 25.59 C ATOM 680 O THR U 77 -17.190 23.420 6.188 1.00 23.84 O ATOM 681 CB THR U 77 -17.039 25.565 8.398 1.00 25.69 C ATOM 682 OG1 THR U 77 -16.951 25.929 9.778 1.00 25.04 O ATOM 683 CG2 THR U 77 -17.549 26.763 7.594 1.00 25.24 C ATOM 684 HG1 THR U 77 -16.356 26.714 9.874 1.00 0.00 H ATOM 685 H THR U 77 -16.376 23.018 8.837 1.00 0.00 H ATOM 686 N GLN U 78 -19.228 24.380 6.181 1.00 24.87 N ATOM 687 CA GLN U 78 -19.457 24.098 4.770 1.00 25.06 C ATOM 688 C GLN U 78 -18.378 24.763 3.922 1.00 24.33 C ATOM 689 O GLN U 78 -18.111 25.953 4.085 1.00 23.62 O ATOM 690 CB GLN U 78 -20.835 24.587 4.335 1.00 25.86 C ATOM 691 CG GLN U 78 -21.227 24.134 2.942 1.00 26.50 C ATOM 692 CD GLN U 78 -22.710 24.296 2.697 1.00 26.37 C ATOM 693 OE1 GLN U 78 -23.241 25.399 2.777 1.00 25.74 O ATOM 694 NE2 GLN U 78 -23.391 23.195 2.421 1.00 27.05 N ATOM 695 HE22 GLN U 78 -22.899 22.280 2.363 1.00 0.00 H ATOM 696 HE21 GLN U 78 -24.418 23.245 2.262 1.00 0.00 H ATOM 697 H GLN U 78 -19.955 24.884 6.728 1.00 0.00 H ATOM 698 N GLY U 79 -17.753 23.980 3.043 1.00 23.77 N ATOM 699 CA GLY U 79 -16.707 24.472 2.150 1.00 24.35 C ATOM 700 C GLY U 79 -15.283 24.366 2.683 1.00 24.29 C ATOM 701 O GLY U 79 -14.338 24.737 1.988 1.00 24.71 O ATOM 702 H GLY U 79 -18.021 22.977 2.991 1.00 0.00 H ATOM 703 N GLU U 80 -15.115 23.865 3.905 1.00 24.25 N ATOM 704 CA GLU U 80 -13.779 23.752 4.503 1.00 24.32 C ATOM 705 C GLU U 80 -12.894 22.763 3.731 1.00 25.28 C ATOM 706 O GLU U 80 -13.398 21.926 2.978 1.00 25.34 O ATOM 707 CB GLU U 80 -13.876 23.334 5.976 1.00 24.35 C ATOM 708 CG GLU U 80 -14.316 21.892 6.209 1.00 25.05 C ATOM 709 CD GLU U 80 -14.435 21.519 7.673 1.00 26.10 C ATOM 710 OE1 GLU U 80 -14.515 22.420 8.536 1.00 27.45 O ATOM 711 OE2 GLU U 80 -14.457 20.306 7.960 1.00 27.83 O ATOM 712 H GLU U 80 -15.945 23.548 4.446 1.00 0.00 H ATOM 713 N MET U 81 -11.580 22.872 3.917 1.00 25.30 N ATOM 714 CA MET U 81 -10.630 21.903 3.354 1.00 26.58 C ATOM 715 C MET U 81 -9.698 21.398 4.449 1.00 26.05 C ATOM 716 O MET U 81 -9.257 22.179 5.285 1.00 24.05 O ATOM 717 CB MET U 81 -9.811 22.528 2.224 1.00 28.71 C ATOM 718 CG MET U 81 -10.608 22.800 0.953 1.00 30.38 C ATOM 719 SD MET U 81 -9.566 23.253 -0.454 1.00 33.17 S ATOM 720 CE MET U 81 -9.082 24.902 0.014 1.00 34.32 C ATOM 721 H MET U 81 -11.215 23.668 4.478 1.00 0.00 H ATOM 722 N LYS U 82 -9.414 20.095 4.419 1.00 25.89 N ATOM 723 CA LYS U 82 -8.564 19.417 5.397 1.00 27.11 C ATOM 724 C LYS U 82 -7.239 19.048 4.738 1.00 26.92 C ATOM 725 O LYS U 82 -7.225 18.545 3.611 1.00 26.09 O ATOM 726 CB LYS U 82 -9.256 18.145 5.893 1.00 28.57 C ATOM 727 CG LYS U 82 -8.531 17.408 7.012 1.00 30.37 C ATOM 728 CD LYS U 82 -9.049 15.985 7.153 1.00 32.39 C ATOM 729 CE LYS U 82 -8.494 15.301 8.392 1.00 33.98 C ATOM 730 NZ LYS U 82 -8.764 13.833 8.382 1.00 35.64 N ATOM 731 HZ1 LYS U 82 -9.791 13.671 8.351 1.00 0.00 H ATOM 732 HZ2 LYS U 82 -8.319 13.406 7.545 1.00 0.00 H ATOM 733 HZ3 LYS U 82 -8.370 13.403 9.243 1.00 0.00 H ATOM 734 H LYS U 82 -9.823 19.525 3.651 1.00 0.00 H ATOM 735 N PHE U 83 -6.137 19.275 5.452 1.00 25.81 N ATOM 736 CA PHE U 83 -4.797 18.996 4.928 1.00 26.40 C ATOM 737 C PHE U 83 -3.933 18.261 5.938 1.00 27.37 C ATOM 738 O PHE U 83 -4.074 18.452 7.144 1.00 25.39 O ATOM 739 CB PHE U 83 -4.092 20.290 4.538 1.00 25.89 C ATOM 740 CG PHE U 83 -4.847 21.108 3.537 1.00 26.02 C ATOM 741 CD1 PHE U 83 -4.665 20.906 2.174 1.00 26.12 C ATOM 742 CD2 PHE U 83 -5.765 22.063 3.957 1.00 25.45 C ATOM 743 CE1 PHE U 83 -5.372 21.657 1.247 1.00 25.93 C ATOM 744 CE2 PHE U 83 -6.476 22.816 3.038 1.00 25.46 C ATOM 745 CZ PHE U 83 -6.279 22.615 1.681 1.00 26.14 C ATOM 746 H PHE U 83 -6.231 19.663 6.412 1.00 0.00 H ATOM 747 N GLU U 84 -3.055 17.403 5.425 1.00 28.80 N ATOM 748 CA GLU U 84 -1.944 16.869 6.212 1.00 30.32 C ATOM 749 C GLU U 84 -0.757 17.813 6.062 1.00 28.80 C ATOM 750 O GLU U 84 -0.745 18.673 5.177 1.00 27.14 O ATOM 751 CB GLU U 84 -1.589 15.447 5.771 1.00 33.39 C ATOM 752 CG GLU U 84 -2.517 14.397 6.371 1.00 36.26 C ATOM 753 CD GLU U 84 -2.554 13.108 5.572 1.00 40.05 C ATOM 754 OE1 GLU U 84 -2.167 12.053 6.123 1.00 42.69 O ATOM 755 OE2 GLU U 84 -2.969 13.143 4.391 1.00 44.10 O ATOM 756 H GLU U 84 -3.162 17.103 4.435 1.00 0.00 H ATOM 757 N VAL U 85 0.230 17.655 6.943 1.00 28.04 N ATOM 758 CA VAL U 85 1.405 18.522 6.963 1.00 28.43 C ATOM 759 C VAL U 85 2.542 17.786 6.270 1.00 29.66 C ATOM 760 O VAL U 85 3.128 16.850 6.811 1.00 29.51 O ATOM 761 CB VAL U 85 1.790 18.943 8.395 1.00 28.22 C ATOM 762 CG1 VAL U 85 3.013 19.856 8.385 1.00 27.82 C ATOM 763 CG2 VAL U 85 0.608 19.636 9.067 1.00 27.73 C ATOM 764 H VAL U 85 0.161 16.887 7.641 1.00 0.00 H ATOM 765 N GLU U 86 2.827 18.226 5.055 1.00 30.18 N ATOM 766 CA GLU U 86 3.865 17.628 4.236 1.00 32.81 C ATOM 767 C GLU U 86 5.262 18.120 4.634 1.00 31.84 C ATOM 768 O GLU U 86 6.266 17.494 4.293 1.00 31.51 O ATOM 769 CB GLU U 86 3.584 17.980 2.790 1.00 34.52 C ATOM 770 CG GLU U 86 4.352 17.164 1.783 1.00 36.94 C ATOM 771 CD GLU U 86 4.695 17.991 0.579 1.00 38.58 C ATOM 772 OE1 GLU U 86 3.763 18.565 -0.024 1.00 39.56 O ATOM 773 OE2 GLU U 86 5.889 18.084 0.228 1.00 42.65 O ATOM 774 H GLU U 86 2.288 19.029 4.673 1.00 0.00 H ATOM 775 N ASN U 87 5.321 19.238 5.354 1.00 31.46 N ATOM 776 CA ASN U 87 6.580 19.846 5.755 1.00 31.41 C ATOM 777 C ASN U 87 6.334 20.694 6.995 1.00 28.76 C ATOM 778 O ASN U 87 5.491 21.577 6.950 1.00 27.77 O ATOM 779 CB ASN U 87 7.059 20.742 4.612 1.00 34.21 C ATOM 780 CG ASN U 87 8.487 20.509 4.242 1.00 36.87 C ATOM 781 OD1 ASN U 87 9.397 21.113 4.810 1.00 40.68 O ATOM 782 ND2 ASN U 87 8.696 19.651 3.251 1.00 38.29 N ATOM 783 HD22 ASN U 87 7.891 19.166 2.804 1.00 0.00 H ATOM 784 HD21 ASN U 87 9.664 19.463 2.921 1.00 0.00 H ATOM 785 H ASN U 87 4.432 19.695 5.641 1.00 0.00 H ATOM 786 N LEU U 88 7.038 20.416 8.093 1.00 25.48 N ATOM 787 CA LEU U 88 6.947 21.231 9.306 1.00 24.27 C ATOM 788 C LEU U 88 8.308 21.869 9.558 1.00 23.43 C ATOM 789 O LEU U 88 9.271 21.172 9.904 1.00 22.81 O ATOM 790 CB LEU U 88 6.507 20.391 10.506 1.00 23.76 C ATOM 791 CG LEU U 88 6.355 21.087 11.866 1.00 23.81 C ATOM 792 CD1 LEU U 88 5.412 22.282 11.808 1.00 23.65 C ATOM 793 CD2 LEU U 88 5.859 20.089 12.900 1.00 23.87 C ATOM 794 H LEU U 88 7.673 19.592 8.088 1.00 0.00 H ATOM 795 N ILE U 89 8.383 23.184 9.367 1.00 22.69 N ATOM 796 CA ILE U 89 9.642 23.922 9.449 1.00 22.52 C ATOM 797 C ILE U 89 9.607 24.861 10.651 1.00 21.68 C ATOM 798 O ILE U 89 8.876 25.846 10.648 1.00 20.50 O ATOM 799 CB ILE U 89 9.906 24.714 8.151 1.00 23.11 C ATOM 800 CG1 ILE U 89 9.999 23.756 6.956 1.00 23.96 C ATOM 801 CG2 ILE U 89 11.187 25.535 8.268 1.00 23.33 C ATOM 802 CD1 ILE U 89 9.923 24.431 5.605 1.00 24.59 C ATOM 803 H ILE U 89 7.511 23.707 9.151 1.00 0.00 H ATOM 804 N LEU U 90 10.405 24.543 11.667 1.00 20.83 N ATOM 805 CA LEU U 90 10.518 25.351 12.875 1.00 20.88 C ATOM 806 C LEU U 90 11.779 26.191 12.772 1.00 21.82 C ATOM 807 O LEU U 90 12.730 25.788 12.090 1.00 22.36 O ATOM 808 CB LEU U 90 10.557 24.450 14.113 1.00 21.13 C ATOM 809 CG LEU U 90 9.475 23.367 14.195 1.00 21.31 C ATOM 810 CD1 LEU U 90 9.594 22.588 15.499 1.00 21.46 C ATOM 811 CD2 LEU U 90 8.079 23.970 14.052 1.00 21.73 C ATOM 812 H LEU U 90 10.976 23.676 11.596 1.00 0.00 H ATOM 813 N HIS U 91 11.797 27.343 13.442 1.00 21.84 N ATOM 814 CA HIS U 91 12.917 28.287 13.313 1.00 22.93 C ATOM 815 C HIS U 91 14.103 27.797 14.143 1.00 23.55 C ATOM 816 O HIS U 91 13.975 27.600 15.350 1.00 23.04 O ATOM 817 CB HIS U 91 12.519 29.702 13.740 1.00 22.88 C ATOM 818 CG HIS U 91 13.438 30.767 13.224 1.00 23.37 C ATOM 819 ND1 HIS U 91 14.679 30.997 13.769 1.00 24.03 N ATOM 820 CD2 HIS U 91 13.306 31.652 12.211 1.00 23.35 C ATOM 821 CE1 HIS U 91 15.275 31.980 13.119 1.00 23.62 C ATOM 822 NE2 HIS U 91 14.463 32.395 12.166 1.00 23.94 N ATOM 823 H HIS U 91 11.002 27.579 14.069 1.00 0.00 H ATOM 824 N LYS U 92 15.239 27.592 13.473 1.00 25.62 N ATOM 825 CA LYS U 92 16.476 27.068 14.097 1.00 27.96 C ATOM 826 C LYS U 92 16.953 27.821 15.354 1.00 27.05 C ATOM 827 O LYS U 92 17.493 27.219 16.284 1.00 27.12 O ATOM 828 CB LYS U 92 17.611 27.033 13.051 1.00 29.89 C ATOM 829 CG LYS U 92 17.978 28.392 12.454 1.00 32.63 C ATOM 830 CD LYS U 92 19.055 28.302 11.382 1.00 35.39 C ATOM 831 CE LYS U 92 18.989 29.479 10.414 1.00 37.68 C ATOM 832 NZ LYS U 92 18.863 30.810 11.079 1.00 39.01 N ATOM 833 HZ1 LYS U 92 17.992 30.831 11.647 1.00 0.00 H ATOM 834 HZ2 LYS U 92 19.685 30.967 11.696 1.00 0.00 H ATOM 835 HZ3 LYS U 92 18.824 31.556 10.355 1.00 0.00 H ATOM 836 H LYS U 92 15.257 27.812 12.457 1.00 0.00 H ATOM 837 N ASP U 93 16.786 29.138 15.347 1.00 26.32 N ATOM 838 CA ASP U 93 17.107 30.013 16.489 1.00 25.96 C ATOM 839 C ASP U 93 15.985 30.251 17.507 1.00 24.65 C ATOM 840 O ASP U 93 16.067 31.179 18.313 1.00 23.00 O ATOM 841 CB ASP U 93 17.628 31.357 15.969 1.00 27.10 C ATOM 842 CG ASP U 93 18.824 31.197 15.060 1.00 28.32 C ATOM 843 OD1 ASP U 93 19.733 30.418 15.421 1.00 29.16 O ATOM 844 OD2 ASP U 93 18.853 31.844 13.996 1.00 30.54 O ATOM 845 H ASP U 93 16.406 29.578 14.485 1.00 0.00 H ATOM 846 N TYR U 94 14.954 29.408 17.492 1.00 24.83 N ATOM 847 CA TYR U 94 13.920 29.453 18.518 1.00 25.02 C ATOM 848 C TYR U 94 14.532 29.295 19.914 1.00 26.32 C ATOM 849 O TYR U 94 15.463 28.509 20.111 1.00 25.00 O ATOM 850 CB TYR U 94 12.876 28.358 18.283 1.00 25.07 C ATOM 851 CG TYR U 94 11.840 28.242 19.381 1.00 25.06 C ATOM 852 CD1 TYR U 94 10.748 29.106 19.426 1.00 24.43 C ATOM 853 CD2 TYR U 94 11.950 27.268 20.375 1.00 25.25 C ATOM 854 CE1 TYR U 94 9.799 29.006 20.428 1.00 25.26 C ATOM 855 CE2 TYR U 94 11.001 27.159 21.380 1.00 25.11 C ATOM 856 CZ TYR U 94 9.928 28.031 21.401 1.00 25.32 C ATOM 857 OH TYR U 94 8.975 27.933 22.391 1.00 26.60 O ATOM 858 HH TYR U 94 8.285 28.629 22.253 1.00 0.00 H ATOM 859 H TYR U 94 14.885 28.702 16.731 1.00 0.00 H ATOM 860 N SER U 95 14.018 30.061 20.869 1.00 28.13 N ATOM 861 CA SER U 95 14.376 29.873 22.268 1.00 31.03 C ATOM 862 C SER U 95 13.203 30.224 23.164 1.00 33.65 C ATOM 863 O SER U 95 12.374 31.063 22.810 1.00 33.00 O ATOM 864 CB SER U 95 15.593 30.722 22.628 1.00 32.03 C ATOM 865 OG SER U 95 15.244 32.082 22.770 1.00 33.85 O ATOM 866 HG SER U 95 14.570 32.175 23.489 1.00 0.00 H ATOM 867 H SER U 95 13.345 30.811 20.612 1.00 0.00 H ATOM 868 N ALA U 96 13.127 29.534 24.261 1.00 36.25 N ATOM 869 CA ALA U 96 12.142 29.889 25.234 1.00 40.32 C ATOM 870 C ALA U 96 12.789 30.203 26.557 1.00 43.29 C ATOM 871 O ALA U 96 13.478 29.387 27.119 1.00 43.03 O ATOM 872 CB ALA U 96 11.190 28.735 25.413 1.00 40.26 C ATOM 873 H ALA U 96 13.772 28.736 24.429 1.00 0.00 H ATOM 874 N ASP U 97 12.519 31.382 27.058 1.00 47.27 N ATOM 875 CA ASP U 97 12.643 31.605 28.449 1.00 50.40 C ATOM 876 C ASP U 97 11.325 31.444 29.068 1.00 51.93 C ATOM 877 O ASP U 97 10.383 31.034 28.433 1.00 53.97 O ATOM 878 CB ASP U 97 13.293 32.947 28.785 1.00 51.55 C ATOM 879 CG ASP U 97 12.418 34.160 28.498 1.00 52.19 C ATOM 880 OD1 ASP U 97 11.229 34.032 28.342 1.00 51.62 O ATOM 881 OD2 ASP U 97 12.969 35.265 28.488 1.00 53.15 O ATOM 882 H ASP U 97 12.213 32.155 26.433 1.00 0.00 H ATOM 883 N THR U 97A 11.233 31.956 30.266 1.00 54.28 N ATOM 884 CA THR U 97A 10.100 31.732 31.094 1.00 55.45 C ATOM 885 C THR U 97A 8.795 32.183 30.429 1.00 55.33 C ATOM 886 O THR U 97A 7.840 31.461 30.468 1.00 57.49 O ATOM 887 CB THR U 97A 10.257 32.483 32.407 1.00 55.81 C ATOM 888 OG1 THR U 97A 11.510 32.140 33.003 1.00 56.58 O ATOM 889 CG2 THR U 97A 9.139 32.136 33.327 1.00 55.97 C ATOM 890 HG1 THR U 97A 11.612 32.629 33.858 1.00 0.00 H ATOM 891 H THR U 97A 12.012 32.545 30.624 1.00 0.00 H ATOM 892 N LEU U 97B 8.782 33.341 29.803 1.00 53.68 N ATOM 893 CA LEU U 97B 7.614 33.853 29.141 1.00 51.62 C ATOM 894 C LEU U 97B 7.867 33.950 27.660 1.00 47.94 C ATOM 895 O LEU U 97B 7.163 33.435 26.859 1.00 47.22 O ATOM 896 CB LEU U 97B 7.414 35.300 29.616 1.00 52.67 C ATOM 897 CG LEU U 97B 6.403 35.804 30.623 1.00 54.04 C ATOM 898 CD1 LEU U 97B 6.995 35.687 32.012 1.00 54.88 C ATOM 899 CD2 LEU U 97B 6.165 37.276 30.388 1.00 53.84 C ATOM 900 H LEU U 97B 9.653 33.909 29.787 1.00 0.00 H ATOM 901 N ALA U 98 8.920 34.641 27.343 1.00 44.45 N ATOM 902 CA ALA U 98 9.142 35.147 26.049 1.00 41.72 C ATOM 903 C ALA U 98 9.778 34.127 25.177 1.00 39.28 C ATOM 904 O ALA U 98 10.700 33.489 25.568 1.00 40.98 O ATOM 905 CB ALA U 98 10.001 36.346 26.162 1.00 42.22 C ATOM 906 H ALA U 98 9.631 34.829 28.079 1.00 0.00 H ATOM 907 N HIS U 99 9.257 33.973 23.988 1.00 35.58 N ATOM 908 CA HIS U 99 9.753 33.047 22.987 1.00 33.34 C ATOM 909 C HIS U 99 10.453 33.879 21.923 1.00 31.21 C ATOM 910 O HIS U 99 9.849 34.790 21.366 1.00 29.47 O ATOM 911 CB HIS U 99 8.594 32.271 22.353 1.00 35.33 C ATOM 912 CG HIS U 99 7.750 31.528 23.342 1.00 36.43 C ATOM 913 ND1 HIS U 99 7.729 30.153 23.418 1.00 38.79 N ATOM 914 CD2 HIS U 99 6.899 31.969 24.297 1.00 38.09 C ATOM 915 CE1 HIS U 99 6.902 29.777 24.377 1.00 37.58 C ATOM 916 NE2 HIS U 99 6.386 30.861 24.927 1.00 38.35 N ATOM 917 H HIS U 99 8.430 34.554 23.743 1.00 0.00 H ATOM 918 N HIS U 100 11.721 33.588 21.652 1.00 28.26 N ATOM 919 CA HIS U 100 12.441 34.262 20.572 1.00 27.36 C ATOM 920 C HIS U 100 12.266 33.477 19.280 1.00 24.51 C ATOM 921 O HIS U 100 12.198 32.246 19.309 1.00 23.67 O ATOM 922 CB HIS U 100 13.925 34.387 20.908 1.00 29.57 C ATOM 923 CG HIS U 100 14.206 35.312 22.048 1.00 31.69 C ATOM 924 ND1 HIS U 100 15.108 36.349 21.952 1.00 34.62 N ATOM 925 CD2 HIS U 100 13.695 35.371 23.300 1.00 33.09 C ATOM 926 CE1 HIS U 100 15.146 37.004 23.098 1.00 34.70 C ATOM 927 NE2 HIS U 100 14.296 36.432 23.933 1.00 34.51 N ATOM 928 H HIS U 100 12.211 32.867 22.219 1.00 0.00 H ATOM 929 N ASN U 101 12.195 34.198 18.157 1.00 22.13 N ATOM 930 CA ASN U 101 12.058 33.603 16.822 1.00 21.16 C ATOM 931 C ASN U 101 10.896 32.619 16.732 1.00 19.62 C ATOM 932 O ASN U 101 11.018 31.509 16.205 1.00 19.25 O ATOM 933 CB ASN U 101 13.377 32.961 16.407 1.00 21.72 C ATOM 934 CG ASN U 101 14.485 33.978 16.308 1.00 22.53 C ATOM 935 OD1 ASN U 101 14.381 34.925 15.539 1.00 23.84 O ATOM 936 ND2 ASN U 101 15.533 33.809 17.099 1.00 23.02 N ATOM 937 HD22 ASN U 101 15.577 32.988 17.736 1.00 0.00 H ATOM 938 HD21 ASN U 101 16.313 34.497 17.083 1.00 0.00 H ATOM 939 H ASN U 101 12.239 35.234 18.233 1.00 0.00 H ATOM 940 N ASP U 102 9.756 33.051 17.259 1.00 19.34 N ATOM 941 CA ASP U 102 8.609 32.168 17.420 1.00 18.62 C ATOM 942 C ASP U 102 7.801 32.166 16.125 1.00 19.12 C ATOM 943 O ASP U 102 6.760 32.823 16.004 1.00 19.26 O ATOM 944 CB ASP U 102 7.775 32.615 18.622 1.00 18.21 C ATOM 945 CG ASP U 102 6.801 31.552 19.097 1.00 17.57 C ATOM 946 OD1 ASP U 102 6.901 30.376 18.681 1.00 17.55 O ATOM 947 OD2 ASP U 102 5.933 31.892 19.919 1.00 17.38 O ATOM 948 H ASP U 102 9.681 34.043 17.564 1.00 0.00 H ATOM 949 N ILE U 103 8.311 31.420 15.152 1.00 18.67 N ATOM 950 CA ILE U 103 7.762 31.419 13.801 1.00 18.72 C ATOM 951 C ILE U 103 8.002 30.054 13.168 1.00 19.01 C ATOM 952 O ILE U 103 9.057 29.439 13.363 1.00 19.63 O ATOM 953 CB ILE U 103 8.353 32.583 12.966 1.00 18.31 C ATOM 954 CG1 ILE U 103 7.615 32.758 11.635 1.00 18.33 C ATOM 955 CG2 ILE U 103 9.850 32.406 12.733 1.00 18.69 C ATOM 956 CD1 ILE U 103 7.998 34.033 10.912 1.00 18.80 C ATOM 957 H ILE U 103 9.131 30.815 15.361 1.00 0.00 H ATOM 958 N ALA U 104 7.004 29.572 12.444 1.00 18.97 N ATOM 959 CA ALA U 104 7.014 28.235 11.875 1.00 19.02 C ATOM 960 C ALA U 104 6.249 28.223 10.566 1.00 19.42 C ATOM 961 O ALA U 104 5.305 28.997 10.393 1.00 19.68 O ATOM 962 CB ALA U 104 6.397 27.247 12.851 1.00 19.12 C ATOM 963 H ALA U 104 6.176 30.178 12.275 1.00 0.00 H ATOM 964 N LEU U 105 6.667 27.348 9.654 1.00 19.49 N ATOM 965 CA LEU U 105 6.016 27.164 8.358 1.00 19.87 C ATOM 966 C LEU U 105 5.498 25.738 8.221 1.00 20.64 C ATOM 967 O LEU U 105 6.202 24.775 8.546 1.00 20.74 O ATOM 968 CB LEU U 105 6.993 27.469 7.219 1.00 20.22 C ATOM 969 CG LEU U 105 7.296 28.937 6.923 1.00 20.36 C ATOM 970 CD1 LEU U 105 8.505 29.033 6.010 1.00 21.02 C ATOM 971 CD2 LEU U 105 6.101 29.639 6.292 1.00 20.20 C ATOM 972 H LEU U 105 7.500 26.765 9.875 1.00 0.00 H ATOM 973 N LEU U 106 4.262 25.608 7.745 1.00 20.43 N ATOM 974 CA LEU U 106 3.651 24.316 7.484 1.00 21.09 C ATOM 975 C LEU U 106 3.304 24.238 6.004 1.00 22.23 C ATOM 976 O LEU U 106 2.485 25.028 5.519 1.00 21.10 O ATOM 977 CB LEU U 106 2.389 24.119 8.330 1.00 21.57 C ATOM 978 CG LEU U 106 2.583 23.966 9.847 1.00 21.87 C ATOM 979 CD1 LEU U 106 2.764 25.310 10.553 1.00 22.85 C ATOM 980 CD2 LEU U 106 1.405 23.227 10.451 1.00 22.57 C ATOM 981 H LEU U 106 3.710 26.468 7.552 1.00 0.00 H ATOM 982 N LYS U 107 3.932 23.306 5.285 1.00 22.86 N ATOM 983 CA LYS U 107 3.543 23.031 3.904 1.00 24.37 C ATOM 984 C LYS U 107 2.387 22.049 3.936 1.00 24.15 C ATOM 985 O LYS U 107 2.504 20.959 4.504 1.00 24.05 O ATOM 986 CB LYS U 107 4.684 22.441 3.075 1.00 25.31 C ATOM 987 CG LYS U 107 4.451 22.569 1.581 1.00 26.85 C ATOM 988 CD LYS U 107 5.600 22.002 0.766 1.00 28.13 C ATOM 989 CE LYS U 107 5.442 22.354 -0.703 1.00 29.77 C ATOM 990 NZ LYS U 107 6.669 22.036 -1.492 1.00 30.68 N ATOM 991 HZ1 LYS U 107 7.473 22.577 -1.113 1.00 0.00 H ATOM 992 HZ2 LYS U 107 6.870 21.018 -1.422 1.00 0.00 H ATOM 993 HZ3 LYS U 107 6.515 22.293 -2.488 1.00 0.00 H ATOM 994 H LYS U 107 4.711 22.767 5.714 1.00 0.00 H ATOM 995 N ILE U 108 1.277 22.432 3.315 1.00 23.97 N ATOM 996 CA ILE U 108 0.036 21.670 3.425 1.00 25.23 C ATOM 997 C ILE U 108 -0.227 20.883 2.150 1.00 25.87 C ATOM 998 O ILE U 108 0.088 21.344 1.055 1.00 27.45 O ATOM 999 CB ILE U 108 -1.180 22.563 3.777 1.00 25.08 C ATOM 1000 CG1 ILE U 108 -1.302 23.774 2.840 1.00 25.57 C ATOM 1001 CG2 ILE U 108 -1.069 23.031 5.222 1.00 24.81 C ATOM 1002 CD1 ILE U 108 -2.641 24.480 2.924 1.00 26.21 C ATOM 1003 H ILE U 108 1.292 23.296 2.736 1.00 0.00 H ATOM 1004 N ARG U 109 -0.791 19.692 2.314 1.00 28.45 N ATOM 1005 CA ARG U 109 -1.136 18.832 1.189 1.00 30.71 C ATOM 1006 C ARG U 109 -2.270 17.888 1.585 1.00 30.97 C ATOM 1007 O ARG U 109 -2.177 17.194 2.601 1.00 31.09 O ATOM 1008 CB ARG U 109 0.097 18.041 0.737 1.00 32.35 C ATOM 1009 CG ARG U 109 -0.179 17.088 -0.417 1.00 34.63 C ATOM 1010 CD ARG U 109 1.083 16.689 -1.160 1.00 36.75 C ATOM 1011 NE ARG U 109 1.857 15.675 -0.445 1.00 39.40 N ATOM 1012 CZ ARG U 109 2.937 15.057 -0.930 1.00 41.66 C ATOM 1013 NH1 ARG U 109 3.401 15.342 -2.149 1.00 43.13 N ATOM 1014 NH2 ARG U 109 3.564 14.145 -0.189 1.00 42.17 N ATOM 1015 HE ARG U 109 1.543 15.416 0.512 1.00 0.00 H ATOM 1016 HH12 ARG U 109 4.243 14.852 -2.512 1.00 0.00 H ATOM 1017 HH11 ARG U 109 2.920 16.054 -2.735 1.00 0.00 H ATOM 1018 HH22 ARG U 109 4.405 13.661 -0.562 1.00 0.00 H ATOM 1019 HH21 ARG U 109 3.212 13.917 0.763 1.00 0.00 H ATOM 1020 H ARG U 109 -0.994 19.361 3.279 1.00 0.00 H ATOM 1021 N SER U 110 -3.337 17.861 0.786 1.00 32.80 N ATOM 1022 CA SER U 110 -4.480 16.976 1.058 1.00 34.56 C ATOM 1023 C SER U 110 -4.131 15.522 0.751 1.00 36.70 C ATOM 1024 O SER U 110 -3.103 15.245 0.125 1.00 36.30 O ATOM 1025 CB SER U 110 -5.700 17.398 0.232 1.00 34.63 C ATOM 1026 OG SER U 110 -5.432 17.335 -1.159 1.00 34.60 O ATOM 1027 HG SER U 110 -4.680 17.941 -1.377 1.00 0.00 H ATOM 1028 H SER U 110 -3.362 18.480 -0.049 1.00 0.00 H ATOM 1029 N LYS U 110A -4.998 14.599 1.166 1.00 39.26 N ATOM 1030 CA LYS U 110A -4.860 13.182 0.786 1.00 42.58 C ATOM 1031 C LYS U 110A -4.927 12.959 -0.737 1.00 42.93 C ATOM 1032 O LYS U 110A -4.466 11.926 -1.225 1.00 44.03 O ATOM 1033 CB LYS U 110A -5.905 12.298 1.488 1.00 44.15 C ATOM 1034 CG LYS U 110A -5.534 11.868 2.905 1.00 45.70 C ATOM 1035 CD LYS U 110A -6.388 10.684 3.356 1.00 46.59 C ATOM 1036 CE LYS U 110A -6.418 10.498 4.870 1.00 46.77 C ATOM 1037 NZ LYS U 110A -5.278 9.693 5.394 1.00 47.57 N ATOM 1038 HZ1 LYS U 110A -5.297 8.747 4.963 1.00 0.00 H ATOM 1039 HZ2 LYS U 110A -4.383 10.166 5.156 1.00 0.00 H ATOM 1040 HZ3 LYS U 110A -5.362 9.607 6.427 1.00 0.00 H ATOM 1041 H LYS U 110A -5.792 14.886 1.773 1.00 0.00 H ATOM 1042 N GLU U 110B -5.491 13.924 -1.468 1.00 43.75 N ATOM 1043 CA GLU U 110B -5.501 13.924 -2.935 1.00 44.04 C ATOM 1044 C GLU U 110B -4.287 14.662 -3.538 1.00 43.36 C ATOM 1045 O GLU U 110B -4.233 14.884 -4.751 1.00 43.96 O ATOM 1046 CB GLU U 110B -6.805 14.553 -3.452 1.00 45.81 C ATOM 1047 CG GLU U 110B -8.082 13.805 -3.062 1.00 46.61 C ATOM 1048 CD GLU U 110B -8.564 14.064 -1.636 1.00 47.65 C ATOM 1049 OE1 GLU U 110B -8.314 15.159 -1.080 1.00 47.62 O ATOM 1050 OE2 GLU U 110B -9.207 13.157 -1.065 1.00 48.76 O ATOM 1051 H GLU U 110B -5.947 14.716 -0.972 1.00 0.00 H ATOM 1052 N GLY U 110C -3.317 15.035 -2.700 1.00 41.54 N ATOM 1053 CA GLY U 110C -2.082 15.668 -3.149 1.00 40.38 C ATOM 1054 C GLY U 110C -2.189 17.109 -3.608 1.00 39.46 C ATOM 1055 O GLY U 110C -1.364 17.557 -4.408 1.00 39.99 O ATOM 1056 H GLY U 110C -3.448 14.867 -1.682 1.00 0.00 H ATOM 1057 N ARG U 110D -3.177 17.850 -3.100 1.00 38.63 N ATOM 1058 CA ARG U 110D -3.408 19.227 -3.546 1.00 38.02 C ATOM 1059 C ARG U 110D -3.252 20.249 -2.427 1.00 35.79 C ATOM 1060 O ARG U 110D -3.357 19.922 -1.243 1.00 34.50 O ATOM 1061 CB ARG U 110D -4.795 19.360 -4.186 1.00 41.77 C ATOM 1062 CG ARG U 110D -4.811 20.240 -5.436 1.00 44.55 C ATOM 1063 CD ARG U 110D -5.945 19.896 -6.389 1.00 46.90 C ATOM 1064 NE ARG U 110D -5.912 18.493 -6.810 1.00 49.49 N ATOM 1065 CZ ARG U 110D -6.743 17.939 -7.695 1.00 51.15 C ATOM 1066 NH1 ARG U 110D -7.685 18.660 -8.306 1.00 51.97 N ATOM 1067 NH2 ARG U 110D -6.618 16.646 -7.987 1.00 52.24 N ATOM 1068 HE ARG U 110D -5.185 17.882 -6.386 1.00 0.00 H ATOM 1069 HH12 ARG U 110D -8.322 18.208 -8.993 1.00 0.00 H ATOM 1070 HH11 ARG U 110D -7.782 19.674 -8.096 1.00 0.00 H ATOM 1071 HH22 ARG U 110D -7.260 16.204 -8.675 1.00 0.00 H ATOM 1072 HH21 ARG U 110D -5.878 16.078 -7.527 1.00 0.00 H ATOM 1073 H ARG U 110D -3.796 17.441 -2.372 1.00 0.00 H ATOM 1074 N CYS U 111 -3.003 21.486 -2.846 1.00 34.08 N ATOM 1075 CA CYS U 111 -2.856 22.635 -1.963 1.00 33.99 C ATOM 1076 C CYS U 111 -4.218 23.335 -1.838 1.00 34.00 C ATOM 1077 O CYS U 111 -5.227 22.809 -2.312 1.00 33.13 O ATOM 1078 CB CYS U 111 -1.776 23.569 -2.528 1.00 33.52 C ATOM 1079 SG CYS U 111 -0.110 22.861 -2.483 1.00 34.41 S ATOM 1080 H CYS U 111 -2.907 21.643 -3.870 1.00 0.00 H ATOM 1081 N ALA U 112 -4.251 24.496 -1.184 1.00 34.03 N ATOM 1082 CA ALA U 112 -5.485 25.270 -1.044 1.00 34.03 C ATOM 1083 C ALA U 112 -5.993 25.805 -2.391 1.00 34.41 C ATOM 1084 O ALA U 112 -5.236 26.417 -3.143 1.00 34.79 O ATOM 1085 CB ALA U 112 -5.285 26.423 -0.073 1.00 33.67 C ATOM 1086 H ALA U 112 -3.374 24.862 -0.761 1.00 0.00 H ATOM 1087 N GLN U 113 -7.253 25.503 -2.699 1.00 35.03 N ATOM 1088 CA GLN U 113 -8.029 26.182 -3.739 1.00 34.88 C ATOM 1089 C GLN U 113 -8.780 27.394 -3.152 1.00 32.50 C ATOM 1090 O GLN U 113 -9.689 27.212 -2.337 1.00 30.84 O ATOM 1091 CB GLN U 113 -9.040 25.208 -4.347 1.00 37.91 C ATOM 1092 CG GLN U 113 -8.420 23.978 -5.000 1.00 40.97 C ATOM 1093 CD GLN U 113 -9.448 22.915 -5.348 1.00 43.70 C ATOM 1094 OE1 GLN U 113 -9.242 21.730 -5.081 1.00 47.70 O ATOM 1095 NE2 GLN U 113 -10.564 23.333 -5.941 1.00 44.70 N ATOM 1096 HE22 GLN U 113 -10.696 24.344 -6.148 1.00 0.00 H ATOM 1097 HE21 GLN U 113 -11.304 22.649 -6.198 1.00 0.00 H ATOM 1098 H GLN U 113 -7.715 24.737 -2.168 1.00 0.00 H ATOM 1099 N PRO U 114 -8.406 28.632 -3.550 1.00 30.59 N ATOM 1100 CA PRO U 114 -9.109 29.798 -3.005 1.00 29.37 C ATOM 1101 C PRO U 114 -10.607 29.839 -3.333 1.00 28.28 C ATOM 1102 O PRO U 114 -11.031 29.364 -4.387 1.00 27.13 O ATOM 1103 CB PRO U 114 -8.373 30.986 -3.633 1.00 30.01 C ATOM 1104 CG PRO U 114 -7.020 30.463 -3.950 1.00 30.12 C ATOM 1105 CD PRO U 114 -7.234 29.037 -4.349 1.00 30.46 C ATOM 1106 N SER U 115 -11.383 30.389 -2.404 1.00 26.68 N ATOM 1107 CA SER U 115 -12.844 30.388 -2.477 1.00 25.80 C ATOM 1108 C SER U 115 -13.378 31.558 -1.655 1.00 25.17 C ATOM 1109 O SER U 115 -12.596 32.371 -1.162 1.00 24.69 O ATOM 1110 CB SER U 115 -13.395 29.062 -1.941 1.00 26.17 C ATOM 1111 OG SER U 115 -13.308 28.980 -0.524 1.00 26.08 O ATOM 1112 HG SER U 115 -13.673 28.111 -0.222 1.00 0.00 H ATOM 1113 H SER U 115 -10.929 30.842 -1.585 1.00 0.00 H ATOM 1114 N ARG U 116 -14.695 31.638 -1.474 1.00 24.54 N ATOM 1115 CA ARG U 116 -15.255 32.689 -0.627 1.00 25.33 C ATOM 1116 C ARG U 116 -14.800 32.592 0.841 1.00 25.35 C ATOM 1117 O ARG U 116 -14.766 33.599 1.541 1.00 26.50 O ATOM 1118 CB ARG U 116 -16.786 32.725 -0.705 1.00 26.80 C ATOM 1119 CG ARG U 116 -17.334 34.045 -0.195 1.00 28.19 C ATOM 1120 CD ARG U 116 -18.696 34.408 -0.756 1.00 30.43 C ATOM 1121 NE ARG U 116 -19.873 33.571 -0.502 1.00 33.04 N ATOM 1122 CZ ARG U 116 -20.221 32.917 0.610 1.00 33.99 C ATOM 1123 NH1 ARG U 116 -19.475 32.882 1.716 1.00 38.02 N ATOM 1124 NH2 ARG U 116 -21.380 32.259 0.610 1.00 34.46 N ATOM 1125 HE ARG U 116 -20.531 33.472 -1.302 1.00 0.00 H ATOM 1126 HH12 ARG U 116 -19.804 32.353 2.549 1.00 0.00 H ATOM 1127 HH11 ARG U 116 -18.564 33.383 1.745 1.00 0.00 H ATOM 1128 HH22 ARG U 116 -21.683 31.739 1.458 1.00 0.00 H ATOM 1129 HH21 ARG U 116 -21.982 32.266 -0.238 1.00 0.00 H ATOM 1130 H ARG U 116 -15.326 30.952 -1.936 1.00 0.00 H ATOM 1131 N THR U 117 -14.446 31.389 1.289 1.00 24.46 N ATOM 1132 CA THR U 117 -14.012 31.150 2.670 1.00 23.97 C ATOM 1133 C THR U 117 -12.501 30.912 2.818 1.00 24.28 C ATOM 1134 O THR U 117 -12.020 30.734 3.938 1.00 24.18 O ATOM 1135 CB THR U 117 -14.779 29.956 3.257 1.00 23.64 C ATOM 1136 OG1 THR U 117 -14.596 28.796 2.436 1.00 23.66 O ATOM 1137 CG2 THR U 117 -16.267 30.277 3.338 1.00 24.00 C ATOM 1138 HG1 THR U 117 -15.095 28.035 2.826 1.00 0.00 H ATOM 1139 H THR U 117 -14.479 30.584 0.631 1.00 0.00 H ATOM 1140 N ILE U 118 -11.759 30.901 1.705 1.00 24.39 N ATOM 1141 CA ILE U 118 -10.328 30.567 1.710 1.00 25.11 C ATOM 1142 C ILE U 118 -9.568 31.518 0.773 1.00 25.93 C ATOM 1143 O ILE U 118 -9.809 31.534 -0.433 1.00 27.30 O ATOM 1144 CB ILE U 118 -10.100 29.085 1.324 1.00 24.89 C ATOM 1145 CG1 ILE U 118 -10.821 28.162 2.320 1.00 24.83 C ATOM 1146 CG2 ILE U 118 -8.606 28.755 1.279 1.00 25.59 C ATOM 1147 CD1 ILE U 118 -10.978 26.731 1.884 1.00 25.13 C ATOM 1148 H ILE U 118 -12.213 31.138 0.800 1.00 0.00 H ATOM 1149 N GLN U 119 -8.682 32.333 1.338 1.00 25.77 N ATOM 1150 CA GLN U 119 -7.866 33.286 0.570 1.00 26.37 C ATOM 1151 C GLN U 119 -6.518 33.418 1.255 1.00 25.64 C ATOM 1152 O GLN U 119 -6.389 33.061 2.421 1.00 24.54 O ATOM 1153 CB GLN U 119 -8.538 34.666 0.491 1.00 27.84 C ATOM 1154 CG GLN U 119 -9.860 34.731 -0.279 1.00 29.74 C ATOM 1155 CD GLN U 119 -9.710 34.508 -1.780 1.00 31.04 C ATOM 1156 OE1 GLN U 119 -8.803 35.045 -2.416 1.00 34.86 O ATOM 1157 NE2 GLN U 119 -10.618 33.729 -2.356 1.00 32.48 N ATOM 1158 HE22 GLN U 119 -11.369 33.294 -1.783 1.00 0.00 H ATOM 1159 HE21 GLN U 119 -10.578 33.554 -3.380 1.00 0.00 H ATOM 1160 H GLN U 119 -8.560 32.295 2.370 1.00 0.00 H ATOM 1161 N THR U 120 -5.518 33.923 0.540 1.00 24.73 N ATOM 1162 CA THR U 120 -4.207 34.194 1.140 1.00 23.81 C ATOM 1163 C THR U 120 -4.160 35.601 1.743 1.00 23.18 C ATOM 1164 O THR U 120 -4.981 36.456 1.404 1.00 22.91 O ATOM 1165 CB THR U 120 -3.067 34.037 0.112 1.00 23.78 C ATOM 1166 OG1 THR U 120 -3.300 34.913 -1.000 1.00 24.69 O ATOM 1167 CG2 THR U 120 -2.976 32.593 -0.380 1.00 23.79 C ATOM 1168 HG1 THR U 120 -3.330 35.849 -0.680 1.00 0.00 H ATOM 1169 H THR U 120 -5.668 34.131 -0.468 1.00 0.00 H ATOM 1170 N ILE U 121 -3.195 35.822 2.638 1.00 22.08 N ATOM 1171 CA ILE U 121 -2.912 37.143 3.213 1.00 21.90 C ATOM 1172 C ILE U 121 -1.524 37.591 2.753 1.00 22.76 C ATOM 1173 O ILE U 121 -0.573 36.807 2.772 1.00 22.26 O ATOM 1174 CB ILE U 121 -3.031 37.166 4.774 1.00 22.27 C ATOM 1175 CG1 ILE U 121 -2.782 38.564 5.358 1.00 22.79 C ATOM 1176 CG2 ILE U 121 -2.109 36.155 5.459 1.00 22.19 C ATOM 1177 CD1 ILE U 121 -3.835 39.588 5.002 1.00 24.03 C ATOM 1178 H ILE U 121 -2.613 35.016 2.944 1.00 0.00 H ATOM 1179 N ALA U 122 -1.422 38.851 2.339 1.00 22.45 N ATOM 1180 CA ALA U 122 -0.151 39.428 1.917 1.00 23.52 C ATOM 1181 C ALA U 122 0.821 39.555 3.087 1.00 24.08 C ATOM 1182 O ALA U 122 0.429 39.903 4.205 1.00 23.54 O ATOM 1183 CB ALA U 122 -0.370 40.797 1.295 1.00 23.67 C ATOM 1184 H ALA U 122 -2.276 39.444 2.316 1.00 0.00 H ATOM 1185 N LEU U 123 2.095 39.285 2.814 1.00 25.08 N ATOM 1186 CA LEU U 123 3.168 39.570 3.757 1.00 25.30 C ATOM 1187 C LEU U 123 3.530 41.053 3.654 1.00 26.24 C ATOM 1188 O LEU U 123 3.329 41.661 2.596 1.00 26.37 O ATOM 1189 CB LEU U 123 4.397 38.713 3.438 1.00 26.02 C ATOM 1190 CG LEU U 123 4.194 37.199 3.526 1.00 26.04 C ATOM 1191 CD1 LEU U 123 5.393 36.466 2.942 1.00 26.37 C ATOM 1192 CD2 LEU U 123 3.959 36.775 4.971 1.00 25.93 C ATOM 1193 H LEU U 123 2.333 38.856 1.897 1.00 0.00 H ATOM 1194 N PRO U 124 4.066 41.647 4.740 1.00 27.01 N ATOM 1195 CA PRO U 124 4.521 43.034 4.653 1.00 28.01 C ATOM 1196 C PRO U 124 5.794 43.150 3.824 1.00 29.44 C ATOM 1197 O PRO U 124 6.440 42.139 3.543 1.00 29.23 O ATOM 1198 CB PRO U 124 4.795 43.409 6.113 1.00 28.09 C ATOM 1199 CG PRO U 124 5.140 42.121 6.773 1.00 27.84 C ATOM 1200 CD PRO U 124 4.367 41.052 6.056 1.00 27.65 C ATOM 1201 N SER U 125 6.122 44.368 3.407 1.00 31.85 N ATOM 1202 CA SER U 125 7.443 44.651 2.838 1.00 33.31 C ATOM 1203 C SER U 125 8.419 44.766 4.007 1.00 33.92 C ATOM 1204 O SER U 125 8.015 45.076 5.135 1.00 33.90 O ATOM 1205 CB SER U 125 7.424 45.918 1.977 1.00 34.30 C ATOM 1206 OG SER U 125 7.094 47.058 2.742 1.00 36.87 O ATOM 1207 HG SER U 125 7.091 47.857 2.157 1.00 0.00 H ATOM 1208 H SER U 125 5.427 45.137 3.486 1.00 0.00 H ATOM 1209 N MET U 126 9.694 44.494 3.750 1.00 34.35 N ATOM 1210 CA MET U 126 10.670 44.317 4.829 1.00 35.34 C ATOM 1211 C MET U 126 10.789 45.558 5.707 1.00 36.33 C ATOM 1212 O MET U 126 10.802 46.684 5.201 1.00 36.95 O ATOM 1213 CB MET U 126 12.048 43.940 4.275 1.00 36.60 C ATOM 1214 CG MET U 126 12.795 45.086 3.620 1.00 37.54 C ATOM 1215 SD MET U 126 14.180 44.534 2.625 1.00 38.96 S ATOM 1216 CE MET U 126 14.800 46.112 2.049 1.00 37.06 C ATOM 1217 H MET U 126 10.006 44.405 2.762 1.00 0.00 H ATOM 1218 N TYR U 127 10.854 45.336 7.021 1.00 36.43 N ATOM 1219 CA TYR U 127 11.005 46.403 8.018 1.00 37.41 C ATOM 1220 C TYR U 127 9.976 47.547 7.882 1.00 38.19 C ATOM 1221 O TYR U 127 10.255 48.687 8.260 1.00 40.61 O ATOM 1222 CB TYR U 127 12.457 46.928 7.993 1.00 37.32 C ATOM 1223 CG TYR U 127 13.456 45.912 8.508 1.00 37.49 C ATOM 1224 CD1 TYR U 127 13.890 44.856 7.707 1.00 37.64 C ATOM 1225 CD2 TYR U 127 13.954 45.994 9.808 1.00 38.14 C ATOM 1226 CE1 TYR U 127 14.795 43.915 8.184 1.00 37.65 C ATOM 1227 CE2 TYR U 127 14.856 45.058 10.293 1.00 38.12 C ATOM 1228 CZ TYR U 127 15.273 44.021 9.481 1.00 37.52 C ATOM 1229 OH TYR U 127 16.169 43.100 9.976 1.00 37.90 O ATOM 1230 HH TYR U 127 16.367 42.426 9.278 1.00 0.00 H ATOM 1231 H TYR U 127 10.794 44.354 7.357 1.00 0.00 H ATOM 1232 N ASN U 128 8.785 47.224 7.368 1.00 38.75 N ATOM 1233 CA ASN U 128 7.721 48.202 7.135 1.00 38.65 C ATOM 1234 C ASN U 128 6.483 47.796 7.921 1.00 38.24 C ATOM 1235 O ASN U 128 5.718 46.927 7.493 1.00 37.88 O ATOM 1236 CB ASN U 128 7.391 48.314 5.640 1.00 39.72 C ATOM 1237 CG ASN U 128 6.324 49.360 5.345 1.00 40.59 C ATOM 1238 OD1 ASN U 128 6.195 50.357 6.059 1.00 42.48 O ATOM 1239 ND2 ASN U 128 5.553 49.136 4.287 1.00 41.33 N ATOM 1240 HD22 ASN U 128 5.696 48.282 3.711 1.00 0.00 H ATOM 1241 HD21 ASN U 128 4.807 49.815 4.034 1.00 0.00 H ATOM 1242 H ASN U 128 8.606 46.230 7.122 1.00 0.00 H ATOM 1243 N ASP U 129 6.312 48.426 9.081 1.00 37.76 N ATOM 1244 CA ASP U 129 5.170 48.184 9.954 1.00 37.73 C ATOM 1245 C ASP U 129 4.407 49.491 10.159 1.00 36.85 C ATOM 1246 O ASP U 129 4.941 50.571 9.878 1.00 36.56 O ATOM 1247 CB ASP U 129 5.656 47.633 11.300 1.00 38.26 C ATOM 1248 CG ASP U 129 6.338 46.278 11.169 1.00 39.47 C ATOM 1249 OD1 ASP U 129 5.830 45.411 10.423 1.00 40.12 O ATOM 1250 OD2 ASP U 129 7.383 46.079 11.820 1.00 41.11 O ATOM 1251 H ASP U 129 7.025 49.122 9.378 1.00 0.00 H ATOM 1252 N PRO U 130 3.155 49.408 10.652 1.00 36.03 N ATOM 1253 CA PRO U 130 2.445 50.651 10.957 1.00 35.33 C ATOM 1254 C PRO U 130 3.031 51.342 12.185 1.00 35.08 C ATOM 1255 O PRO U 130 3.720 50.706 12.989 1.00 34.18 O ATOM 1256 CB PRO U 130 0.996 50.196 11.220 1.00 35.41 C ATOM 1257 CG PRO U 130 0.954 48.722 10.991 1.00 35.57 C ATOM 1258 CD PRO U 130 2.359 48.216 11.000 1.00 35.38 C ATOM 1259 N GLN U 131 2.758 52.636 12.320 1.00 35.24 N ATOM 1260 CA GLN U 131 3.215 53.406 13.479 1.00 36.09 C ATOM 1261 C GLN U 131 2.456 53.003 14.741 1.00 34.52 C ATOM 1262 O GLN U 131 1.341 52.475 14.665 1.00 32.97 O ATOM 1263 CB GLN U 131 3.062 54.908 13.219 1.00 39.78 C ATOM 1264 CG GLN U 131 4.045 55.439 12.182 1.00 42.36 C ATOM 1265 CD GLN U 131 3.788 56.882 11.784 1.00 45.81 C ATOM 1266 OE1 GLN U 131 2.906 57.550 12.328 1.00 48.40 O ATOM 1267 NE2 GLN U 131 4.567 57.373 10.823 1.00 47.88 N ATOM 1268 HE22 GLN U 131 5.299 56.774 10.391 1.00 0.00 H ATOM 1269 HE21 GLN U 131 4.443 58.355 10.504 1.00 0.00 H ATOM 1270 H GLN U 131 2.204 53.115 11.582 1.00 0.00 H ATOM 1271 N PHE U 132 3.065 53.246 15.900 1.00 33.56 N ATOM 1272 CA PHE U 132 2.418 52.941 17.180 1.00 33.64 C ATOM 1273 C PHE U 132 1.091 53.690 17.303 1.00 32.21 C ATOM 1274 O PHE U 132 0.936 54.798 16.782 1.00 31.44 O ATOM 1275 CB PHE U 132 3.332 53.229 18.382 1.00 35.15 C ATOM 1276 CG PHE U 132 3.597 54.691 18.624 1.00 36.40 C ATOM 1277 CD1 PHE U 132 2.739 55.452 19.417 1.00 37.20 C ATOM 1278 CD2 PHE U 132 4.722 55.307 18.079 1.00 38.11 C ATOM 1279 CE1 PHE U 132 2.986 56.802 19.644 1.00 38.21 C ATOM 1280 CE2 PHE U 132 4.973 56.653 18.301 1.00 38.27 C ATOM 1281 CZ PHE U 132 4.107 57.401 19.087 1.00 38.28 C ATOM 1282 H PHE U 132 4.019 53.660 15.897 1.00 0.00 H ATOM 1283 N GLY U 133 0.135 53.059 17.970 1.00 29.97 N ATOM 1284 CA GLY U 133 -1.227 53.566 18.039 1.00 28.98 C ATOM 1285 C GLY U 133 -2.130 53.151 16.891 1.00 27.84 C ATOM 1286 O GLY U 133 -3.321 53.436 16.939 1.00 27.95 O ATOM 1287 H GLY U 133 0.366 52.172 18.461 1.00 0.00 H ATOM 1288 N THR U 134 -1.588 52.491 15.861 1.00 26.68 N ATOM 1289 CA THR U 134 -2.400 51.967 14.760 1.00 25.79 C ATOM 1290 C THR U 134 -3.242 50.803 15.269 1.00 24.70 C ATOM 1291 O THR U 134 -2.735 49.956 16.001 1.00 24.00 O ATOM 1292 CB THR U 134 -1.524 51.456 13.595 1.00 26.52 C ATOM 1293 OG1 THR U 134 -0.741 52.535 13.076 1.00 27.73 O ATOM 1294 CG2 THR U 134 -2.373 50.868 12.466 1.00 26.00 C ATOM 1295 HG1 THR U 134 -0.160 52.894 13.793 1.00 0.00 H ATOM 1296 H THR U 134 -0.558 52.345 15.841 1.00 0.00 H ATOM 1297 N SER U 135 -4.516 50.776 14.876 1.00 23.76 N ATOM 1298 CA SER U 135 -5.433 49.695 15.254 1.00 23.74 C ATOM 1299 C SER U 135 -5.270 48.526 14.291 1.00 23.21 C ATOM 1300 O SER U 135 -5.308 48.717 13.074 1.00 23.99 O ATOM 1301 CB SER U 135 -6.890 50.171 15.214 1.00 24.17 C ATOM 1302 OG SER U 135 -7.135 51.174 16.187 1.00 25.14 O ATOM 1303 HG SER U 135 -6.546 51.951 16.014 1.00 0.00 H ATOM 1304 H SER U 135 -4.873 51.550 14.280 1.00 0.00 H ATOM 1305 N CYS U 136 -5.096 47.321 14.832 1.00 22.79 N ATOM 1306 CA CYS U 136 -5.020 46.100 14.028 1.00 22.20 C ATOM 1307 C CYS U 136 -5.963 45.060 14.595 1.00 21.54 C ATOM 1308 O CYS U 136 -6.500 45.236 15.690 1.00 22.66 O ATOM 1309 CB CYS U 136 -3.594 45.557 14.023 1.00 23.08 C ATOM 1310 SG CYS U 136 -2.412 46.760 13.377 1.00 24.02 S ATOM 1311 H CYS U 136 -5.011 47.245 15.866 1.00 0.00 H ATOM 1312 N GLU U 137 -6.160 43.979 13.851 1.00 20.50 N ATOM 1313 CA GLU U 137 -7.090 42.933 14.267 1.00 20.71 C ATOM 1314 C GLU U 137 -6.357 41.633 14.556 1.00 19.94 C ATOM 1315 O GLU U 137 -5.308 41.360 13.973 1.00 19.67 O ATOM 1316 CB GLU U 137 -8.203 42.731 13.236 1.00 22.08 C ATOM 1317 CG GLU U 137 -7.760 42.263 11.857 1.00 23.01 C ATOM 1318 CD GLU U 137 -8.852 42.375 10.799 1.00 24.01 C ATOM 1319 OE1 GLU U 137 -9.742 43.243 10.923 1.00 25.30 O ATOM 1320 OE2 GLU U 137 -8.801 41.599 9.827 1.00 24.68 O ATOM 1321 H GLU U 137 -5.642 43.875 12.955 1.00 0.00 H ATOM 1322 N ILE U 138 -6.922 40.857 15.480 1.00 17.83 N ATOM 1323 CA ILE U 138 -6.424 39.523 15.827 1.00 17.84 C ATOM 1324 C ILE U 138 -7.596 38.560 15.789 1.00 17.14 C ATOM 1325 O ILE U 138 -8.720 38.963 16.073 1.00 16.82 O ATOM 1326 CB ILE U 138 -5.725 39.482 17.207 1.00 18.36 C ATOM 1327 CG1 ILE U 138 -6.557 40.190 18.284 1.00 18.65 C ATOM 1328 CG2 ILE U 138 -4.357 40.131 17.110 1.00 18.79 C ATOM 1329 CD1 ILE U 138 -5.993 40.091 19.688 1.00 18.98 C ATOM 1330 H ILE U 138 -7.760 41.216 15.981 1.00 0.00 H ATOM 1331 N THR U 139 -7.327 37.309 15.426 1.00 16.37 N ATOM 1332 CA THR U 139 -8.364 36.300 15.203 1.00 16.12 C ATOM 1333 C THR U 139 -7.924 34.960 15.777 1.00 16.18 C ATOM 1334 O THR U 139 -6.755 34.607 15.680 1.00 15.89 O ATOM 1335 CB THR U 139 -8.627 36.125 13.694 1.00 16.73 C ATOM 1336 OG1 THR U 139 -8.933 37.397 13.118 1.00 16.73 O ATOM 1337 CG2 THR U 139 -9.778 35.164 13.422 1.00 16.59 C ATOM 1338 HG1 THR U 139 -8.169 38.012 13.253 1.00 0.00 H ATOM 1339 H THR U 139 -6.333 37.035 15.294 1.00 0.00 H ATOM 1340 N GLY U 140 -8.858 34.202 16.343 1.00 15.42 N ATOM 1341 CA GLY U 140 -8.521 32.888 16.873 1.00 15.49 C ATOM 1342 C GLY U 140 -9.634 32.184 17.630 1.00 15.46 C ATOM 1343 O GLY U 140 -10.696 32.775 17.896 1.00 15.66 O ATOM 1344 H GLY U 140 -9.836 34.550 16.408 1.00 0.00 H ATOM 1345 N PHE U 141 -9.369 30.913 17.941 1.00 15.11 N ATOM 1346 CA PHE U 141 -10.237 30.050 18.753 1.00 15.39 C ATOM 1347 C PHE U 141 -9.761 29.961 20.218 1.00 15.06 C ATOM 1348 O PHE U 141 -10.174 29.061 20.947 1.00 15.37 O ATOM 1349 CB PHE U 141 -10.272 28.627 18.162 1.00 15.97 C ATOM 1350 CG PHE U 141 -11.072 28.484 16.893 1.00 16.20 C ATOM 1351 CD1 PHE U 141 -12.461 28.583 16.910 1.00 16.91 C ATOM 1352 CD2 PHE U 141 -10.445 28.150 15.690 1.00 16.82 C ATOM 1353 CE1 PHE U 141 -13.200 28.408 15.752 1.00 17.40 C ATOM 1354 CE2 PHE U 141 -11.179 27.979 14.529 1.00 17.23 C ATOM 1355 CZ PHE U 141 -12.561 28.100 14.559 1.00 17.77 C ATOM 1356 H PHE U 141 -8.483 30.504 17.582 1.00 0.00 H ATOM 1357 N GLY U 142 -8.903 30.878 20.662 1.00 15.04 N ATOM 1358 CA GLY U 142 -8.326 30.798 22.000 1.00 15.51 C ATOM 1359 C GLY U 142 -9.318 31.163 23.089 1.00 15.89 C ATOM 1360 O GLY U 142 -10.443 31.590 22.810 1.00 16.08 O ATOM 1361 H GLY U 142 -8.638 31.669 20.041 1.00 0.00 H ATOM 1362 N LYS U 143 -8.883 31.037 24.336 1.00 16.89 N ATOM 1363 CA LYS U 143 -9.771 31.237 25.484 1.00 18.01 C ATOM 1364 C LYS U 143 -10.430 32.614 25.488 1.00 17.74 C ATOM 1365 O LYS U 143 -9.823 33.594 25.068 1.00 16.10 O ATOM 1366 CB LYS U 143 -9.011 31.056 26.794 1.00 19.41 C ATOM 1367 CG LYS U 143 -8.553 29.640 27.051 1.00 21.13 C ATOM 1368 CD LYS U 143 -7.941 29.515 28.434 1.00 23.29 C ATOM 1369 CE LYS U 143 -7.509 28.090 28.706 1.00 24.93 C ATOM 1370 NZ LYS U 143 -7.002 27.969 30.097 1.00 26.02 N ATOM 1371 HZ1 LYS U 143 -6.188 28.604 30.225 1.00 0.00 H ATOM 1372 HZ2 LYS U 143 -7.756 28.232 30.764 1.00 0.00 H ATOM 1373 HZ3 LYS U 143 -6.708 26.987 30.273 1.00 0.00 H ATOM 1374 H LYS U 143 -7.887 30.790 24.503 1.00 0.00 H ATOM 1375 N GLU U 144 -11.670 32.663 25.972 1.00 18.18 N ATOM 1376 CA GLU U 144 -12.417 33.914 26.147 1.00 19.13 C ATOM 1377 C GLU U 144 -12.178 34.569 27.498 1.00 20.45 C ATOM 1378 O GLU U 144 -12.462 35.753 27.674 1.00 20.36 O ATOM 1379 CB GLU U 144 -13.911 33.664 26.000 1.00 19.39 C ATOM 1380 CG GLU U 144 -14.325 33.163 24.633 1.00 19.42 C ATOM 1381 CD GLU U 144 -15.808 33.339 24.409 1.00 19.51 C ATOM 1382 OE1 GLU U 144 -16.548 32.343 24.533 1.00 20.89 O ATOM 1383 OE2 GLU U 144 -16.229 34.482 24.147 1.00 19.25 O ATOM 1384 H GLU U 144 -12.132 31.770 26.239 1.00 0.00 H ATOM 1385 N GLN U 145 -11.725 33.777 28.463 1.00 22.53 N ATOM 1386 CA GLN U 145 -11.260 34.292 29.745 1.00 24.78 C ATOM 1387 C GLN U 145 -10.060 33.463 30.167 1.00 24.48 C ATOM 1388 O GLN U 145 -9.971 32.271 29.852 1.00 22.59 O ATOM 1389 CB GLN U 145 -12.365 34.247 30.816 1.00 26.97 C ATOM 1390 CG GLN U 145 -13.668 34.935 30.413 1.00 29.24 C ATOM 1391 CD GLN U 145 -14.563 35.294 31.585 1.00 32.35 C ATOM 1392 OE1 GLN U 145 -14.692 36.465 31.949 1.00 36.66 O ATOM 1393 NE2 GLN U 145 -15.199 34.294 32.170 1.00 34.92 N ATOM 1394 HE22 GLN U 145 -15.061 33.321 31.831 1.00 0.00 H ATOM 1395 HE21 GLN U 145 -15.837 34.480 32.970 1.00 0.00 H ATOM 1396 H GLN U 145 -11.701 32.750 28.298 1.00 0.00 H ATOM 1397 N SER U 146 -9.134 34.098 30.880 1.00 26.14 N ATOM 1398 CA SER U 146 -7.936 33.420 31.367 1.00 27.56 C ATOM 1399 C SER U 146 -8.286 32.188 32.205 1.00 28.49 C ATOM 1400 O SER U 146 -7.651 31.147 32.060 1.00 29.49 O ATOM 1401 CB SER U 146 -7.070 34.385 32.178 1.00 28.33 C ATOM 1402 OG SER U 146 -6.723 35.509 31.382 1.00 28.82 O ATOM 1403 HG SER U 146 -6.163 36.128 31.914 1.00 0.00 H ATOM 1404 H SER U 146 -9.267 35.106 31.097 1.00 0.00 H ATOM 1405 N THR U 147 -9.326 32.310 33.028 1.00 29.69 N ATOM 1406 CA THR U 147 -9.779 31.222 33.911 1.00 29.42 C ATOM 1407 C THR U 147 -10.582 30.095 33.221 1.00 28.59 C ATOM 1408 O THR U 147 -10.873 29.080 33.862 1.00 28.66 O ATOM 1409 CB THR U 147 -10.625 31.789 35.071 1.00 29.74 C ATOM 1410 OG1 THR U 147 -11.704 32.573 34.548 1.00 30.19 O ATOM 1411 CG2 THR U 147 -9.772 32.659 35.991 1.00 31.13 C ATOM 1412 HG1 THR U 147 -12.242 32.933 35.297 1.00 0.00 H ATOM 1413 H THR U 147 -9.841 33.213 33.048 1.00 0.00 H ATOM 1414 N ASP U 148 -10.944 30.256 31.944 1.00 27.23 N ATOM 1415 CA ASP U 148 -11.746 29.241 31.237 1.00 26.48 C ATOM 1416 C ASP U 148 -10.999 27.935 31.055 1.00 27.19 C ATOM 1417 O ASP U 148 -9.780 27.918 30.880 1.00 27.40 O ATOM 1418 CB ASP U 148 -12.200 29.727 29.849 1.00 25.23 C ATOM 1419 CG ASP U 148 -13.310 30.763 29.911 1.00 24.39 C ATOM 1420 OD1 ASP U 148 -13.828 31.052 31.010 1.00 23.57 O ATOM 1421 OD2 ASP U 148 -13.673 31.293 28.843 1.00 23.43 O ATOM 1422 H ASP U 148 -10.653 31.117 31.438 1.00 0.00 H ATOM 1423 N TYR U 149 -11.755 26.845 31.096 1.00 27.23 N ATOM 1424 CA TYR U 149 -11.234 25.523 30.803 1.00 28.97 C ATOM 1425 C TYR U 149 -11.398 25.200 29.318 1.00 27.32 C ATOM 1426 O TYR U 149 -10.480 24.656 28.706 1.00 29.67 O ATOM 1427 CB TYR U 149 -11.948 24.486 31.667 1.00 30.66 C ATOM 1428 CG TYR U 149 -11.356 23.101 31.585 1.00 33.95 C ATOM 1429 CD1 TYR U 149 -10.023 22.864 31.927 1.00 35.69 C ATOM 1430 CD2 TYR U 149 -12.131 22.018 31.180 1.00 35.54 C ATOM 1431 CE1 TYR U 149 -9.483 21.587 31.858 1.00 37.46 C ATOM 1432 CE2 TYR U 149 -11.602 20.740 31.109 1.00 37.07 C ATOM 1433 CZ TYR U 149 -10.279 20.529 31.448 1.00 37.47 C ATOM 1434 OH TYR U 149 -9.762 19.259 31.374 1.00 40.39 O ATOM 1435 HH TYR U 149 -8.811 19.275 31.647 1.00 0.00 H ATOM 1436 H TYR U 149 -12.759 26.942 31.348 1.00 0.00 H ATOM 1437 N LEU U 150 -12.552 25.551 28.749 1.00 24.86 N ATOM 1438 CA LEU U 150 -12.860 25.288 27.339 1.00 23.62 C ATOM 1439 C LEU U 150 -12.406 26.425 26.430 1.00 21.75 C ATOM 1440 O LEU U 150 -12.241 27.558 26.874 1.00 20.16 O ATOM 1441 CB LEU U 150 -14.370 25.123 27.147 1.00 24.19 C ATOM 1442 CG LEU U 150 -15.045 23.968 27.897 1.00 24.89 C ATOM 1443 CD1 LEU U 150 -16.553 24.151 27.973 1.00 25.36 C ATOM 1444 CD2 LEU U 150 -14.708 22.647 27.230 1.00 25.25 C ATOM 1445 H LEU U 150 -13.266 26.033 29.331 1.00 0.00 H ATOM 1446 N TYR U 151 -12.212 26.091 25.158 1.00 20.55 N ATOM 1447 CA TYR U 151 -12.081 27.085 24.094 1.00 19.97 C ATOM 1448 C TYR U 151 -13.465 27.334 23.496 1.00 19.11 C ATOM 1449 O TYR U 151 -14.306 26.421 23.495 1.00 18.95 O ATOM 1450 CB TYR U 151 -11.162 26.586 22.979 1.00 20.49 C ATOM 1451 CG TYR U 151 -9.677 26.461 23.292 1.00 21.34 C ATOM 1452 CD1 TYR U 151 -9.065 27.170 24.337 1.00 22.73 C ATOM 1453 CD2 TYR U 151 -8.870 25.659 22.496 1.00 22.30 C ATOM 1454 CE1 TYR U 151 -7.703 27.047 24.585 1.00 22.87 C ATOM 1455 CE2 TYR U 151 -7.506 25.535 22.738 1.00 22.90 C ATOM 1456 CZ TYR U 151 -6.931 26.233 23.778 1.00 22.82 C ATOM 1457 OH TYR U 151 -5.585 26.099 24.011 1.00 24.50 O ATOM 1458 HH TYR U 151 -5.082 26.390 23.210 1.00 0.00 H ATOM 1459 H TYR U 151 -12.151 25.083 24.910 1.00 0.00 H ATOM 1460 N PRO U 152 -13.708 28.551 22.965 1.00 17.76 N ATOM 1461 CA PRO U 152 -14.970 28.838 22.291 1.00 17.65 C ATOM 1462 C PRO U 152 -15.139 27.948 21.067 1.00 18.16 C ATOM 1463 O PRO U 152 -14.159 27.578 20.415 1.00 17.92 O ATOM 1464 CB PRO U 152 -14.824 30.307 21.878 1.00 17.42 C ATOM 1465 CG PRO U 152 -13.357 30.513 21.759 1.00 17.60 C ATOM 1466 CD PRO U 152 -12.801 29.708 22.896 1.00 17.26 C ATOM 1467 N GLU U 153 -16.381 27.583 20.790 1.00 18.50 N ATOM 1468 CA GLU U 153 -16.709 26.766 19.644 1.00 20.19 C ATOM 1469 C GLU U 153 -16.746 27.579 18.343 1.00 18.91 C ATOM 1470 O GLU U 153 -16.649 27.001 17.266 1.00 19.33 O ATOM 1471 CB GLU U 153 -18.066 26.095 19.896 1.00 22.71 C ATOM 1472 CG GLU U 153 -18.404 24.949 18.976 1.00 25.98 C ATOM 1473 CD GLU U 153 -17.358 23.859 18.941 1.00 27.71 C ATOM 1474 OE1 GLU U 153 -16.755 23.522 19.989 1.00 32.36 O ATOM 1475 OE2 GLU U 153 -17.151 23.336 17.836 1.00 31.86 O ATOM 1476 H GLU U 153 -17.148 27.895 21.419 1.00 0.00 H ATOM 1477 N GLN U 154 -16.924 28.899 18.453 1.00 18.07 N ATOM 1478 CA GLN U 154 -17.065 29.807 17.317 1.00 17.68 C ATOM 1479 C GLN U 154 -15.853 30.738 17.267 1.00 16.73 C ATOM 1480 O GLN U 154 -15.406 31.244 18.295 1.00 16.46 O ATOM 1481 CB GLN U 154 -18.337 30.645 17.485 1.00 17.81 C ATOM 1482 CG GLN U 154 -18.711 31.541 16.302 1.00 18.51 C ATOM 1483 CD GLN U 154 -19.265 30.772 15.113 1.00 19.05 C ATOM 1484 OE1 GLN U 154 -19.999 29.791 15.273 1.00 20.21 O ATOM 1485 NE2 GLN U 154 -18.933 31.228 13.904 1.00 19.24 N ATOM 1486 HE22 GLN U 154 -18.312 32.057 13.814 1.00 0.00 H ATOM 1487 HE21 GLN U 154 -19.295 30.754 13.052 1.00 0.00 H ATOM 1488 H GLN U 154 -16.965 29.306 19.409 1.00 0.00 H ATOM 1489 N LEU U 155 -15.356 30.983 16.057 1.00 16.57 N ATOM 1490 CA LEU U 155 -14.207 31.855 15.840 1.00 15.89 C ATOM 1491 C LEU U 155 -14.479 33.252 16.373 1.00 15.79 C ATOM 1492 O LEU U 155 -15.614 33.734 16.318 1.00 15.34 O ATOM 1493 CB LEU U 155 -13.888 31.928 14.339 1.00 15.82 C ATOM 1494 CG LEU U 155 -12.579 32.583 13.899 1.00 15.74 C ATOM 1495 CD1 LEU U 155 -11.380 31.800 14.413 1.00 15.87 C ATOM 1496 CD2 LEU U 155 -12.557 32.679 12.376 1.00 16.18 C ATOM 1497 H LEU U 155 -15.805 30.535 15.233 1.00 0.00 H ATOM 1498 N LYS U 156 -13.440 33.898 16.893 1.00 15.32 N ATOM 1499 CA LYS U 156 -13.542 35.273 17.384 1.00 15.37 C ATOM 1500 C LYS U 156 -12.489 36.181 16.768 1.00 15.97 C ATOM 1501 O LYS U 156 -11.469 35.722 16.278 1.00 15.70 O ATOM 1502 CB LYS U 156 -13.393 35.313 18.904 1.00 15.45 C ATOM 1503 CG LYS U 156 -14.545 34.669 19.655 1.00 15.67 C ATOM 1504 CD LYS U 156 -14.387 34.833 21.161 1.00 15.95 C ATOM 1505 CE LYS U 156 -14.764 36.234 21.620 1.00 16.21 C ATOM 1506 NZ LYS U 156 -14.584 36.425 23.092 1.00 16.31 N ATOM 1507 HZ1 LYS U 156 -15.185 35.748 23.604 1.00 0.00 H ATOM 1508 HZ2 LYS U 156 -13.587 36.264 23.342 1.00 0.00 H ATOM 1509 HZ3 LYS U 156 -14.855 37.395 23.350 1.00 0.00 H ATOM 1510 H LYS U 156 -12.524 33.410 16.953 1.00 0.00 H ATOM 1511 N MET U 157 -12.760 37.478 16.804 1.00 16.78 N ATOM 1512 CA MET U 157 -11.750 38.473 16.491 1.00 18.12 C ATOM 1513 C MET U 157 -11.947 39.727 17.326 1.00 17.87 C ATOM 1514 O MET U 157 -13.011 39.946 17.902 1.00 17.59 O ATOM 1515 CB MET U 157 -11.725 38.785 14.988 1.00 20.62 C ATOM 1516 CG MET U 157 -13.005 39.352 14.424 1.00 22.95 C ATOM 1517 SD MET U 157 -12.743 39.841 12.709 1.00 28.21 S ATOM 1518 CE MET U 157 -14.408 40.263 12.258 1.00 28.50 C ATOM 1519 H MET U 157 -13.718 37.790 17.062 1.00 0.00 H ATOM 1520 N THR U 158 -10.892 40.518 17.434 1.00 17.27 N ATOM 1521 CA THR U 158 -10.962 41.791 18.133 1.00 17.32 C ATOM 1522 C THR U 158 -9.943 42.741 17.550 1.00 17.80 C ATOM 1523 O THR U 158 -9.225 42.385 16.611 1.00 17.35 O ATOM 1524 CB THR U 158 -10.778 41.626 19.665 1.00 17.56 C ATOM 1525 OG1 THR U 158 -11.223 42.814 20.328 1.00 17.65 O ATOM 1526 CG2 THR U 158 -9.338 41.331 20.047 1.00 17.36 C ATOM 1527 HG1 THR U 158 -11.106 42.709 21.305 1.00 0.00 H ATOM 1528 H THR U 158 -9.990 40.222 17.008 1.00 0.00 H ATOM 1529 N VAL U 159 -9.913 43.950 18.106 1.00 18.70 N ATOM 1530 CA VAL U 159 -8.984 45.000 17.705 1.00 19.43 C ATOM 1531 C VAL U 159 -8.078 45.324 18.877 1.00 19.50 C ATOM 1532 O VAL U 159 -8.536 45.422 20.009 1.00 19.52 O ATOM 1533 CB VAL U 159 -9.739 46.276 17.261 1.00 20.19 C ATOM 1534 CG1 VAL U 159 -8.806 47.484 17.157 1.00 20.79 C ATOM 1535 CG2 VAL U 159 -10.433 46.025 15.941 1.00 20.47 C ATOM 1536 H VAL U 159 -10.589 44.157 18.868 1.00 0.00 H ATOM 1537 N VAL U 160 -6.791 45.488 18.582 1.00 19.45 N ATOM 1538 CA VAL U 160 -5.807 45.992 19.534 1.00 20.00 C ATOM 1539 C VAL U 160 -4.962 47.055 18.835 1.00 20.54 C ATOM 1540 O VAL U 160 -4.910 47.090 17.602 1.00 21.09 O ATOM 1541 CB VAL U 160 -4.906 44.866 20.092 1.00 19.69 C ATOM 1542 CG1 VAL U 160 -5.706 43.968 21.029 1.00 19.98 C ATOM 1543 CG2 VAL U 160 -4.266 44.044 18.975 1.00 19.67 C ATOM 1544 H VAL U 160 -6.470 45.244 17.623 1.00 0.00 H ATOM 1545 N LYS U 161 -4.314 47.908 19.624 1.00 21.20 N ATOM 1546 CA LYS U 161 -3.459 48.974 19.095 1.00 21.85 C ATOM 1547 C LYS U 161 -1.986 48.663 19.308 1.00 21.65 C ATOM 1548 O LYS U 161 -1.587 48.224 20.385 1.00 20.96 O ATOM 1549 CB LYS U 161 -3.800 50.306 19.752 1.00 22.98 C ATOM 1550 CG LYS U 161 -5.182 50.805 19.382 1.00 25.02 C ATOM 1551 CD LYS U 161 -5.392 52.235 19.836 1.00 27.52 C ATOM 1552 CE LYS U 161 -6.733 52.752 19.355 1.00 29.79 C ATOM 1553 NZ LYS U 161 -6.869 54.213 19.583 1.00 31.38 N ATOM 1554 HZ1 LYS U 161 -6.785 54.413 20.600 1.00 0.00 H ATOM 1555 HZ2 LYS U 161 -6.119 54.715 19.066 1.00 0.00 H ATOM 1556 HZ3 LYS U 161 -7.799 54.531 19.242 1.00 0.00 H ATOM 1557 H LYS U 161 -4.418 47.815 20.655 1.00 0.00 H ATOM 1558 N LEU U 162 -1.188 48.918 18.274 1.00 22.88 N ATOM 1559 CA LEU U 162 0.259 48.705 18.318 1.00 24.06 C ATOM 1560 C LEU U 162 0.927 49.608 19.359 1.00 24.72 C ATOM 1561 O LEU U 162 0.598 50.793 19.470 1.00 24.93 O ATOM 1562 CB LEU U 162 0.887 48.940 16.934 1.00 24.59 C ATOM 1563 CG LEU U 162 1.046 47.755 15.973 1.00 26.34 C ATOM 1564 CD1 LEU U 162 -0.082 46.738 16.050 1.00 26.62 C ATOM 1565 CD2 LEU U 162 1.228 48.257 14.547 1.00 26.25 C ATOM 1566 H LEU U 162 -1.611 49.284 17.397 1.00 0.00 H ATOM 1567 N ILE U 163 1.851 49.028 20.117 1.00 25.83 N ATOM 1568 CA ILE U 163 2.589 49.727 21.167 1.00 27.48 C ATOM 1569 C ILE U 163 4.041 49.838 20.705 1.00 29.07 C ATOM 1570 O ILE U 163 4.580 48.900 20.117 1.00 27.74 O ATOM 1571 CB ILE U 163 2.487 48.971 22.514 1.00 28.25 C ATOM 1572 CG1 ILE U 163 1.058 49.068 23.065 1.00 29.09 C ATOM 1573 CG2 ILE U 163 3.465 49.533 23.541 1.00 28.77 C ATOM 1574 CD1 ILE U 163 0.717 48.019 24.101 1.00 29.29 C ATOM 1575 H ILE U 163 2.060 48.022 19.954 1.00 0.00 H ATOM 1576 N SER U 164 4.689 50.959 20.975 1.00 31.03 N ATOM 1577 CA SER U 164 6.063 51.141 20.548 1.00 32.78 C ATOM 1578 C SER U 164 7.026 50.274 21.306 1.00 34.28 C ATOM 1579 O SER U 164 6.813 49.988 22.448 1.00 33.63 O ATOM 1580 CB SER U 164 6.480 52.585 20.709 1.00 33.15 C ATOM 1581 OG SER U 164 6.761 52.862 22.026 1.00 33.82 O ATOM 1582 HG SER U 164 7.032 53.810 22.112 1.00 0.00 H ATOM 1583 H SER U 164 4.208 51.718 21.499 1.00 0.00 H ATOM 1584 N HIS U 165 8.147 49.970 20.686 1.00 36.40 N ATOM 1585 CA HIS U 165 9.158 49.201 21.358 1.00 38.76 C ATOM 1586 C HIS U 165 9.620 49.894 22.615 1.00 38.99 C ATOM 1587 O HIS U 165 9.818 49.245 23.584 1.00 36.18 O ATOM 1588 CB HIS U 165 10.319 48.888 20.428 1.00 41.19 C ATOM 1589 CG HIS U 165 11.380 48.025 21.047 1.00 44.01 C ATOM 1590 ND1 HIS U 165 11.178 46.709 21.371 1.00 45.06 N ATOM 1591 CD2 HIS U 165 12.655 48.301 21.403 1.00 44.83 C ATOM 1592 CE1 HIS U 165 12.268 46.213 21.918 1.00 45.98 C ATOM 1593 NE2 HIS U 165 13.187 47.155 21.933 1.00 46.28 N ATOM 1594 H HIS U 165 8.301 50.287 19.708 1.00 0.00 H ATOM 1595 N ARG U 166 9.746 51.195 22.557 1.00 40.32 N ATOM 1596 CA ARG U 166 10.111 51.931 23.721 1.00 42.48 C ATOM 1597 C ARG U 166 9.147 51.751 24.868 1.00 40.66 C ATOM 1598 O ARG U 166 9.559 51.542 25.956 1.00 40.46 O ATOM 1599 CB ARG U 166 10.317 53.403 23.359 1.00 46.26 C ATOM 1600 CG ARG U 166 9.999 54.439 24.438 1.00 49.54 C ATOM 1601 CD ARG U 166 10.939 55.633 24.402 1.00 52.17 C ATOM 1602 NE ARG U 166 11.899 55.393 25.465 1.00 54.42 N ATOM 1603 CZ ARG U 166 13.157 55.792 25.513 1.00 55.86 C ATOM 1604 NH1 ARG U 166 13.715 56.558 24.572 1.00 57.17 N ATOM 1605 NH2 ARG U 166 13.844 55.418 26.557 1.00 56.57 N ATOM 1606 HE ARG U 166 11.557 54.845 26.280 1.00 0.00 H ATOM 1607 HH12 ARG U 166 14.711 56.845 24.658 1.00 0.00 H ATOM 1608 HH11 ARG U 166 13.153 56.868 23.753 1.00 0.00 H ATOM 1609 HH22 ARG U 166 14.840 55.701 26.652 1.00 0.00 H ATOM 1610 HH21 ARG U 166 13.395 54.837 27.294 1.00 0.00 H ATOM 1611 H ARG U 166 9.579 51.693 21.659 1.00 0.00 H ATOM 1612 N GLU U 167 7.852 51.846 24.618 1.00 38.86 N ATOM 1613 CA GLU U 167 6.866 51.691 25.689 1.00 37.47 C ATOM 1614 C GLU U 167 6.819 50.249 26.211 1.00 35.63 C ATOM 1615 O GLU U 167 6.734 50.033 27.423 1.00 34.98 O ATOM 1616 CB GLU U 167 5.479 52.130 25.214 1.00 38.17 C ATOM 1617 CG GLU U 167 4.440 52.228 26.325 1.00 39.26 C ATOM 1618 CD GLU U 167 3.028 52.437 25.809 1.00 40.74 C ATOM 1619 OE1 GLU U 167 2.858 53.045 24.731 1.00 42.33 O ATOM 1620 OE2 GLU U 167 2.080 51.994 26.492 1.00 41.20 O ATOM 1621 H GLU U 167 7.529 52.033 23.647 1.00 0.00 H ATOM 1622 N CYS U 168 6.885 49.274 25.304 1.00 33.49 N ATOM 1623 CA CYS U 168 6.820 47.862 25.698 1.00 32.50 C ATOM 1624 C CYS U 168 8.079 47.406 26.442 1.00 33.96 C ATOM 1625 O CYS U 168 8.022 46.491 27.266 1.00 32.38 O ATOM 1626 CB CYS U 168 6.559 46.956 24.492 1.00 31.77 C ATOM 1627 SG CYS U 168 5.649 45.475 24.981 1.00 30.06 S ATOM 1628 H CYS U 168 6.984 49.519 24.298 1.00 0.00 H ATOM 1629 N GLN U 169 9.192 48.075 26.140 1.00 35.72 N ATOM 1630 CA GLN U 169 10.494 47.879 26.785 1.00 37.74 C ATOM 1631 C GLN U 169 10.563 48.377 28.240 1.00 38.26 C ATOM 1632 O GLN U 169 11.494 48.016 28.959 1.00 37.01 O ATOM 1633 CB GLN U 169 11.556 48.599 25.938 1.00 39.43 C ATOM 1634 CG GLN U 169 13.015 48.383 26.279 1.00 40.91 C ATOM 1635 CD GLN U 169 13.912 49.052 25.258 1.00 41.29 C ATOM 1636 OE1 GLN U 169 13.884 50.274 25.101 1.00 42.38 O ATOM 1637 NE2 GLN U 169 14.695 48.255 24.540 1.00 42.56 N ATOM 1638 HE22 GLN U 169 14.686 47.229 24.707 1.00 0.00 H ATOM 1639 HE21 GLN U 169 15.318 48.657 23.811 1.00 0.00 H ATOM 1640 H GLN U 169 9.132 48.792 25.389 1.00 0.00 H ATOM 1641 N GLN U 170 9.596 49.196 28.649 1.00 38.48 N ATOM 1642 CA GLN U 170 9.579 49.708 30.016 1.00 39.59 C ATOM 1643 C GLN U 170 9.463 48.588 31.019 1.00 40.00 C ATOM 1644 O GLN U 170 8.877 47.579 30.745 1.00 37.97 O ATOM 1645 CB GLN U 170 8.477 50.730 30.257 1.00 40.06 C ATOM 1646 CG GLN U 170 8.545 51.900 29.334 1.00 41.12 C ATOM 1647 CD GLN U 170 9.748 52.792 29.616 1.00 42.70 C ATOM 1648 OE1 GLN U 170 10.645 52.940 28.793 1.00 43.81 O ATOM 1649 NE2 GLN U 170 9.752 53.390 30.775 1.00 43.00 N ATOM 1650 HE22 GLN U 170 8.970 53.235 31.443 1.00 0.00 H ATOM 1651 HE21 GLN U 170 10.537 54.022 31.032 1.00 0.00 H ATOM 1652 H GLN U 170 8.844 49.474 27.987 1.00 0.00 H ATOM 1653 N PRO U 170A 10.133 48.817 32.226 1.00 40.49 N ATOM 1654 CA PRO U 170A 10.056 47.693 33.164 1.00 41.28 C ATOM 1655 C PRO U 170A 8.671 47.297 33.655 1.00 41.09 C ATOM 1656 O PRO U 170A 8.507 46.132 33.925 1.00 40.22 O ATOM 1657 CB PRO U 170A 10.973 48.074 34.316 1.00 41.88 C ATOM 1658 CG PRO U 170A 11.122 49.512 34.254 1.00 42.02 C ATOM 1659 CD PRO U 170A 11.162 49.815 32.826 1.00 41.62 C ATOM 1660 N HIS U 170B 7.762 48.234 33.840 1.00 40.74 N ATOM 1661 CA HIS U 170B 6.412 47.904 34.292 1.00 41.45 C ATOM 1662 C HIS U 170B 5.625 47.091 33.243 1.00 38.99 C ATOM 1663 O HIS U 170B 4.624 46.500 33.570 1.00 38.63 O ATOM 1664 CB HIS U 170B 5.610 49.132 34.685 1.00 44.56 C ATOM 1665 CG HIS U 170B 5.623 49.432 36.162 1.00 47.57 C ATOM 1666 ND1 HIS U 170B 5.636 48.453 37.129 1.00 49.25 N ATOM 1667 CD2 HIS U 170B 5.612 50.612 36.825 1.00 49.21 C ATOM 1668 CE1 HIS U 170B 5.652 49.016 38.323 1.00 49.52 C ATOM 1669 NE2 HIS U 170B 5.641 50.326 38.163 1.00 50.02 N ATOM 1670 H HIS U 170B 8.011 49.228 33.661 1.00 0.00 H ATOM 1671 N TYR U 171 6.081 47.131 32.000 1.00 35.78 N ATOM 1672 CA TYR U 171 5.550 46.332 30.912 1.00 33.46 C ATOM 1673 C TYR U 171 6.405 45.068 30.848 1.00 31.69 C ATOM 1674 O TYR U 171 6.255 44.233 31.687 1.00 30.59 O ATOM 1675 CB TYR U 171 5.540 47.107 29.619 1.00 33.91 C ATOM 1676 CG TYR U 171 4.374 48.052 29.425 1.00 34.10 C ATOM 1677 CD1 TYR U 171 3.958 48.871 30.408 1.00 34.89 C ATOM 1678 CD2 TYR U 171 3.720 48.118 28.243 1.00 35.10 C ATOM 1679 CE1 TYR U 171 2.893 49.728 30.214 1.00 35.34 C ATOM 1680 CE2 TYR U 171 2.656 48.973 28.034 1.00 35.54 C ATOM 1681 CZ TYR U 171 2.244 49.779 29.021 1.00 35.34 C ATOM 1682 OH TYR U 171 1.188 50.647 28.825 1.00 35.23 O ATOM 1683 HH TYR U 171 1.408 51.271 28.089 1.00 0.00 H ATOM 1684 H TYR U 171 6.870 47.776 31.791 1.00 0.00 H ATOM 1685 N TYR U 172 7.267 44.925 29.859 1.00 30.00 N ATOM 1686 CA TYR U 172 8.033 43.706 29.718 1.00 30.35 C ATOM 1687 C TYR U 172 9.567 43.738 29.855 1.00 31.74 C ATOM 1688 O TYR U 172 10.204 42.742 29.697 1.00 31.19 O ATOM 1689 CB TYR U 172 7.663 42.992 28.431 1.00 29.44 C ATOM 1690 CG TYR U 172 6.273 42.365 28.427 1.00 28.20 C ATOM 1691 CD1 TYR U 172 5.883 41.502 29.400 1.00 27.95 C ATOM 1692 CD2 TYR U 172 5.360 42.643 27.428 1.00 27.51 C ATOM 1693 CE1 TYR U 172 4.635 40.932 29.401 1.00 27.15 C ATOM 1694 CE2 TYR U 172 4.123 42.052 27.420 1.00 26.70 C ATOM 1695 CZ TYR U 172 3.767 41.209 28.417 1.00 26.45 C ATOM 1696 OH TYR U 172 2.548 40.627 28.431 1.00 25.20 O ATOM 1697 HH TYR U 172 2.435 40.080 27.614 1.00 0.00 H ATOM 1698 H TYR U 172 7.397 45.697 29.174 1.00 0.00 H ATOM 1699 N GLY U 173 10.139 44.890 30.130 1.00 34.27 N ATOM 1700 CA GLY U 173 11.596 45.032 30.230 1.00 35.65 C ATOM 1701 C GLY U 173 12.295 44.618 28.946 1.00 36.73 C ATOM 1702 O GLY U 173 11.846 44.964 27.856 1.00 37.85 O ATOM 1703 H GLY U 173 9.540 45.726 30.281 1.00 0.00 H ATOM 1704 N SER U 174 13.373 43.844 29.076 1.00 38.27 N ATOM 1705 CA SER U 174 14.119 43.333 27.917 1.00 38.84 C ATOM 1706 C SER U 174 13.613 41.989 27.371 1.00 38.76 C ATOM 1707 O SER U 174 14.217 41.444 26.443 1.00 37.65 O ATOM 1708 CB SER U 174 15.606 43.228 28.257 1.00 39.89 C ATOM 1709 OG SER U 174 16.140 44.516 28.531 1.00 41.37 O ATOM 1710 HG SER U 174 17.102 44.433 28.749 1.00 0.00 H ATOM 1711 H SER U 174 13.698 43.593 30.032 1.00 0.00 H ATOM 1712 N GLU U 175 12.515 41.461 27.925 1.00 39.20 N ATOM 1713 CA GLU U 175 11.844 40.278 27.352 1.00 38.85 C ATOM 1714 C GLU U 175 11.412 40.521 25.897 1.00 37.37 C ATOM 1715 O GLU U 175 11.433 39.598 25.078 1.00 36.02 O ATOM 1716 CB GLU U 175 10.628 39.866 28.195 1.00 41.03 C ATOM 1717 CG GLU U 175 10.966 39.342 29.586 1.00 43.15 C ATOM 1718 CD GLU U 175 9.749 39.188 30.486 1.00 45.83 C ATOM 1719 OE1 GLU U 175 9.575 38.099 31.071 1.00 48.10 O ATOM 1720 OE2 GLU U 175 8.967 40.153 30.621 1.00 48.63 O ATOM 1721 H GLU U 175 12.123 41.897 28.784 1.00 0.00 H ATOM 1722 N VAL U 176 11.031 41.764 25.590 1.00 35.31 N ATOM 1723 CA VAL U 176 10.653 42.163 24.230 1.00 34.89 C ATOM 1724 C VAL U 176 11.874 42.629 23.424 1.00 34.41 C ATOM 1725 O VAL U 176 12.621 43.505 23.863 1.00 34.14 O ATOM 1726 CB VAL U 176 9.511 43.226 24.209 1.00 34.78 C ATOM 1727 CG1 VAL U 176 9.792 44.413 25.130 1.00 35.03 C ATOM 1728 CG2 VAL U 176 9.222 43.697 22.784 1.00 34.92 C ATOM 1729 H VAL U 176 11.001 42.478 26.346 1.00 0.00 H ATOM 1730 N THR U 177 12.058 42.030 22.248 1.00 34.39 N ATOM 1731 CA THR U 177 13.125 42.397 21.313 1.00 34.19 C ATOM 1732 C THR U 177 12.547 43.180 20.135 1.00 34.11 C ATOM 1733 O THR U 177 11.329 43.325 20.019 1.00 33.08 O ATOM 1734 CB THR U 177 13.845 41.141 20.786 1.00 34.82 C ATOM 1735 OG1 THR U 177 12.959 40.377 19.954 1.00 34.38 O ATOM 1736 CG2 THR U 177 14.328 40.274 21.949 1.00 35.12 C ATOM 1737 HG1 THR U 177 13.432 39.573 19.621 1.00 0.00 H ATOM 1738 H THR U 177 11.410 41.262 21.980 1.00 0.00 H ATOM 1739 N THR U 178 13.421 43.672 19.257 1.00 33.32 N ATOM 1740 CA THR U 178 12.992 44.371 18.036 1.00 33.70 C ATOM 1741 C THR U 178 12.392 43.454 16.956 1.00 32.32 C ATOM 1742 O THR U 178 11.831 43.950 15.977 1.00 32.85 O ATOM 1743 CB THR U 178 14.148 45.173 17.408 1.00 34.90 C ATOM 1744 OG1 THR U 178 15.280 44.315 17.225 1.00 36.02 O ATOM 1745 CG2 THR U 178 14.526 46.343 18.298 1.00 35.77 C ATOM 1746 HG1 THR U 178 15.032 43.567 16.625 1.00 0.00 H ATOM 1747 H THR U 178 14.438 43.558 19.441 1.00 0.00 H ATOM 1748 N LYS U 179 12.520 42.135 17.123 1.00 31.38 N ATOM 1749 CA LYS U 179 11.819 41.163 16.276 1.00 31.05 C ATOM 1750 C LYS U 179 10.436 40.770 16.831 1.00 28.83 C ATOM 1751 O LYS U 179 9.796 39.865 16.297 1.00 27.26 O ATOM 1752 CB LYS U 179 12.704 39.932 16.040 1.00 32.78 C ATOM 1753 CG LYS U 179 13.835 40.222 15.061 1.00 34.22 C ATOM 1754 CD LYS U 179 15.070 39.377 15.301 1.00 36.57 C ATOM 1755 CE LYS U 179 14.766 37.895 15.260 1.00 37.95 C ATOM 1756 NZ LYS U 179 15.939 37.086 14.818 1.00 39.61 N ATOM 1757 HZ1 LYS U 179 16.223 37.383 13.863 1.00 0.00 H ATOM 1758 HZ2 LYS U 179 16.729 37.234 15.478 1.00 0.00 H ATOM 1759 HZ3 LYS U 179 15.680 36.079 14.807 1.00 0.00 H ATOM 1760 H LYS U 179 13.139 41.784 17.881 1.00 0.00 H ATOM 1761 N MET U 180 9.987 41.454 17.886 1.00 27.65 N ATOM 1762 CA MET U 180 8.646 41.283 18.449 1.00 27.42 C ATOM 1763 C MET U 180 7.869 42.594 18.379 1.00 27.20 C ATOM 1764 O MET U 180 8.463 43.675 18.410 1.00 27.96 O ATOM 1765 CB MET U 180 8.742 40.866 19.908 1.00 27.41 C ATOM 1766 CG MET U 180 9.448 39.547 20.151 1.00 27.30 C ATOM 1767 SD MET U 180 9.706 39.299 21.913 1.00 27.64 S ATOM 1768 CE MET U 180 10.789 37.876 21.929 1.00 27.24 C ATOM 1769 H MET U 180 10.624 42.145 18.332 1.00 0.00 H ATOM 1770 N LEU U 181 6.542 42.489 18.294 1.00 26.22 N ATOM 1771 CA LEU U 181 5.640 43.647 18.331 1.00 26.31 C ATOM 1772 C LEU U 181 4.696 43.472 19.498 1.00 24.61 C ATOM 1773 O LEU U 181 4.185 42.378 19.709 1.00 23.98 O ATOM 1774 CB LEU U 181 4.796 43.733 17.059 1.00 27.66 C ATOM 1775 CG LEU U 181 5.501 44.028 15.742 1.00 29.62 C ATOM 1776 CD1 LEU U 181 4.512 43.944 14.588 1.00 30.47 C ATOM 1777 CD2 LEU U 181 6.179 45.388 15.775 1.00 30.58 C ATOM 1778 H LEU U 181 6.126 41.541 18.197 1.00 0.00 H ATOM 1779 N CYS U 182 4.456 44.547 20.239 1.00 24.08 N ATOM 1780 CA CYS U 182 3.456 44.548 21.300 1.00 23.77 C ATOM 1781 C CYS U 182 2.176 45.205 20.810 1.00 22.31 C ATOM 1782 O CYS U 182 2.213 46.119 19.991 1.00 22.05 O ATOM 1783 CB CYS U 182 3.983 45.277 22.521 1.00 25.07 C ATOM 1784 SG CYS U 182 5.396 44.442 23.269 1.00 27.12 S ATOM 1785 H CYS U 182 4.998 45.416 20.057 1.00 0.00 H ATOM 1786 N ALA U 183 1.040 44.728 21.305 1.00 21.25 N ATOM 1787 CA ALA U 183 -0.249 45.340 20.982 1.00 20.87 C ATOM 1788 C ALA U 183 -1.224 45.115 22.122 1.00 20.90 C ATOM 1789 O ALA U 183 -1.193 44.064 22.770 1.00 20.71 O ATOM 1790 CB ALA U 183 -0.797 44.776 19.685 1.00 21.18 C ATOM 1791 H ALA U 183 1.067 43.902 21.936 1.00 0.00 H ATOM 1792 N ALA U 184 -2.068 46.110 22.386 1.00 20.33 N ATOM 1793 CA ALA U 184 -3.039 46.016 23.481 1.00 20.21 C ATOM 1794 C ALA U 184 -4.189 46.995 23.333 1.00 20.58 C ATOM 1795 O ALA U 184 -4.165 47.901 22.495 1.00 19.64 O ATOM 1796 CB ALA U 184 -2.350 46.225 24.821 1.00 20.49 C ATOM 1797 H ALA U 184 -2.038 46.971 21.804 1.00 0.00 H ATOM 1798 N ASP U 185 -5.208 46.784 24.160 1.00 21.08 N ATOM 1799 CA ASP U 185 -6.347 47.689 24.248 1.00 22.08 C ATOM 1800 C ASP U 185 -5.992 48.807 25.235 1.00 22.66 C ATOM 1801 O ASP U 185 -5.383 48.521 26.267 1.00 22.50 O ATOM 1802 CB ASP U 185 -7.567 46.913 24.744 1.00 21.96 C ATOM 1803 CG ASP U 185 -8.817 47.771 24.820 1.00 22.46 C ATOM 1804 OD1 ASP U 185 -9.464 48.000 23.786 1.00 23.31 O ATOM 1805 OD2 ASP U 185 -9.152 48.218 25.931 1.00 22.78 O ATOM 1806 H ASP U 185 -5.192 45.940 24.768 1.00 0.00 H ATOM 1807 N PRO U 185A -6.390 50.071 24.951 1.00 24.36 N ATOM 1808 CA PRO U 185A -6.159 51.161 25.920 1.00 25.27 C ATOM 1809 C PRO U 185A -6.745 50.922 27.322 1.00 25.82 C ATOM 1810 O PRO U 185A -6.170 51.386 28.309 1.00 27.05 O ATOM 1811 CB PRO U 185A -6.841 52.367 25.263 1.00 25.50 C ATOM 1812 CG PRO U 185A -6.811 52.071 23.807 1.00 25.37 C ATOM 1813 CD PRO U 185A -6.967 50.581 23.693 1.00 24.70 C ATOM 1814 N GLN U 185B -7.868 50.205 27.394 1.00 26.38 N ATOM 1815 CA GLN U 185B -8.468 49.771 28.665 1.00 26.70 C ATOM 1816 C GLN U 185B -8.035 48.375 29.150 1.00 26.03 C ATOM 1817 O GLN U 185B -8.499 47.925 30.201 1.00 25.40 O ATOM 1818 CB GLN U 185B -10.002 49.824 28.554 1.00 28.37 C ATOM 1819 CG GLN U 185B -10.561 51.230 28.407 1.00 30.59 C ATOM 1820 CD GLN U 185B -10.540 51.991 29.717 1.00 32.47 C ATOM 1821 OE1 GLN U 185B -11.009 51.490 30.738 1.00 32.46 O ATOM 1822 NE2 GLN U 185B -9.972 53.196 29.702 1.00 35.63 N ATOM 1823 HE22 GLN U 185B -9.589 53.579 28.814 1.00 0.00 H ATOM 1824 HE21 GLN U 185B -9.912 53.753 30.578 1.00 0.00 H ATOM 1825 H GLN U 185B -8.343 49.940 26.507 1.00 0.00 H ATOM 1826 N TRP U 186 -7.150 47.706 28.406 1.00 25.24 N ATOM 1827 CA TRP U 186 -6.742 46.309 28.674 1.00 25.08 C ATOM 1828 C TRP U 186 -7.930 45.332 28.702 1.00 24.77 C ATOM 1829 O TRP U 186 -7.880 44.284 29.346 1.00 24.81 O ATOM 1830 CB TRP U 186 -5.911 46.226 29.966 1.00 25.57 C ATOM 1831 CG TRP U 186 -4.874 47.301 30.032 1.00 26.21 C ATOM 1832 CD1 TRP U 186 -4.977 48.498 30.680 1.00 26.82 C ATOM 1833 CD2 TRP U 186 -3.585 47.294 29.404 1.00 26.29 C ATOM 1834 NE1 TRP U 186 -3.834 49.234 30.501 1.00 27.31 N ATOM 1835 CE2 TRP U 186 -2.961 48.519 29.723 1.00 26.84 C ATOM 1836 CE3 TRP U 186 -2.895 46.369 28.609 1.00 25.77 C ATOM 1837 CZ2 TRP U 186 -1.676 48.848 29.270 1.00 26.68 C ATOM 1838 CZ3 TRP U 186 -1.613 46.694 28.160 1.00 25.93 C ATOM 1839 CH2 TRP U 186 -1.019 47.922 28.498 1.00 26.35 C ATOM 1840 HE1 TRP U 186 -3.658 50.181 30.892 1.00 0.00 H ATOM 1841 H TRP U 186 -6.724 48.194 27.593 1.00 0.00 H ATOM 1842 N LYS U 187 -8.960 45.681 27.936 1.00 23.98 N ATOM 1843 CA LYS U 187 -10.293 45.066 27.960 1.00 25.53 C ATOM 1844 C LYS U 187 -10.390 43.843 27.044 1.00 22.90 C ATOM 1845 O LYS U 187 -11.253 42.978 27.236 1.00 22.43 O ATOM 1846 CB LYS U 187 -11.288 46.152 27.496 1.00 28.50 C ATOM 1847 CG LYS U 187 -12.747 45.788 27.296 1.00 33.37 C ATOM 1848 CD LYS U 187 -13.471 46.974 26.667 1.00 35.63 C ATOM 1849 CE LYS U 187 -14.861 46.619 26.151 1.00 37.94 C ATOM 1850 NZ LYS U 187 -15.787 46.092 27.189 1.00 38.63 N ATOM 1851 HZ1 LYS U 187 -15.386 45.226 27.602 1.00 0.00 H ATOM 1852 HZ2 LYS U 187 -15.913 46.806 27.934 1.00 0.00 H ATOM 1853 HZ3 LYS U 187 -16.707 45.877 26.754 1.00 0.00 H ATOM 1854 H LYS U 187 -8.808 46.457 27.261 1.00 0.00 H ATOM 1855 N THR U 188 -9.522 43.790 26.035 1.00 20.64 N ATOM 1856 CA THR U 188 -9.582 42.777 24.991 1.00 19.48 C ATOM 1857 C THR U 188 -8.154 42.423 24.572 1.00 18.72 C ATOM 1858 O THR U 188 -7.268 43.275 24.624 1.00 18.21 O ATOM 1859 CB THR U 188 -10.446 43.271 23.799 1.00 19.40 C ATOM 1860 OG1 THR U 188 -10.609 42.225 22.841 1.00 19.13 O ATOM 1861 CG2 THR U 188 -9.836 44.498 23.117 1.00 19.11 C ATOM 1862 HG1 THR U 188 -11.161 42.553 22.087 1.00 0.00 H ATOM 1863 H THR U 188 -8.767 44.504 25.991 1.00 0.00 H ATOM 1864 N ASP U 189 -7.931 41.170 24.185 1.00 17.92 N ATOM 1865 CA ASP U 189 -6.582 40.640 23.993 1.00 17.74 C ATOM 1866 C ASP U 189 -6.627 39.251 23.358 1.00 17.43 C ATOM 1867 O ASP U 189 -7.674 38.607 23.322 1.00 17.13 O ATOM 1868 CB ASP U 189 -5.882 40.527 25.362 1.00 17.60 C ATOM 1869 CG ASP U 189 -4.364 40.564 25.280 1.00 18.38 C ATOM 1870 OD1 ASP U 189 -3.785 40.554 24.177 1.00 18.02 O ATOM 1871 OD2 ASP U 189 -3.751 40.581 26.366 1.00 18.49 O ATOM 1872 H ASP U 189 -8.745 40.546 24.013 1.00 0.00 H ATOM 1873 N SER U 190 -5.476 38.790 22.881 1.00 16.71 N ATOM 1874 CA SER U 190 -5.279 37.376 22.575 1.00 17.17 C ATOM 1875 C SER U 190 -5.044 36.597 23.881 1.00 17.08 C ATOM 1876 O SER U 190 -4.807 37.188 24.936 1.00 16.87 O ATOM 1877 CB SER U 190 -4.112 37.193 21.608 1.00 17.40 C ATOM 1878 OG SER U 190 -2.970 37.891 22.064 1.00 17.84 O ATOM 1879 HG SER U 190 -2.227 37.759 21.424 1.00 0.00 H ATOM 1880 H SER U 190 -4.693 39.455 22.721 1.00 0.00 H ATOM 1881 N CYS U 191 -5.150 35.275 23.803 1.00 17.84 N ATOM 1882 CA CYS U 191 -4.922 34.407 24.958 1.00 18.16 C ATOM 1883 C CYS U 191 -4.481 33.016 24.512 1.00 18.30 C ATOM 1884 O CYS U 191 -4.284 32.778 23.322 1.00 17.40 O ATOM 1885 CB CYS U 191 -6.202 34.339 25.820 1.00 18.84 C ATOM 1886 SG CYS U 191 -5.933 33.854 27.547 1.00 20.70 S ATOM 1887 H CYS U 191 -5.403 34.843 22.891 1.00 0.00 H ATOM 1888 N GLN U 192 -4.291 32.111 25.474 1.00 18.57 N ATOM 1889 CA GLN U 192 -3.963 30.708 25.185 1.00 19.74 C ATOM 1890 C GLN U 192 -4.906 30.122 24.144 1.00 18.43 C ATOM 1891 O GLN U 192 -6.120 30.282 24.252 1.00 18.31 O ATOM 1892 CB GLN U 192 -4.028 29.879 26.465 1.00 21.85 C ATOM 1893 CG GLN U 192 -3.861 28.376 26.295 1.00 24.24 C ATOM 1894 CD GLN U 192 -3.808 27.648 27.625 1.00 26.68 C ATOM 1895 OE1 GLN U 192 -3.751 28.265 28.685 1.00 30.37 O ATOM 1896 NE2 GLN U 192 -3.839 26.327 27.571 1.00 29.46 N ATOM 1897 HE22 GLN U 192 -3.887 25.845 26.651 1.00 0.00 H ATOM 1898 HE21 GLN U 192 -3.815 25.770 28.449 1.00 0.00 H ATOM 1899 H GLN U 192 -4.378 32.410 26.466 1.00 0.00 H ATOM 1900 N GLY U 193 -4.329 29.463 23.142 1.00 16.89 N ATOM 1901 CA GLY U 193 -5.075 28.946 21.999 1.00 16.45 C ATOM 1902 C GLY U 193 -5.114 29.878 20.794 1.00 15.90 C ATOM 1903 O GLY U 193 -5.364 29.421 19.683 1.00 15.57 O ATOM 1904 H GLY U 193 -3.301 29.310 23.175 1.00 0.00 H ATOM 1905 N ASP U 194 -4.869 31.172 20.995 1.00 15.34 N ATOM 1906 CA ASP U 194 -4.714 32.111 19.871 1.00 15.34 C ATOM 1907 C ASP U 194 -3.317 32.112 19.246 1.00 15.13 C ATOM 1908 O ASP U 194 -3.141 32.671 18.163 1.00 14.64 O ATOM 1909 CB ASP U 194 -5.056 33.540 20.298 1.00 15.54 C ATOM 1910 CG ASP U 194 -6.517 33.709 20.646 1.00 15.75 C ATOM 1911 OD1 ASP U 194 -7.368 33.159 19.919 1.00 16.17 O ATOM 1912 OD2 ASP U 194 -6.820 34.390 21.657 1.00 15.85 O ATOM 1913 H ASP U 194 -4.785 31.528 21.969 1.00 0.00 H ATOM 1914 N SER U 195 -2.336 31.520 19.930 1.00 15.22 N ATOM 1915 CA SER U 195 -0.959 31.416 19.430 1.00 15.37 C ATOM 1916 C SER U 195 -0.905 30.952 17.983 1.00 14.82 C ATOM 1917 O SER U 195 -1.692 30.098 17.569 1.00 14.86 O ATOM 1918 CB SER U 195 -0.157 30.438 20.293 1.00 15.80 C ATOM 1919 OG SER U 195 0.006 30.932 21.614 1.00 16.10 O ATOM 1920 HG SER U 195 0.527 30.280 22.147 1.00 0.00 H ATOM 1921 H SER U 195 -2.557 31.113 20.861 1.00 0.00 H ATOM 1922 N GLY U 196 0.009 31.540 17.215 1.00 14.56 N ATOM 1923 CA GLY U 196 0.191 31.196 15.809 1.00 14.69 C ATOM 1924 C GLY U 196 -0.707 31.946 14.842 1.00 14.97 C ATOM 1925 O GLY U 196 -0.424 31.982 13.644 1.00 15.13 O ATOM 1926 H GLY U 196 0.617 32.273 17.633 1.00 0.00 H ATOM 1927 N GLY U 197 -1.786 32.548 15.344 1.00 15.03 N ATOM 1928 CA GLY U 197 -2.762 33.208 14.490 1.00 15.19 C ATOM 1929 C GLY U 197 -2.352 34.613 14.094 1.00 15.52 C ATOM 1930 O GLY U 197 -1.334 35.125 14.562 1.00 15.41 O ATOM 1931 H GLY U 197 -1.934 32.546 16.373 1.00 0.00 H ATOM 1932 N PRO U 198 -3.162 35.254 13.236 1.00 15.76 N ATOM 1933 CA PRO U 198 -2.784 36.509 12.593 1.00 16.03 C ATOM 1934 C PRO U 198 -3.045 37.779 13.392 1.00 16.63 C ATOM 1935 O PRO U 198 -4.094 37.923 14.011 1.00 17.56 O ATOM 1936 CB PRO U 198 -3.657 36.518 11.332 1.00 15.72 C ATOM 1937 CG PRO U 198 -4.869 35.767 11.725 1.00 15.44 C ATOM 1938 CD PRO U 198 -4.371 34.675 12.627 1.00 15.60 C ATOM 1939 N LEU U 199 -2.076 38.687 13.359 1.00 17.46 N ATOM 1940 CA LEU U 199 -2.290 40.092 13.663 1.00 18.63 C ATOM 1941 C LEU U 199 -2.252 40.788 12.303 1.00 19.24 C ATOM 1942 O LEU U 199 -1.224 40.772 11.623 1.00 18.35 O ATOM 1943 CB LEU U 199 -1.211 40.629 14.608 1.00 19.37 C ATOM 1944 CG LEU U 199 -1.196 42.136 14.923 1.00 20.51 C ATOM 1945 CD1 LEU U 199 -2.199 42.503 16.001 1.00 21.25 C ATOM 1946 CD2 LEU U 199 0.191 42.598 15.340 1.00 20.93 C ATOM 1947 H LEU U 199 -1.117 38.377 13.103 1.00 0.00 H ATOM 1948 N VAL U 200 -3.386 41.359 11.891 1.00 19.81 N ATOM 1949 CA VAL U 200 -3.535 41.949 10.555 1.00 20.78 C ATOM 1950 C VAL U 200 -3.725 43.461 10.658 1.00 21.74 C ATOM 1951 O VAL U 200 -4.606 43.937 11.377 1.00 21.09 O ATOM 1952 CB VAL U 200 -4.707 41.305 9.783 1.00 20.64 C ATOM 1953 CG1 VAL U 200 -5.049 42.080 8.508 1.00 21.16 C ATOM 1954 CG2 VAL U 200 -4.373 39.863 9.440 1.00 20.84 C ATOM 1955 H VAL U 200 -4.196 41.387 12.542 1.00 0.00 H ATOM 1956 N CYS U 201 -2.911 44.207 9.910 1.00 22.98 N ATOM 1957 CA CYS U 201 -3.030 45.664 9.830 1.00 24.34 C ATOM 1958 C CYS U 201 -3.239 46.075 8.377 1.00 25.87 C ATOM 1959 O CYS U 201 -2.836 45.361 7.453 1.00 25.13 O ATOM 1960 CB CYS U 201 -1.785 46.345 10.400 1.00 24.48 C ATOM 1961 SG CYS U 201 -1.263 45.746 12.022 1.00 24.92 S ATOM 1962 H CYS U 201 -2.163 43.736 9.362 1.00 0.00 H ATOM 1963 N SER U 202 -3.897 47.216 8.184 1.00 28.24 N ATOM 1964 CA SER U 202 -4.113 47.767 6.854 1.00 31.51 C ATOM 1965 C SER U 202 -2.958 48.723 6.564 1.00 34.42 C ATOM 1966 O SER U 202 -2.884 49.804 7.146 1.00 34.50 O ATOM 1967 CB SER U 202 -5.460 48.486 6.777 1.00 32.03 C ATOM 1968 OG SER U 202 -5.714 48.939 5.460 1.00 32.87 O ATOM 1969 HG SER U 202 -5.729 48.165 4.843 1.00 0.00 H ATOM 1970 H SER U 202 -4.268 47.730 9.009 1.00 0.00 H ATOM 1971 N LEU U 203 -2.089 48.323 5.652 1.00 38.98 N ATOM 1972 CA LEU U 203 -0.965 49.140 5.294 1.00 42.10 C ATOM 1973 C LEU U 203 -1.069 49.546 3.873 1.00 44.27 C ATOM 1974 O LEU U 203 -0.984 48.714 2.997 1.00 43.03 O ATOM 1975 CB LEU U 203 0.301 48.358 5.453 1.00 43.67 C ATOM 1976 CG LEU U 203 0.934 48.431 6.809 1.00 44.42 C ATOM 1977 CD1 LEU U 203 1.574 47.101 7.106 1.00 44.89 C ATOM 1978 CD2 LEU U 203 2.003 49.490 6.721 1.00 45.23 C ATOM 1979 H LEU U 203 -2.222 47.402 5.187 1.00 0.00 H ATOM 1980 N GLN U 204 -1.219 50.851 3.671 1.00 47.35 N ATOM 1981 CA GLN U 204 -1.248 51.423 2.354 1.00 49.37 C ATOM 1982 C GLN U 204 -2.348 50.822 1.499 1.00 48.86 C ATOM 1983 O GLN U 204 -2.208 50.683 0.308 1.00 50.27 O ATOM 1984 CB GLN U 204 0.142 51.329 1.741 1.00 51.93 C ATOM 1985 CG GLN U 204 1.147 51.936 2.732 1.00 53.72 C ATOM 1986 CD GLN U 204 2.603 51.562 2.500 1.00 55.47 C ATOM 1987 OE1 GLN U 204 3.106 50.595 3.066 1.00 55.90 O ATOM 1988 NE2 GLN U 204 3.295 52.369 1.695 1.00 55.57 N ATOM 1989 HE22 GLN U 204 2.824 53.176 1.238 1.00 0.00 H ATOM 1990 HE21 GLN U 204 4.305 52.191 1.524 1.00 0.00 H ATOM 1991 H GLN U 204 -1.319 51.479 4.494 1.00 0.00 H ATOM 1992 N GLY U 205 -3.466 50.534 2.149 1.00 47.17 N ATOM 1993 CA GLY U 205 -4.648 50.021 1.498 1.00 45.64 C ATOM 1994 C GLY U 205 -4.720 48.533 1.310 1.00 43.87 C ATOM 1995 O GLY U 205 -5.587 48.003 0.636 1.00 45.47 O ATOM 1996 H GLY U 205 -3.493 50.685 3.178 1.00 0.00 H ATOM 1997 N ARG U 206 -3.784 47.860 1.934 1.00 40.42 N ATOM 1998 CA ARG U 206 -3.596 46.418 1.782 1.00 37.58 C ATOM 1999 C ARG U 206 -3.608 45.748 3.156 1.00 34.14 C ATOM 2000 O ARG U 206 -2.867 46.153 4.050 1.00 34.06 O ATOM 2001 CB ARG U 206 -2.273 46.146 1.059 1.00 39.29 C ATOM 2002 CG ARG U 206 -1.764 44.708 1.098 1.00 40.83 C ATOM 2003 CD ARG U 206 -0.584 44.526 0.154 1.00 42.67 C ATOM 2004 NE ARG U 206 -1.041 44.427 -1.237 1.00 44.45 N ATOM 2005 CZ ARG U 206 -0.822 43.411 -2.079 1.00 46.24 C ATOM 2006 NH1 ARG U 206 -0.097 42.344 -1.738 1.00 47.26 N ATOM 2007 NH2 ARG U 206 -1.323 43.478 -3.312 1.00 47.02 N ATOM 2008 HE ARG U 206 -1.591 45.229 -1.606 1.00 0.00 H ATOM 2009 HH12 ARG U 206 0.050 41.575 -2.422 1.00 0.00 H ATOM 2010 HH11 ARG U 206 0.321 42.282 -0.788 1.00 0.00 H ATOM 2011 HH22 ARG U 206 -1.163 42.698 -3.981 1.00 0.00 H ATOM 2012 HH21 ARG U 206 -1.874 44.310 -3.605 1.00 0.00 H ATOM 2013 H ARG U 206 -3.143 48.378 2.569 1.00 0.00 H ATOM 2014 N MET U 207 -4.447 44.727 3.310 1.00 31.50 N ATOM 2015 CA MET U 207 -4.465 43.916 4.534 1.00 30.14 C ATOM 2016 C MET U 207 -3.179 43.096 4.558 1.00 28.12 C ATOM 2017 O MET U 207 -2.865 42.404 3.585 1.00 26.94 O ATOM 2018 CB MET U 207 -5.690 43.004 4.571 1.00 30.67 C ATOM 2019 CG MET U 207 -7.015 43.753 4.639 1.00 31.71 C ATOM 2020 SD MET U 207 -7.291 44.523 6.244 1.00 32.39 S ATOM 2021 CE MET U 207 -8.156 43.200 7.082 1.00 32.16 C ATOM 2022 H MET U 207 -5.109 44.497 2.542 1.00 0.00 H ATOM 2023 N THR U 208 -2.441 43.196 5.662 1.00 26.29 N ATOM 2024 CA THR U 208 -1.069 42.700 5.736 1.00 25.13 C ATOM 2025 C THR U 208 -0.864 41.892 7.005 1.00 23.08 C ATOM 2026 O THR U 208 -1.284 42.319 8.075 1.00 21.72 O ATOM 2027 CB THR U 208 -0.079 43.880 5.738 1.00 26.13 C ATOM 2028 OG1 THR U 208 -0.311 44.705 4.589 1.00 26.98 O ATOM 2029 CG2 THR U 208 1.349 43.394 5.713 1.00 26.43 C ATOM 2030 HG1 THR U 208 -1.238 45.052 4.615 1.00 0.00 H ATOM 2031 H THR U 208 -2.857 43.644 6.503 1.00 0.00 H ATOM 2032 N LEU U 209 -0.204 40.738 6.887 1.00 22.22 N ATOM 2033 CA LEU U 209 0.146 39.925 8.063 1.00 21.40 C ATOM 2034 C LEU U 209 1.315 40.566 8.816 1.00 21.22 C ATOM 2035 O LEU U 209 2.487 40.257 8.567 1.00 21.82 O ATOM 2036 CB LEU U 209 0.477 38.482 7.662 1.00 20.87 C ATOM 2037 CG LEU U 209 0.720 37.522 8.835 1.00 20.59 C ATOM 2038 CD1 LEU U 209 -0.569 37.287 9.609 1.00 20.66 C ATOM 2039 CD2 LEU U 209 1.300 36.200 8.361 1.00 20.46 C ATOM 2040 H LEU U 209 0.070 40.405 5.941 1.00 0.00 H ATOM 2041 N THR U 210 0.986 41.461 9.740 1.00 20.32 N ATOM 2042 CA THR U 210 1.987 42.225 10.489 1.00 20.05 C ATOM 2043 C THR U 210 2.609 41.411 11.629 1.00 19.30 C ATOM 2044 O THR U 210 3.811 41.540 11.913 1.00 18.67 O ATOM 2045 CB THR U 210 1.371 43.540 11.010 1.00 21.13 C ATOM 2046 OG1 THR U 210 1.016 44.352 9.882 1.00 22.71 O ATOM 2047 CG2 THR U 210 2.326 44.314 11.900 1.00 20.73 C ATOM 2048 HG1 THR U 210 0.358 43.868 9.322 1.00 0.00 H ATOM 2049 H THR U 210 -0.021 41.626 9.940 1.00 0.00 H ATOM 2050 N GLY U 211 1.800 40.568 12.266 1.00 17.91 N ATOM 2051 CA GLY U 211 2.245 39.801 13.412 1.00 17.95 C ATOM 2052 C GLY U 211 1.667 38.404 13.483 1.00 17.25 C ATOM 2053 O GLY U 211 0.680 38.093 12.815 1.00 16.76 O ATOM 2054 H GLY U 211 0.821 40.457 11.932 1.00 0.00 H ATOM 2055 N ILE U 212 2.322 37.571 14.290 1.00 17.14 N ATOM 2056 CA ILE U 212 1.869 36.219 14.620 1.00 16.94 C ATOM 2057 C ILE U 212 1.767 36.153 16.144 1.00 16.45 C ATOM 2058 O ILE U 212 2.729 36.486 16.841 1.00 16.51 O ATOM 2059 CB ILE U 212 2.850 35.137 14.107 1.00 17.58 C ATOM 2060 CG1 ILE U 212 2.927 35.158 12.576 1.00 17.55 C ATOM 2061 CG2 ILE U 212 2.442 33.748 14.593 1.00 17.56 C ATOM 2062 CD1 ILE U 212 4.081 34.355 12.007 1.00 18.13 C ATOM 2063 H ILE U 212 3.212 37.903 14.713 1.00 0.00 H ATOM 2064 N VAL U 213 0.616 35.712 16.665 1.00 15.97 N ATOM 2065 CA VAL U 213 0.394 35.675 18.120 1.00 15.54 C ATOM 2066 C VAL U 213 1.449 34.759 18.743 1.00 15.55 C ATOM 2067 O VAL U 213 1.580 33.613 18.324 1.00 15.26 O ATOM 2068 CB VAL U 213 -1.013 35.128 18.490 1.00 15.68 C ATOM 2069 CG1 VAL U 213 -1.192 35.047 20.003 1.00 15.63 C ATOM 2070 CG2 VAL U 213 -2.134 35.958 17.862 1.00 15.82 C ATOM 2071 H VAL U 213 -0.139 35.388 16.027 1.00 0.00 H ATOM 2072 N SER U 214 2.167 35.258 19.749 1.00 16.04 N ATOM 2073 CA SER U 214 3.288 34.522 20.336 1.00 16.60 C ATOM 2074 C SER U 214 3.152 34.320 21.845 1.00 17.48 C ATOM 2075 O SER U 214 3.087 33.188 22.287 1.00 17.70 O ATOM 2076 CB SER U 214 4.610 35.202 19.985 1.00 16.69 C ATOM 2077 OG SER U 214 5.713 34.470 20.510 1.00 16.93 O ATOM 2078 HG SER U 214 5.713 33.557 20.128 1.00 0.00 H ATOM 2079 H SER U 214 1.924 36.196 20.127 1.00 0.00 H ATOM 2080 N TRP U 215 3.110 35.395 22.629 1.00 18.05 N ATOM 2081 CA TRP U 215 3.044 35.257 24.093 1.00 19.53 C ATOM 2082 C TRP U 215 2.504 36.485 24.815 1.00 19.81 C ATOM 2083 O TRP U 215 2.296 37.530 24.208 1.00 19.87 O ATOM 2084 CB TRP U 215 4.427 34.888 24.655 1.00 20.04 C ATOM 2085 CG TRP U 215 5.492 35.932 24.434 1.00 20.92 C ATOM 2086 CD1 TRP U 215 6.252 36.106 23.316 1.00 20.72 C ATOM 2087 CD2 TRP U 215 5.907 36.941 25.360 1.00 21.45 C ATOM 2088 NE1 TRP U 215 7.116 37.156 23.486 1.00 21.60 N ATOM 2089 CE2 TRP U 215 6.924 37.689 24.732 1.00 21.51 C ATOM 2090 CE3 TRP U 215 5.518 37.285 26.662 1.00 21.68 C ATOM 2091 CZ2 TRP U 215 7.559 38.766 25.362 1.00 21.84 C ATOM 2092 CZ3 TRP U 215 6.150 38.353 27.287 1.00 21.86 C ATOM 2093 CH2 TRP U 215 7.159 39.083 26.633 1.00 21.86 C ATOM 2094 HE1 TRP U 215 7.805 37.493 22.783 1.00 0.00 H ATOM 2095 H TRP U 215 3.124 36.343 22.202 1.00 0.00 H ATOM 2096 N GLY U 216 2.277 36.322 26.118 1.00 20.26 N ATOM 2097 CA GLY U 216 1.963 37.430 27.027 1.00 21.45 C ATOM 2098 C GLY U 216 1.880 36.976 28.480 1.00 23.31 C ATOM 2099 O GLY U 216 1.727 35.783 28.745 1.00 23.40 O ATOM 2100 H GLY U 216 2.325 35.360 26.511 1.00 0.00 H ATOM 2101 N ARG U 217 1.928 37.886 29.418 1.00 25.76 N ATOM 2102 CA ARG U 217 1.760 37.515 30.796 1.00 28.76 C ATOM 2103 C ARG U 217 0.277 37.695 31.065 1.00 28.34 C ATOM 2104 O ARG U 217 -0.219 38.758 30.945 1.00 28.38 O ATOM 2105 CB ARG U 217 2.623 38.403 31.680 1.00 31.78 C ATOM 2106 CG ARG U 217 2.287 38.401 33.142 1.00 35.77 C ATOM 2107 CD ARG U 217 2.850 37.190 33.848 1.00 38.58 C ATOM 2108 NE ARG U 217 1.774 36.356 34.404 1.00 42.97 N ATOM 2109 CZ ARG U 217 0.922 36.729 35.366 1.00 46.17 C ATOM 2110 NH1 ARG U 217 1.038 37.926 35.923 1.00 47.99 N ATOM 2111 NH2 ARG U 217 -0.024 35.898 35.791 1.00 47.63 N ATOM 2112 HE ARG U 217 1.666 35.397 34.017 1.00 0.00 H ATOM 2113 HH12 ARG U 217 0.377 38.218 36.671 1.00 0.00 H ATOM 2114 HH11 ARG U 217 1.790 38.573 35.612 1.00 0.00 H ATOM 2115 HH22 ARG U 217 -0.681 36.197 36.539 1.00 0.00 H ATOM 2116 HH21 ARG U 217 -0.107 34.948 35.375 1.00 0.00 H ATOM 2117 H ARG U 217 2.088 38.882 29.166 1.00 0.00 H ATOM 2118 N GLY U 219 -0.419 36.595 31.310 1.00 26.99 N ATOM 2119 CA GLY U 219 -1.842 36.623 31.493 1.00 25.02 C ATOM 2120 C GLY U 219 -2.476 36.977 30.164 1.00 23.97 C ATOM 2121 O GLY U 219 -1.825 36.956 29.168 1.00 23.77 O ATOM 2122 H GLY U 219 0.080 35.685 31.372 1.00 0.00 H ATOM 2123 N CYS U 220 -3.762 37.289 30.195 1.00 22.45 N ATOM 2124 CA CYS U 220 -4.501 37.793 29.076 1.00 21.95 C ATOM 2125 C CYS U 220 -5.340 38.994 29.506 1.00 22.19 C ATOM 2126 O CYS U 220 -5.991 38.935 30.488 1.00 22.64 O ATOM 2127 CB CYS U 220 -5.390 36.695 28.533 1.00 21.32 C ATOM 2128 SG CYS U 220 -4.403 35.246 28.141 1.00 20.98 S ATOM 2129 H CYS U 220 -4.271 37.159 31.093 1.00 0.00 H ATOM 2130 N ALA U 221 -5.306 40.054 28.739 1.00 21.86 N ATOM 2131 CA ALA U 221 -6.066 41.260 29.046 1.00 22.69 C ATOM 2132 C ALA U 221 -5.757 41.749 30.478 1.00 23.78 C ATOM 2133 O ALA U 221 -6.667 42.093 31.233 1.00 24.71 O ATOM 2134 CB ALA U 221 -7.559 40.997 28.850 1.00 22.26 C ATOM 2135 H ALA U 221 -4.717 40.036 27.882 1.00 0.00 H ATOM 2136 N LEU U 222 -4.470 41.728 30.839 1.00 25.76 N ATOM 2137 CA LEU U 222 -3.978 42.217 32.140 1.00 27.47 C ATOM 2138 C LEU U 222 -3.365 43.598 31.952 1.00 27.21 C ATOM 2139 O LEU U 222 -2.626 43.815 30.990 1.00 25.18 O ATOM 2140 CB LEU U 222 -2.882 41.311 32.720 1.00 28.73 C ATOM 2141 CG LEU U 222 -3.155 39.993 33.443 1.00 31.08 C ATOM 2142 CD1 LEU U 222 -1.856 39.519 34.081 1.00 31.73 C ATOM 2143 CD2 LEU U 222 -4.232 40.124 34.507 1.00 32.77 C ATOM 2144 H LEU U 222 -3.777 41.345 30.164 1.00 0.00 H ATOM 2145 N LYS U 223 -3.627 44.507 32.894 1.00 28.34 N ATOM 2146 CA LYS U 223 -3.037 45.853 32.852 1.00 30.25 C ATOM 2147 C LYS U 223 -1.503 45.786 32.787 1.00 28.94 C ATOM 2148 O LYS U 223 -0.879 44.989 33.488 1.00 28.97 O ATOM 2149 CB LYS U 223 -3.479 46.709 34.050 1.00 32.26 C ATOM 2150 CG LYS U 223 -3.278 48.206 33.832 1.00 34.32 C ATOM 2151 CD LYS U 223 -2.982 48.962 35.118 1.00 37.03 C ATOM 2152 CE LYS U 223 -2.638 50.419 34.826 1.00 38.41 C ATOM 2153 NZ LYS U 223 -1.968 51.094 35.972 1.00 40.19 N ATOM 2154 HZ1 LYS U 223 -2.597 51.075 36.800 1.00 0.00 H ATOM 2155 HZ2 LYS U 223 -1.083 50.597 36.196 1.00 0.00 H ATOM 2156 HZ3 LYS U 223 -1.758 52.080 35.717 1.00 0.00 H ATOM 2157 H LYS U 223 -4.264 44.257 33.677 1.00 0.00 H ATOM 2158 N ASP U 223A -0.933 46.628 31.924 1.00 28.70 N ATOM 2159 CA ASP U 223A 0.509 46.731 31.654 1.00 29.14 C ATOM 2160 C ASP U 223A 1.177 45.462 31.113 1.00 28.22 C ATOM 2161 O ASP U 223A 2.395 45.335 31.184 1.00 28.05 O ATOM 2162 CB ASP U 223A 1.266 47.249 32.893 1.00 30.50 C ATOM 2163 CG ASP U 223A 0.791 48.615 33.347 1.00 32.02 C ATOM 2164 OD1 ASP U 223A 0.095 49.317 32.578 1.00 32.42 O ATOM 2165 OD2 ASP U 223A 1.129 48.987 34.490 1.00 34.80 O ATOM 2166 H ASP U 223A -1.562 47.267 31.397 1.00 0.00 H ATOM 2167 N LYS U 224 0.395 44.554 30.531 1.00 26.99 N ATOM 2168 CA LYS U 224 0.927 43.308 29.980 1.00 26.50 C ATOM 2169 C LYS U 224 0.315 43.100 28.597 1.00 25.39 C ATOM 2170 O LYS U 224 -0.659 42.363 28.450 1.00 25.83 O ATOM 2171 CB LYS U 224 0.636 42.121 30.914 1.00 26.59 C ATOM 2172 CG LYS U 224 1.111 42.286 32.356 1.00 27.71 C ATOM 2173 CD LYS U 224 2.625 42.425 32.485 1.00 28.84 C ATOM 2174 CE LYS U 224 3.002 43.220 33.729 1.00 30.17 C ATOM 2175 NZ LYS U 224 4.450 43.540 33.757 1.00 31.25 N ATOM 2176 HZ1 LYS U 224 4.999 42.657 33.753 1.00 0.00 H ATOM 2177 HZ2 LYS U 224 4.695 44.106 32.919 1.00 0.00 H ATOM 2178 HZ3 LYS U 224 4.668 44.081 34.618 1.00 0.00 H ATOM 2179 H LYS U 224 -0.627 44.737 30.466 1.00 0.00 H ATOM 2180 N PRO U 225 0.865 43.778 27.573 1.00 24.07 N ATOM 2181 CA PRO U 225 0.316 43.618 26.223 1.00 23.07 C ATOM 2182 C PRO U 225 0.476 42.217 25.629 1.00 21.49 C ATOM 2183 O PRO U 225 1.213 41.378 26.161 1.00 21.09 O ATOM 2184 CB PRO U 225 1.093 44.645 25.379 1.00 23.77 C ATOM 2185 CG PRO U 225 2.172 45.181 26.244 1.00 24.42 C ATOM 2186 CD PRO U 225 1.816 44.902 27.663 1.00 24.31 C ATOM 2187 N GLY U 226 -0.238 41.969 24.537 1.00 20.06 N ATOM 2188 CA GLY U 226 0.038 40.806 23.708 1.00 19.52 C ATOM 2189 C GLY U 226 1.332 41.025 22.963 1.00 18.90 C ATOM 2190 O GLY U 226 1.624 42.152 22.550 1.00 18.33 O ATOM 2191 H GLY U 226 -1.007 42.617 24.270 1.00 0.00 H ATOM 2192 N VAL U 227 2.107 39.952 22.805 1.00 19.10 N ATOM 2193 CA VAL U 227 3.378 40.007 22.093 1.00 18.83 C ATOM 2194 C VAL U 227 3.307 39.108 20.864 1.00 18.51 C ATOM 2195 O VAL U 227 2.810 37.981 20.927 1.00 18.28 O ATOM 2196 CB VAL U 227 4.571 39.633 22.996 1.00 19.11 C ATOM 2197 CG1 VAL U 227 5.889 39.895 22.263 1.00 19.67 C ATOM 2198 CG2 VAL U 227 4.507 40.428 24.297 1.00 19.42 C ATOM 2199 H VAL U 227 1.794 39.044 23.204 1.00 0.00 H ATOM 2200 N TYR U 228 3.803 39.648 19.753 1.00 18.58 N ATOM 2201 CA TYR U 228 3.623 39.089 18.426 1.00 18.14 C ATOM 2202 C TYR U 228 4.966 39.004 17.725 1.00 18.49 C ATOM 2203 O TYR U 228 5.804 39.888 17.888 1.00 19.79 O ATOM 2204 CB TYR U 228 2.666 39.977 17.607 1.00 17.86 C ATOM 2205 CG TYR U 228 1.292 40.065 18.234 1.00 17.51 C ATOM 2206 CD1 TYR U 228 1.029 40.968 19.273 1.00 17.34 C ATOM 2207 CD2 TYR U 228 0.265 39.233 17.812 1.00 17.58 C ATOM 2208 CE1 TYR U 228 -0.217 41.031 19.874 1.00 17.43 C ATOM 2209 CE2 TYR U 228 -0.989 39.291 18.405 1.00 17.49 C ATOM 2210 CZ TYR U 228 -1.222 40.179 19.436 1.00 17.72 C ATOM 2211 OH TYR U 228 -2.469 40.223 20.018 1.00 18.47 O ATOM 2212 HH TYR U 228 -2.473 40.905 20.735 1.00 0.00 H ATOM 2213 H TYR U 228 4.354 40.526 19.842 1.00 0.00 H ATOM 2214 N THR U 229 5.169 37.945 16.953 1.00 18.85 N ATOM 2215 CA THR U 229 6.352 37.842 16.104 1.00 19.37 C ATOM 2216 C THR U 229 6.230 38.888 15.003 1.00 20.16 C ATOM 2217 O THR U 229 5.207 38.979 14.338 1.00 19.51 O ATOM 2218 CB THR U 229 6.492 36.434 15.510 1.00 19.67 C ATOM 2219 OG1 THR U 229 6.593 35.488 16.579 1.00 19.38 O ATOM 2220 CG2 THR U 229 7.721 36.324 14.607 1.00 20.06 C ATOM 2221 HG1 THR U 229 6.684 34.576 16.204 1.00 0.00 H ATOM 2222 H THR U 229 4.472 37.173 16.952 1.00 0.00 H ATOM 2223 N ARG U 230 7.278 39.684 14.826 1.00 21.26 N ATOM 2224 CA ARG U 230 7.262 40.788 13.875 1.00 22.73 C ATOM 2225 C ARG U 230 7.593 40.257 12.479 1.00 21.86 C ATOM 2226 O ARG U 230 8.769 40.112 12.128 1.00 21.20 O ATOM 2227 CB ARG U 230 8.263 41.842 14.349 1.00 24.98 C ATOM 2228 CG ARG U 230 8.224 43.187 13.645 1.00 27.00 C ATOM 2229 CD ARG U 230 9.164 44.145 14.364 1.00 28.81 C ATOM 2230 NE ARG U 230 8.927 45.552 14.051 1.00 30.87 N ATOM 2231 CZ ARG U 230 9.674 46.569 14.486 1.00 31.95 C ATOM 2232 NH1 ARG U 230 10.744 46.368 15.261 1.00 32.59 N ATOM 2233 NH2 ARG U 230 9.352 47.812 14.137 1.00 33.23 N ATOM 2234 HE ARG U 230 8.114 45.779 13.443 1.00 0.00 H ATOM 2235 HH12 ARG U 230 11.310 47.178 15.587 1.00 0.00 H ATOM 2236 HH11 ARG U 230 11.011 45.402 15.538 1.00 0.00 H ATOM 2237 HH22 ARG U 230 9.928 48.611 14.471 1.00 0.00 H ATOM 2238 HH21 ARG U 230 8.525 47.984 13.531 1.00 0.00 H ATOM 2239 H ARG U 230 8.139 39.514 15.385 1.00 0.00 H ATOM 2240 N VAL U 231 6.555 39.985 11.682 1.00 21.05 N ATOM 2241 CA VAL U 231 6.694 39.263 10.404 1.00 20.88 C ATOM 2242 C VAL U 231 7.641 39.978 9.423 1.00 21.67 C ATOM 2243 O VAL U 231 8.409 39.318 8.716 1.00 21.75 O ATOM 2244 CB VAL U 231 5.319 38.999 9.734 1.00 20.85 C ATOM 2245 CG1 VAL U 231 5.470 38.323 8.372 1.00 21.13 C ATOM 2246 CG2 VAL U 231 4.446 38.138 10.643 1.00 20.73 C ATOM 2247 H VAL U 231 5.607 40.296 11.976 1.00 0.00 H ATOM 2248 N SER U 232 7.609 41.311 9.414 1.00 22.06 N ATOM 2249 CA SER U 232 8.472 42.104 8.525 1.00 23.04 C ATOM 2250 C SER U 232 9.981 41.956 8.797 1.00 24.38 C ATOM 2251 O SER U 232 10.783 42.400 7.979 1.00 25.40 O ATOM 2252 CB SER U 232 8.085 43.587 8.568 1.00 23.11 C ATOM 2253 OG SER U 232 8.458 44.187 9.796 1.00 23.45 O ATOM 2254 HG SER U 232 8.194 45.141 9.789 1.00 0.00 H ATOM 2255 H SER U 232 6.955 41.805 10.054 1.00 0.00 H ATOM 2256 N HIS U 233 10.359 41.375 9.940 1.00 24.72 N ATOM 2257 CA HIS U 233 11.763 41.065 10.252 1.00 25.32 C ATOM 2258 C HIS U 233 12.182 39.619 9.903 1.00 24.80 C ATOM 2259 O HIS U 233 13.318 39.230 10.194 1.00 26.83 O ATOM 2260 CB HIS U 233 12.040 41.359 11.737 1.00 26.15 C ATOM 2261 CG HIS U 233 12.155 42.817 12.059 1.00 27.06 C ATOM 2262 ND1 HIS U 233 11.269 43.765 11.593 1.00 28.39 N ATOM 2263 CD2 HIS U 233 13.052 43.485 12.819 1.00 27.34 C ATOM 2264 CE1 HIS U 233 11.623 44.956 12.043 1.00 28.17 C ATOM 2265 NE2 HIS U 233 12.701 44.812 12.791 1.00 28.75 N ATOM 2266 H HIS U 233 9.629 41.131 10.639 1.00 0.00 H ATOM 2267 N PHE U 234 11.297 38.838 9.273 1.00 23.57 N ATOM 2268 CA PHE U 234 11.578 37.433 8.924 1.00 22.77 C ATOM 2269 C PHE U 234 11.392 37.097 7.444 1.00 22.91 C ATOM 2270 O PHE U 234 11.306 35.923 7.082 1.00 22.39 O ATOM 2271 CB PHE U 234 10.697 36.502 9.777 1.00 22.14 C ATOM 2272 CG PHE U 234 11.085 36.459 11.221 1.00 21.71 C ATOM 2273 CD1 PHE U 234 10.576 37.384 12.114 1.00 21.38 C ATOM 2274 CD2 PHE U 234 11.962 35.488 11.693 1.00 21.68 C ATOM 2275 CE1 PHE U 234 10.923 37.350 13.456 1.00 21.49 C ATOM 2276 CE2 PHE U 234 12.315 35.444 13.036 1.00 21.72 C ATOM 2277 CZ PHE U 234 11.796 36.376 13.921 1.00 21.57 C ATOM 2278 H PHE U 234 10.372 39.239 9.019 1.00 0.00 H ATOM 2279 N LEU U 235 11.348 38.105 6.573 1.00 24.04 N ATOM 2280 CA LEU U 235 11.030 37.850 5.166 1.00 24.93 C ATOM 2281 C LEU U 235 12.059 36.953 4.445 1.00 24.59 C ATOM 2282 O LEU U 235 11.663 36.088 3.656 1.00 24.17 O ATOM 2283 CB LEU U 235 10.796 39.160 4.403 1.00 26.26 C ATOM 2284 CG LEU U 235 9.605 40.007 4.873 1.00 26.99 C ATOM 2285 CD1 LEU U 235 9.474 41.251 4.010 1.00 27.69 C ATOM 2286 CD2 LEU U 235 8.309 39.206 4.846 1.00 27.50 C ATOM 2287 H LEU U 235 11.540 39.076 6.893 1.00 0.00 H ATOM 2288 N PRO U 236 13.366 37.138 4.725 1.00 25.43 N ATOM 2289 CA PRO U 236 14.358 36.240 4.112 1.00 26.45 C ATOM 2290 C PRO U 236 14.186 34.787 4.547 1.00 26.59 C ATOM 2291 O PRO U 236 14.226 33.887 3.703 1.00 27.92 O ATOM 2292 CB PRO U 236 15.695 36.807 4.602 1.00 26.22 C ATOM 2293 CG PRO U 236 15.409 38.235 4.876 1.00 26.39 C ATOM 2294 CD PRO U 236 14.024 38.235 5.453 1.00 25.57 C ATOM 2295 N TRP U 237 13.976 34.575 5.849 1.00 26.39 N ATOM 2296 CA TRP U 237 13.713 33.241 6.398 1.00 25.37 C ATOM 2297 C TRP U 237 12.477 32.608 5.761 1.00 25.70 C ATOM 2298 O TRP U 237 12.498 31.426 5.411 1.00 25.80 O ATOM 2299 CB TRP U 237 13.579 33.294 7.927 1.00 25.08 C ATOM 2300 CG TRP U 237 13.352 31.951 8.560 1.00 23.96 C ATOM 2301 CD1 TRP U 237 14.307 31.081 9.003 1.00 24.16 C ATOM 2302 CD2 TRP U 237 12.089 31.326 8.820 1.00 23.83 C ATOM 2303 NE1 TRP U 237 13.718 29.950 9.517 1.00 23.84 N ATOM 2304 CE2 TRP U 237 12.356 30.072 9.414 1.00 23.47 C ATOM 2305 CE3 TRP U 237 10.754 31.703 8.604 1.00 23.14 C ATOM 2306 CZ2 TRP U 237 11.337 29.192 9.804 1.00 23.33 C ATOM 2307 CZ3 TRP U 237 9.739 30.829 8.992 1.00 22.85 C ATOM 2308 CH2 TRP U 237 10.038 29.586 9.586 1.00 23.09 C ATOM 2309 HE1 TRP U 237 14.223 29.135 9.919 1.00 0.00 H ATOM 2310 H TRP U 237 14.000 35.387 6.498 1.00 0.00 H ATOM 2311 N ILE U 238 11.410 33.394 5.599 1.00 25.66 N ATOM 2312 CA ILE U 238 10.189 32.912 4.947 1.00 26.60 C ATOM 2313 C ILE U 238 10.454 32.572 3.479 1.00 28.23 C ATOM 2314 O ILE U 238 10.104 31.480 3.028 1.00 28.42 O ATOM 2315 CB ILE U 238 9.024 33.930 5.043 1.00 25.63 C ATOM 2316 CG1 ILE U 238 8.582 34.100 6.503 1.00 25.39 C ATOM 2317 CG2 ILE U 238 7.836 33.480 4.194 1.00 25.53 C ATOM 2318 CD1 ILE U 238 7.781 35.356 6.778 1.00 25.00 C ATOM 2319 H ILE U 238 11.446 34.374 5.945 1.00 0.00 H ATOM 2320 N ARG U 239 11.059 33.505 2.745 1.00 31.58 N ATOM 2321 CA ARG U 239 11.376 33.289 1.323 1.00 34.65 C ATOM 2322 C ARG U 239 12.275 32.076 1.110 1.00 34.26 C ATOM 2323 O ARG U 239 11.983 31.233 0.258 1.00 35.40 O ATOM 2324 CB ARG U 239 12.038 34.520 0.685 1.00 37.01 C ATOM 2325 CG ARG U 239 11.076 35.464 -0.030 1.00 39.30 C ATOM 2326 CD ARG U 239 11.834 36.431 -0.932 1.00 41.52 C ATOM 2327 NE ARG U 239 12.813 37.200 -0.164 1.00 42.78 N ATOM 2328 CZ ARG U 239 12.535 38.252 0.606 1.00 43.16 C ATOM 2329 NH1 ARG U 239 11.292 38.726 0.723 1.00 43.85 N ATOM 2330 NH2 ARG U 239 13.520 38.849 1.267 1.00 43.99 N ATOM 2331 HE ARG U 239 13.807 36.902 -0.224 1.00 0.00 H ATOM 2332 HH12 ARG U 239 11.104 39.549 1.331 1.00 0.00 H ATOM 2333 HH11 ARG U 239 10.512 38.273 0.206 1.00 0.00 H ATOM 2334 HH22 ARG U 239 13.317 39.671 1.871 1.00 0.00 H ATOM 2335 HH21 ARG U 239 14.494 38.495 1.180 1.00 0.00 H ATOM 2336 H ARG U 239 11.314 34.410 3.188 1.00 0.00 H ATOM 2337 N SER U 240 13.354 31.993 1.884 1.00 35.09 N ATOM 2338 CA SER U 240 14.307 30.886 1.751 1.00 35.75 C ATOM 2339 C SER U 240 13.631 29.533 1.985 1.00 35.84 C ATOM 2340 O SER U 240 13.833 28.611 1.209 1.00 35.97 O ATOM 2341 CB SER U 240 15.532 31.067 2.668 1.00 36.26 C ATOM 2342 OG SER U 240 15.235 30.830 4.034 1.00 37.81 O ATOM 2343 HG SER U 240 14.536 31.464 4.333 1.00 0.00 H ATOM 2344 H SER U 240 13.525 32.729 2.599 1.00 0.00 H ATOM 2345 N HIS U 241 12.791 29.439 3.016 1.00 34.23 N ATOM 2346 CA HIS U 241 12.128 28.174 3.365 1.00 33.49 C ATOM 2347 C HIS U 241 10.866 27.821 2.552 1.00 34.25 C ATOM 2348 O HIS U 241 10.348 26.713 2.693 1.00 34.45 O ATOM 2349 CB HIS U 241 11.839 28.136 4.870 1.00 32.91 C ATOM 2350 CG HIS U 241 13.074 28.006 5.704 1.00 32.44 C ATOM 2351 ND1 HIS U 241 13.792 29.094 6.150 1.00 32.11 N ATOM 2352 CD2 HIS U 241 13.739 26.911 6.142 1.00 32.16 C ATOM 2353 CE1 HIS U 241 14.839 28.674 6.838 1.00 32.67 C ATOM 2354 NE2 HIS U 241 14.827 27.355 6.853 1.00 32.00 N ATOM 2355 H HIS U 241 12.599 30.285 3.590 1.00 0.00 H ATOM 2356 N THR U 242 10.386 28.741 1.711 1.00 34.46 N ATOM 2357 CA THR U 242 9.235 28.498 0.832 1.00 34.78 C ATOM 2358 C THR U 242 9.663 28.562 -0.630 1.00 36.46 C ATOM 2359 O THR U 242 8.862 28.304 -1.530 1.00 37.94 O ATOM 2360 CB THR U 242 8.118 29.535 1.061 1.00 34.14 C ATOM 2361 OG1 THR U 242 8.624 30.855 0.831 1.00 33.01 O ATOM 2362 CG2 THR U 242 7.575 29.435 2.478 1.00 33.95 C ATOM 2363 HG1 THR U 242 9.370 31.035 1.456 1.00 0.00 H ATOM 2364 H THR U 242 10.849 29.672 1.677 1.00 0.00 H TER 2365 THR U 242 HETATM 2366 O HOH 1 -15.531 27.058 4.236 1.00 22.33 O HETATM 2367 O HOH 2 -4.888 36.673 32.854 1.00 27.13 O HETATM 2368 O HOH 3 -0.165 33.453 11.349 1.00 17.66 O HETATM 2369 O HOH 4 12.733 40.919 6.938 1.00 26.34 O HETATM 2370 O HOH 5 -2.856 41.985 22.002 1.00 17.92 O HETATM 2371 O HOH 6 7.836 36.319 20.466 1.00 25.04 O HETATM 2372 O HOH 7 16.914 26.504 19.073 1.00 25.40 O HETATM 2373 O HOH 8 -6.595 30.104 17.393 1.00 16.51 O HETATM 2374 O HOH 9 0.013 19.588 21.067 1.00 39.55 O HETATM 2375 O HOH 10 -16.906 26.292 24.182 1.00 31.99 O HETATM 2376 O HOH 11 -16.866 42.190 23.629 1.00 26.70 O HETATM 2377 O HOH 12 10.296 43.625 1.260 1.00 45.75 O HETATM 2378 O HOH 13 8.883 25.883 24.154 1.00 35.04 O HETATM 2379 O HOH 14 -6.161 53.699 16.040 1.00 49.18 O HETATM 2380 O HOH 15 1.496 36.186 1.121 1.00 29.90 O HETATM 2381 O HOH 16 -5.031 48.577 10.368 1.00 28.77 O HETATM 2382 O HOH 17 -6.987 47.746 3.368 1.00 37.79 O HETATM 2383 O HOH 18 -4.322 24.488 22.209 1.00 32.48 O HETATM 2384 O HOH 19 15.746 43.246 14.759 1.00 52.34 O HETATM 2385 O HOH 20 -6.652 39.005 12.712 1.00 19.31 O HETATM 2386 O HOH 21 -8.276 47.901 21.321 1.00 26.00 O HETATM 2387 O HOH 22 -9.106 43.225 31.752 1.00 25.97 O HETATM 2388 O HOH 23 8.914 35.719 18.017 1.00 25.88 O HETATM 2389 O HOH 24 -9.126 29.507 5.806 1.00 19.35 O HETATM 2390 O HOH 25 -16.173 32.421 28.636 1.00 26.92 O HETATM 2391 O HOH 26 -5.292 32.342 16.476 1.00 13.86 O HETATM 2392 O HOH 27 -13.018 30.165 26.415 1.00 16.73 O HETATM 2393 O HOH 28 0.116 15.522 8.743 1.00 25.25 O HETATM 2394 O HOH 29 1.419 40.042 -1.901 1.00 50.24 O HETATM 2395 O HOH 30 0.211 27.885 22.643 1.00 22.10 O HETATM 2396 O HOH 31 7.453 55.454 22.696 1.00 42.77 O HETATM 2397 O HOH 32 -18.374 30.356 7.523 1.00 32.80 O HETATM 2398 O HOH 33 -19.993 22.852 17.289 1.00 44.69 O HETATM 2399 O HOH 34 2.731 31.441 24.413 1.00 30.81 O HETATM 2400 O HOH 35 -5.221 44.555 25.992 1.00 20.60 O HETATM 2401 O HOH 36 -16.881 32.826 33.819 1.00 23.07 O HETATM 2402 O HOH 37 -9.780 45.842 31.519 1.00 26.32 O HETATM 2403 O HOH 38 -3.282 43.045 27.563 1.00 26.81 O HETATM 2404 O HOH 39 17.245 26.436 7.877 1.00 50.42 O HETATM 2405 O HOH 40 -11.278 33.192 20.682 1.00 14.54 O HETATM 2406 O HOH 41 -15.722 29.885 25.593 1.00 23.53 O HETATM 2407 O HOH 42 2.506 14.160 7.288 1.00 40.05 O HETATM 2408 O HOH 43 18.651 24.685 15.983 1.00 35.96 O HETATM 2409 O HOH 44 -14.037 42.658 27.132 1.00 28.13 O HETATM 2410 O HOH 45 -11.739 42.987 8.969 1.00 34.30 O HETATM 2411 O HOH 46 -17.165 40.131 13.632 1.00 36.52 O HETATM 2412 O HOH 47 -16.522 30.299 -3.134 1.00 34.68 O HETATM 2413 O HOH 48 -2.267 40.281 29.461 1.00 23.50 O HETATM 2414 O HOH 49 -5.434 52.882 13.243 1.00 33.24 O HETATM 2415 O HOH 50 -19.395 18.164 15.338 1.00 34.84 O HETATM 2416 O HOH 51 -7.534 40.227 33.167 1.00 32.22 O HETATM 2417 O HOH 52 -15.286 18.441 13.756 1.00 48.85 O HETATM 2418 O HOH 53 -8.536 15.529 -6.238 1.00 50.08 O HETATM 2419 O HOH 54 -3.837 40.643 1.593 1.00 28.68 O HETATM 2420 O HOH 55 3.500 53.359 21.901 1.00 39.27 O HETATM 2421 O HOH 56 -20.401 36.063 10.583 1.00 28.29 O HETATM 2422 O HOH 57 -16.479 28.654 0.308 1.00 35.41 O HETATM 2423 O HOH 58 -0.137 37.777 21.752 1.00 26.60 O HETATM 2424 O HOH 59 14.288 25.106 9.791 1.00 44.43 O HETATM 2425 O HOH 60 1.628 53.944 10.026 1.00 41.51 O HETATM 2426 O HOH 61 -9.406 20.501 21.357 1.00 37.28 O HETATM 2427 O HOH 62 -12.460 23.369 24.261 1.00 32.90 O HETATM 2428 O HOH 63 -13.422 18.100 6.413 1.00 39.37 O HETATM 2429 O HOH 64 -14.827 23.773 22.451 1.00 40.27 O HETATM 2430 O HOH 65 15.291 27.730 10.538 1.00 27.27 O HETATM 2431 O HOH 66 5.546 44.336 36.330 1.00 46.50 O HETATM 2432 O HOH 67 12.307 22.353 11.453 1.00 31.29 O HETATM 2433 O HOH 68 -10.021 27.697 9.149 1.00 19.81 O HETATM 2434 O HOH 69 2.044 20.756 -1.026 1.00 35.63 O HETATM 2435 O HOH 70 15.059 38.797 25.556 1.00 42.75 O HETATM 2436 O HOH 71 -21.524 31.250 6.042 1.00 35.22 O HETATM 2437 O HOH 72 -12.951 16.205 8.605 1.00 44.58 O HETATM 2438 O HOH 73 -6.826 15.647 3.191 1.00 31.80 O HETATM 2439 O HOH 74 16.275 34.495 1.686 1.00 41.78 O HETATM 2440 O HOH 75 15.373 34.751 10.663 1.00 26.80 O HETATM 2441 O HOH 76 6.764 40.499 1.125 1.00 46.01 O HETATM 2442 O HOH 77 -21.312 25.642 7.839 1.00 35.44 O HETATM 2443 O HOH 78 -20.396 29.640 11.898 1.00 34.11 O HETATM 2444 O HOH 79 6.529 46.634 20.452 1.00 35.90 O HETATM 2445 O HOH 80 14.691 36.248 8.171 1.00 28.94 O HETATM 2446 O HOH 81 -9.111 49.920 32.376 1.00 40.16 O HETATM 2447 O HOH 82 -2.508 37.772 -1.040 1.00 48.93 O HETATM 2448 O HOH 83 -2.517 22.348 -5.655 1.00 50.23 O HETATM 2449 O HOH 84 -13.082 35.685 0.235 1.00 41.14 O HETATM 2450 O HOH 85 5.660 49.348 17.367 1.00 50.46 O HETATM 2451 O HOH 86 15.038 37.481 11.910 1.00 39.75 O HETATM 2452 O HOH 87 8.460 16.314 10.964 1.00 36.45 O HETATM 2453 O HOH 88 6.060 25.243 23.855 1.00 36.87 O HETATM 2454 O HOH 89 13.286 37.505 19.150 1.00 33.41 O HETATM 2455 O HOH 90 -6.404 21.872 23.293 1.00 54.06 O HETATM 2456 O HOH 91 -14.243 43.711 24.149 1.00 32.06 O HETATM 2457 O HOH 92 2.889 38.417 0.051 1.00 35.49 O HETATM 2458 O HOH 93 -24.840 26.044 5.242 1.00 39.93 O HETATM 2459 O HOH 94 -13.193 29.831 -6.428 1.00 48.17 O HETATM 2460 O HOH 95 4.322 57.728 14.991 1.00 54.02 O HETATM 2461 O HOH 96 -6.700 25.309 31.509 1.00 60.28 O HETATM 2462 O HOH 97 -7.565 13.749 24.062 1.00 51.89 O HETATM 2463 O HOH 98 18.402 34.762 14.697 1.00 48.81 O HETATM 2464 O HOH 99 -22.877 23.954 15.188 1.00 45.46 O HETATM 2465 O HOH 100 0.211 52.099 31.369 1.00 45.74 O HETATM 2466 O HOH 101 -16.203 38.127 25.017 1.00 35.19 O HETATM 2467 O HOH 102 2.313 27.643 -2.781 1.00 23.60 O HETATM 2468 O HOH 103 1.140 34.137 32.246 1.00 32.35 O HETATM 2469 O HOH 104 17.492 27.958 22.332 1.00 36.76 O HETATM 2470 O HOH 105 4.759 49.081 0.979 1.00 59.38 O HETATM 2471 O HOH 106 11.062 37.206 17.150 1.00 32.20 O HETATM 2472 O HOH 107 -19.506 18.208 12.254 1.00 54.96 O HETATM 2473 O HOH 108 -12.035 21.602 21.977 1.00 44.06 O HETATM 2474 O HOH 109 -11.572 50.081 25.493 1.00 42.64 O HETATM 2475 O HOH 110 1.345 15.756 -4.509 1.00 48.42 O HETATM 2476 O HOH 111 -2.227 12.596 -5.679 1.00 55.21 O HETATM 2477 O HOH 112 -4.444 51.954 5.091 1.00 60.04 O HETATM 2478 O HOH 113 -1.041 52.686 9.647 1.00 52.59 O HETATM 2479 O HOH 114 -7.667 54.375 32.008 1.00 53.32 O HETATM 2480 O HOH 115 -6.425 14.235 5.750 1.00 46.23 O HETATM 2481 O HOH 116 7.864 47.230 17.782 1.00 49.26 O HETATM 2482 O HOH 117 -0.526 25.002 22.528 1.00 40.27 O HETATM 2483 O HOH 118 -24.250 22.172 5.978 1.00 44.48 O HETATM 2484 O HOH 119 14.439 23.574 7.635 1.00 49.09 O HETATM 2485 O HOH 120 12.922 21.707 8.690 1.00 43.57 O HETATM 2486 O HOH 121 18.976 30.453 22.243 1.00 40.80 O HETATM 2487 O HOH 122 6.786 53.426 12.580 1.00 52.15 O HETATM 2488 O HOH 123 4.240 27.170 25.062 1.00 46.88 O HETATM 2489 O HOH 124 -12.272 17.631 34.278 1.00 37.84 O HETATM 2490 O HOH 125 18.899 28.853 7.266 1.00 59.20 O HETATM 2491 O HOH 126 8.633 42.001 -0.486 1.00 51.99 O HETATM 2492 O HOH 127 0.408 13.610 -6.327 1.00 46.98 O HETATM 2493 C1 UNN A 128 -0.485 31.685 26.499 1.00 0.14 C HETATM 2494 C2 UNN A 128 -0.998 32.724 27.285 1.00 0.07 C HETATM 2495 N2 UNN A 128 -1.229 33.929 26.727 1.00 -0.28 N HETATM 2496 C3 UNN A 128 -0.957 34.178 25.427 1.00 0.15 C HETATM 2497 C4 UNN A 128 -0.435 33.171 24.627 1.00 0.14 C HETATM 2498 N3 UNN A 128 -0.140 33.368 23.312 1.00 -0.32 N HETATM 2499 H11 UNN A 128 0.246 32.596 22.750 1.00 0.18 H HETATM 2500 H12 UNN A 128 -0.303 34.289 22.880 1.00 0.18 H HETATM 2501 N1 UNN A 128 -0.206 31.960 25.187 1.00 -0.25 N HETATM 2502 C6 UNN A 128 -1.232 35.560 24.948 1.00 0.21 C HETATM 2503 O1 UNN A 128 -1.223 35.801 23.752 1.00 -0.39 O HETATM 2504 N5 UNN A 128 -1.389 36.455 25.932 1.00 -0.22 N HETATM 2505 C7 UNN A 128 -1.639 37.751 25.802 1.00 0.33 C HETATM 2506 N6 UNN A 128 -1.739 38.306 24.603 1.00 -0.25 N HETATM 2507 H1 UNN A 128 -1.933 39.314 24.517 1.00 0.32 H HETATM 2508 H2 UNN A 128 -1.622 37.730 23.757 1.00 0.32 H HETATM 2509 N7 UNN A 128 -1.762 38.440 26.850 1.00 -0.25 N HETATM 2510 H14 UNN A 128 -1.956 39.449 26.783 1.00 0.32 H HETATM 2511 H15 UNN A 128 -1.668 37.994 27.774 1.00 0.32 H HETATM 2512 H13 UNN A 128 -1.309 36.108 26.866 1.00 0.18 H HETATM 2513 C5 UNN A 128 -1.397 32.646 28.717 1.00 -0.01 C HETATM 2514 C10 UNN A 128 -2.346 31.801 29.277 1.00 0.09 C HETATM 2515 O2 UNN A 128 -2.439 32.084 30.620 1.00 -0.27 O HETATM 2516 C9 UNN A 128 -1.563 33.107 30.894 1.00 0.08 C HETATM 2517 C8 UNN A 128 -0.933 33.458 29.718 1.00 -0.06 C HETATM 2518 H16 UNN A 128 -0.192 34.248 29.605 1.00 0.03 H HETATM 2519 H3 UNN A 128 -1.395 33.561 31.869 1.00 0.10 H HETATM 2520 H4 UNN A 128 -2.919 31.044 28.744 1.00 0.10 H HETATM 2521 N4 UNN A 128 -0.145 30.403 26.988 1.00 -0.29 N HETATM 2522 C11 UNN A 128 -0.378 29.207 26.179 1.00 0.03 C HETATM 2523 C12 UNN A 128 1.010 28.614 25.906 1.00 -0.03 C HETATM 2524 C13 UNN A 128 1.378 27.523 26.912 1.00 -0.05 C HETATM 2525 C14 UNN A 128 1.799 28.088 28.263 1.00 -0.05 C HETATM 2526 C15 UNN A 128 0.689 28.933 28.877 1.00 -0.03 C HETATM 2527 C16 UNN A 128 0.633 30.326 28.251 1.00 0.03 C HETATM 2528 H17 UNN A 128 0.175 31.012 28.979 1.00 0.05 H HETATM 2529 H18 UNN A 128 1.663 30.650 28.040 1.00 0.05 H HETATM 2530 H19 UNN A 128 0.872 29.034 29.957 1.00 0.03 H HETATM 2531 H20 UNN A 128 -0.275 28.429 28.714 1.00 0.03 H HETATM 2532 H9 UNN A 128 2.034 27.256 28.943 1.00 0.03 H HETATM 2533 H10 UNN A 128 2.693 28.714 28.127 1.00 0.03 H HETATM 2534 H21 UNN A 128 2.211 26.933 26.502 1.00 0.03 H HETATM 2535 H22 UNN A 128 0.504 26.871 27.060 1.00 0.03 H HETATM 2536 H7 UNN A 128 1.758 29.419 25.966 1.00 0.03 H HETATM 2537 H8 UNN A 128 1.018 28.181 24.895 1.00 0.03 H HETATM 2538 H5 UNN A 128 -1.001 28.487 26.730 1.00 0.05 H HETATM 2539 H6 UNN A 128 -0.874 29.474 25.234 1.00 0.05 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 307 306 439 CONECT 365 364 1079 CONECT 439 307 438 CONECT 1079 365 1078 CONECT 1310 1309 1961 CONECT 1627 1626 1784 CONECT 1784 1627 1783 CONECT 1886 1885 2128 CONECT 1961 1310 1960 CONECT 2128 1886 2127 CONECT 2493 2494 2501 2521 CONECT 2494 2493 2495 2513 CONECT 2495 2494 2496 CONECT 2496 2495 2497 2502 CONECT 2497 2496 2498 2501 CONECT 2498 2497 2499 2500 CONECT 2499 2498 CONECT 2500 2498 CONECT 2501 2493 2497 CONECT 2502 2496 2503 2504 CONECT 2503 2502 CONECT 2504 2502 2505 2512 CONECT 2505 2504 2506 2509 CONECT 2506 2505 2507 2508 CONECT 2507 2506 CONECT 2508 2506 CONECT 2509 2505 2510 2511 CONECT 2510 2509 CONECT 2511 2509 CONECT 2512 2504 CONECT 2513 2494 2514 2517 CONECT 2514 2513 2515 2520 CONECT 2515 2514 2516 CONECT 2516 2515 2517 2519 CONECT 2517 2513 2516 2518 CONECT 2518 2517 CONECT 2519 2516 CONECT 2520 2514 CONECT 2521 2493 2522 2527 CONECT 2522 2521 2523 2538 2539 CONECT 2523 2522 2524 2536 2537 CONECT 2524 2523 2525 2534 2535 CONECT 2525 2524 2526 2532 2533 CONECT 2526 2525 2527 2530 2531 CONECT 2527 2521 2526 2528 2529 CONECT 2528 2527 CONECT 2529 2527 CONECT 2530 2526 CONECT 2531 2526 CONECT 2532 2525 CONECT 2533 2525 CONECT 2534 2524 CONECT 2535 2524 CONECT 2536 2523 CONECT 2537 2523 CONECT 2538 2522 CONECT 2539 2522 MASTER 0 0 0 0 0 0 0 0 2538 1 61 19 END
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Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
5zaf
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
urokinase plasminogen activator
Ligand Name
28I
EC.Number
E.C.-.-.-.-
Resolution
1.65(Å)
Affinity (Kd/Ki/IC50)
Ki=166nM
Release Year
2018
Protein/NA Sequence
Check fasta file
Primary Reference
(2018) J. Med. Chem. Vol. 61: pp. 8299-8320
Ligand Properties
Formula
C
1
6
H
2
2
N
7
O
2
Molecular Weight
344.392
Exact Mass
344.183
No. of atoms
47
No. of bonds
49
Polar Surface Area
148.89
LOGP Value
3.17 (
Computed with XLOGP3
)
1.24 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 4
No. of Nitrogen and Oxygen Atoms: 9
No. of Rings: 3
Canonical SMILES
NC(=[NH2+])NC(=O)c1nc(c2ccoc2)c(nc1N)N1CCCCCC1
InChI String
InChI=1S/C16H21N7O2/c17-13-12(15(24)22-16(18)19)20-11(10-5-8-25-9-10)14(21-13)23-6-3-1-2-4-7-23/h5,8-9H,1-4,6-7H2,(H2,17,21)(H4,18,19,22,24)/p+1
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):
P00749
Entrez Gene ID
NCBI Entrez Gene ID:
5328
ASD
Information of known allosteric effects of PDB entries
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