Browse entries in the PDBbind-CN Database
HEADER 4X1R_COMPLEX COMPND 4X1R_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 U 247 ILE ILE GLY GLY GLU PHE THR THR ILE GLU ASN GLN PRO SEQRES 2 U 247 TRP PHE ALA ALA ILE TYR ARG ARG HIS ARG GLY GLY SER SEQRES 3 U 247 VAL THR TYR VAL CYS GLY GLY SER LEU ILE SER PRO CYS SEQRES 4 U 247 TRP VAL ILE SER ALA THR HIS CYS PHE ILE ASP TYR PRO SEQRES 5 U 247 LYS LYS GLU ASP TYR ILE VAL TYR LEU GLY ARG SER ARG SEQRES 6 U 247 LEU ASN SER ASN THR GLN GLY GLU MET LYS PHE GLU VAL SEQRES 7 U 247 GLU ASN LEU ILE LEU HIS LYS ASP TYR SER ALA ASP THR SEQRES 8 U 247 LEU ALA TYR HIS ASN ASP ILE ALA LEU LEU LYS ILE ARG SEQRES 9 U 247 SER LYS GLU GLY ARG CYS ALA GLN PRO SER ARG THR ILE SEQRES 10 U 247 GLN THR ILE ALA LEU PRO SER MET TYR ASN ASP PRO GLN SEQRES 11 U 247 PHE GLY THR SER CYS GLU ILE THR GLY PHE GLY LYS GLU SEQRES 12 U 247 GLN SER THR ASP TYR LEU TYR PRO GLU GLN LEU LYS MET SEQRES 13 U 247 THR VAL VAL LYS LEU ILE SER HIS ARG GLU CYS GLN GLN SEQRES 14 U 247 PRO HIS TYR TYR GLY SER GLU VAL THR THR LYS MET LEU SEQRES 15 U 247 CYS ALA ALA ASP PRO GLN TRP LYS THR ASP SER CYS GLN SEQRES 16 U 247 GLY ASP SER GLY GLY PRO LEU VAL CYS SER LEU GLN GLY SEQRES 17 U 247 ARG MET THR LEU THR GLY ILE VAL SER TRP GLY ARG GLY SEQRES 18 U 247 CYS ALA LEU LYS ASP LYS PRO GLY VAL TYR THR ARG VAL SEQRES 19 U 247 SER HIS PHE LEU PRO TRP ILE ARG SER HIS THR LYS GLU HET CYS A 280 141 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 -26.371 -24.797 -9.289 1.00 40.73 N ATOM 2 CA ILE U 16 -25.021 -24.178 -9.268 1.00 43.16 C ATOM 3 C ILE U 16 -24.284 -24.585 -10.531 1.00 42.32 C ATOM 4 O ILE U 16 -24.191 -25.770 -10.829 1.00 39.53 O ATOM 5 CB ILE U 16 -24.185 -24.646 -8.057 1.00 43.48 C ATOM 6 CG1 ILE U 16 -24.801 -24.175 -6.721 1.00 44.10 C ATOM 7 CG2 ILE U 16 -22.750 -24.177 -8.190 1.00 46.69 C ATOM 8 CD1 ILE U 16 -24.749 -22.696 -6.486 1.00 44.14 C ATOM 9 HN3 ILE U 16 -26.276 -25.832 -9.327 1.00 0.00 H ATOM 10 HN2 ILE U 16 -26.891 -24.464 -10.126 1.00 0.00 H ATOM 11 HN1 ILE U 16 -26.888 -24.527 -8.428 1.00 0.00 H ATOM 12 N ILE U 17 -23.771 -23.601 -11.263 1.00 40.29 N ATOM 13 CA ILE U 17 -22.958 -23.870 -12.433 1.00 44.07 C ATOM 14 C ILE U 17 -21.517 -23.914 -11.985 1.00 42.19 C ATOM 15 O ILE U 17 -21.070 -23.028 -11.251 1.00 47.78 O ATOM 16 CB ILE U 17 -23.064 -22.765 -13.514 1.00 47.93 C ATOM 17 CG1 ILE U 17 -24.503 -22.287 -13.705 1.00 48.56 C ATOM 18 CG2 ILE U 17 -22.479 -23.288 -14.823 1.00 51.35 C ATOM 19 CD1 ILE U 17 -25.488 -23.392 -13.986 1.00 54.06 C ATOM 20 H ILE U 17 -23.957 -22.615 -10.990 1.00 0.00 H ATOM 21 N GLY U 18 -20.792 -24.914 -12.469 1.00 41.63 N ATOM 22 CA GLY U 18 -19.442 -25.211 -11.998 1.00 47.45 C ATOM 23 C GLY U 18 -19.418 -25.574 -10.517 1.00 45.59 C ATOM 24 O GLY U 18 -20.378 -26.117 -9.979 1.00 46.60 O ATOM 25 H GLY U 18 -21.202 -25.511 -13.215 1.00 0.00 H ATOM 26 N GLY U 19 -18.321 -25.251 -9.855 1.00 49.81 N ATOM 27 CA GLY U 19 -18.147 -25.631 -8.466 1.00 48.45 C ATOM 28 C GLY U 19 -18.135 -27.134 -8.321 1.00 48.38 C ATOM 29 O GLY U 19 -17.841 -27.873 -9.267 1.00 46.91 O ATOM 30 H GLY U 19 -17.571 -24.716 -10.337 1.00 0.00 H ATOM 31 N GLU U 20 -18.400 -27.605 -7.119 1.00 46.21 N ATOM 32 CA GLU U 20 -18.167 -28.982 -6.784 1.00 44.38 C ATOM 33 C GLU U 20 -19.296 -29.526 -5.972 1.00 38.04 C ATOM 34 O GLU U 20 -19.942 -28.791 -5.295 1.00 35.54 O ATOM 35 CB GLU U 20 -16.878 -29.083 -6.004 1.00 52.45 C ATOM 36 CG GLU U 20 -16.706 -27.958 -5.007 1.00 62.91 C ATOM 37 CD GLU U 20 -15.343 -27.936 -4.316 1.00 74.40 C ATOM 38 OE1 GLU U 20 -14.363 -27.496 -4.938 1.00 81.50 O ATOM 39 OE2 GLU U 20 -15.252 -28.331 -3.132 1.00 78.21 O ATOM 40 H GLU U 20 -18.787 -26.965 -6.396 1.00 0.00 H ATOM 41 N PHE U 21 -19.533 -30.819 -6.067 1.00 33.83 N ATOM 42 CA PHE U 21 -20.469 -31.466 -5.199 1.00 36.24 C ATOM 43 C PHE U 21 -19.901 -31.403 -3.783 1.00 35.72 C ATOM 44 O PHE U 21 -18.696 -31.396 -3.575 1.00 34.76 O ATOM 45 CB PHE U 21 -20.696 -32.896 -5.620 1.00 36.29 C ATOM 46 CG PHE U 21 -21.452 -33.008 -6.895 1.00 38.78 C ATOM 47 CD1 PHE U 21 -22.813 -32.740 -6.923 1.00 36.83 C ATOM 48 CD2 PHE U 21 -20.792 -33.314 -8.085 1.00 38.70 C ATOM 49 CE1 PHE U 21 -23.522 -32.818 -8.099 1.00 37.96 C ATOM 50 CE2 PHE U 21 -21.499 -33.394 -9.278 1.00 41.19 C ATOM 51 CZ PHE U 21 -22.867 -33.158 -9.280 1.00 40.62 C ATOM 52 H PHE U 21 -19.031 -31.379 -6.785 1.00 0.00 H ATOM 53 N THR U 22 -20.791 -31.311 -2.823 1.00 41.63 N ATOM 54 CA THR U 22 -20.384 -31.191 -1.433 1.00 39.30 C ATOM 55 C THR U 22 -21.370 -31.970 -0.627 1.00 38.00 C ATOM 56 O THR U 22 -22.240 -32.645 -1.184 1.00 40.52 O ATOM 57 CB THR U 22 -20.328 -29.694 -1.033 1.00 41.11 C ATOM 58 OG1 THR U 22 -19.752 -29.553 0.269 1.00 44.25 O ATOM 59 CG2 THR U 22 -21.716 -29.017 -1.068 1.00 39.37 C ATOM 60 HG1 THR U 22 -19.722 -28.594 0.513 1.00 0.00 H ATOM 61 H THR U 22 -21.803 -31.324 -3.061 1.00 0.00 H ATOM 62 N THR U 23 -21.258 -31.906 0.694 1.00 39.51 N ATOM 63 CA THR U 23 -22.255 -32.565 1.551 1.00 37.78 C ATOM 64 C THR U 23 -22.765 -31.549 2.559 1.00 32.59 C ATOM 65 O THR U 23 -22.207 -30.472 2.710 1.00 33.20 O ATOM 66 CB THR U 23 -21.661 -33.790 2.291 1.00 41.06 C ATOM 67 OG1 THR U 23 -20.536 -33.373 3.070 1.00 39.78 O ATOM 68 CG2 THR U 23 -21.190 -34.852 1.293 1.00 45.04 C ATOM 69 HG1 THR U 23 -20.826 -32.695 3.731 1.00 0.00 H ATOM 70 H THR U 23 -20.464 -31.389 1.124 1.00 0.00 H ATOM 71 N ILE U 24 -23.816 -31.902 3.265 1.00 33.58 N ATOM 72 CA ILE U 24 -24.404 -30.975 4.186 1.00 34.16 C ATOM 73 C ILE U 24 -23.379 -30.525 5.264 1.00 36.23 C ATOM 74 O ILE U 24 -23.406 -29.379 5.701 1.00 36.83 O ATOM 75 CB ILE U 24 -25.728 -31.515 4.756 1.00 32.97 C ATOM 76 CG1 ILE U 24 -26.586 -30.361 5.332 1.00 33.84 C ATOM 77 CG2 ILE U 24 -25.489 -32.563 5.809 1.00 35.84 C ATOM 78 CD1 ILE U 24 -26.967 -29.322 4.288 1.00 36.73 C ATOM 79 H ILE U 24 -24.221 -32.854 3.155 1.00 0.00 H ATOM 80 N GLU U 25 -22.430 -31.386 5.626 1.00 34.61 N ATOM 81 CA GLU U 25 -21.501 -31.049 6.695 1.00 37.66 C ATOM 82 C GLU U 25 -20.680 -29.804 6.369 1.00 37.59 C ATOM 83 O GLU U 25 -20.301 -29.059 7.263 1.00 36.93 O ATOM 84 CB GLU U 25 -20.592 -32.242 7.042 1.00 35.87 C ATOM 85 CG GLU U 25 -21.341 -33.449 7.594 1.00 39.22 C ATOM 86 CD GLU U 25 -21.793 -34.428 6.521 1.00 42.34 C ATOM 87 OE1 GLU U 25 -21.874 -34.029 5.344 1.00 43.51 O ATOM 88 OE2 GLU U 25 -22.078 -35.600 6.858 1.00 47.50 O ATOM 89 H GLU U 25 -22.352 -32.304 5.143 1.00 0.00 H ATOM 90 N ASN U 26 -20.407 -29.564 5.097 1.00 36.41 N ATOM 91 CA ASN U 26 -19.711 -28.360 4.702 1.00 40.90 C ATOM 92 C ASN U 26 -20.578 -27.114 4.601 1.00 40.44 C ATOM 93 O ASN U 26 -20.041 -26.036 4.387 1.00 42.81 O ATOM 94 CB ASN U 26 -18.978 -28.586 3.366 1.00 44.68 C ATOM 95 CG ASN U 26 -17.793 -29.502 3.531 1.00 49.87 C ATOM 96 OD1 ASN U 26 -17.093 -29.419 4.541 1.00 48.69 O ATOM 97 ND2 ASN U 26 -17.570 -30.399 2.566 1.00 46.14 N ATOM 98 HD22 ASN U 26 -18.190 -30.430 1.731 1.00 0.00 H ATOM 99 HD21 ASN U 26 -16.777 -31.066 2.650 1.00 0.00 H ATOM 100 H ASN U 26 -20.697 -30.251 4.372 1.00 0.00 H ATOM 101 N GLN U 27 -21.898 -27.282 4.690 1.00 40.40 N ATOM 102 CA GLN U 27 -22.885 -26.180 4.601 1.00 41.67 C ATOM 103 C GLN U 27 -24.088 -26.489 5.501 1.00 39.65 C ATOM 104 O GLN U 27 -25.220 -26.518 5.043 1.00 37.53 O ATOM 105 CB GLN U 27 -23.370 -25.997 3.155 1.00 44.30 C ATOM 106 CG GLN U 27 -22.297 -25.545 2.181 1.00 50.79 C ATOM 107 CD GLN U 27 -21.897 -24.095 2.394 1.00 57.29 C ATOM 108 OE1 GLN U 27 -22.743 -23.234 2.677 1.00 60.38 O ATOM 109 NE2 GLN U 27 -20.610 -23.811 2.257 1.00 62.46 N ATOM 110 HE22 GLN U 27 -19.934 -24.564 2.019 1.00 0.00 H ATOM 111 HE21 GLN U 27 -20.276 -22.835 2.388 1.00 0.00 H ATOM 112 H GLN U 27 -22.258 -28.248 4.831 1.00 0.00 H ATOM 113 N PRO U 28 -23.842 -26.668 6.814 1.00 38.91 N ATOM 114 CA PRO U 28 -24.803 -27.259 7.713 1.00 36.55 C ATOM 115 C PRO U 28 -25.952 -26.356 8.087 1.00 32.67 C ATOM 116 O PRO U 28 -26.890 -26.813 8.716 1.00 35.63 O ATOM 117 CB PRO U 28 -23.944 -27.608 8.958 1.00 39.37 C ATOM 118 CG PRO U 28 -22.887 -26.586 8.955 1.00 40.54 C ATOM 119 CD PRO U 28 -22.553 -26.419 7.488 1.00 40.79 C ATOM 120 N TRP U 29 -25.867 -25.103 7.694 1.00 32.07 N ATOM 121 CA TRP U 29 -26.978 -24.151 7.765 1.00 35.99 C ATOM 122 C TRP U 29 -27.972 -24.261 6.608 1.00 36.01 C ATOM 123 O TRP U 29 -29.042 -23.616 6.605 1.00 34.68 O ATOM 124 CB TRP U 29 -26.414 -22.728 7.786 1.00 37.31 C ATOM 125 CG TRP U 29 -25.382 -22.465 6.747 1.00 37.09 C ATOM 126 CD1 TRP U 29 -25.609 -22.091 5.469 1.00 42.76 C ATOM 127 CD2 TRP U 29 -23.966 -22.535 6.895 1.00 41.58 C ATOM 128 NE1 TRP U 29 -24.430 -21.914 4.804 1.00 42.55 N ATOM 129 CE2 TRP U 29 -23.401 -22.187 5.658 1.00 38.83 C ATOM 130 CE3 TRP U 29 -23.114 -22.853 7.961 1.00 41.66 C ATOM 131 CZ2 TRP U 29 -22.034 -22.142 5.448 1.00 41.84 C ATOM 132 CZ3 TRP U 29 -21.756 -22.809 7.753 1.00 38.93 C ATOM 133 CH2 TRP U 29 -21.225 -22.465 6.504 1.00 43.73 C ATOM 134 HE1 TRP U 29 -24.332 -21.620 3.811 1.00 0.00 H ATOM 135 H TRP U 29 -24.959 -24.770 7.311 1.00 0.00 H ATOM 136 N PHE U 30 -27.643 -25.064 5.615 1.00 33.77 N ATOM 137 CA PHE U 30 -28.506 -25.100 4.442 1.00 31.70 C ATOM 138 C PHE U 30 -29.795 -25.870 4.674 1.00 29.16 C ATOM 139 O PHE U 30 -29.783 -27.010 5.117 1.00 29.56 O ATOM 140 CB PHE U 30 -27.754 -25.624 3.227 1.00 33.25 C ATOM 141 CG PHE U 30 -28.601 -25.660 1.991 1.00 34.72 C ATOM 142 CD1 PHE U 30 -28.728 -24.531 1.202 1.00 37.22 C ATOM 143 CD2 PHE U 30 -29.272 -26.812 1.633 1.00 34.69 C ATOM 144 CE1 PHE U 30 -29.496 -24.566 0.041 1.00 41.08 C ATOM 145 CE2 PHE U 30 -30.039 -26.857 0.472 1.00 35.63 C ATOM 146 CZ PHE U 30 -30.142 -25.733 -0.320 1.00 37.07 C ATOM 147 H PHE U 30 -26.790 -25.656 5.668 1.00 0.00 H ATOM 148 N ALA U 31 -30.913 -25.210 4.355 1.00 27.22 N ATOM 149 CA ALA U 31 -32.256 -25.708 4.549 1.00 30.68 C ATOM 150 C ALA U 31 -32.851 -25.988 3.169 1.00 31.33 C ATOM 151 O ALA U 31 -32.784 -25.132 2.309 1.00 34.04 O ATOM 152 CB ALA U 31 -33.109 -24.652 5.209 1.00 30.59 C ATOM 153 H ALA U 31 -30.808 -24.265 3.934 1.00 0.00 H ATOM 154 N ALA U 32 -33.423 -27.174 3.002 1.00 32.62 N ATOM 155 CA ALA U 32 -34.043 -27.599 1.768 1.00 35.83 C ATOM 156 C ALA U 32 -35.549 -27.571 1.942 1.00 33.54 C ATOM 157 O ALA U 32 -36.095 -28.243 2.817 1.00 34.87 O ATOM 158 CB ALA U 32 -33.548 -28.988 1.388 1.00 36.19 C ATOM 159 H ALA U 32 -33.425 -27.835 3.805 1.00 0.00 H ATOM 160 N ILE U 33 -36.223 -26.795 1.090 1.00 35.22 N ATOM 161 CA ILE U 33 -37.678 -26.523 1.257 1.00 34.77 C ATOM 162 C ILE U 33 -38.501 -27.121 0.120 1.00 36.50 C ATOM 163 O ILE U 33 -38.184 -26.947 -1.077 1.00 33.85 O ATOM 164 CB ILE U 33 -37.981 -25.002 1.382 1.00 36.49 C ATOM 165 CG1 ILE U 33 -37.004 -24.344 2.377 1.00 36.83 C ATOM 166 CG2 ILE U 33 -39.418 -24.791 1.852 1.00 38.02 C ATOM 167 CD1 ILE U 33 -37.052 -22.847 2.472 1.00 34.00 C ATOM 168 H ILE U 33 -35.718 -26.368 0.287 1.00 0.00 H ATOM 169 N TYR U 34 -39.548 -27.838 0.509 1.00 36.04 N ATOM 170 CA TYR U 34 -40.352 -28.611 -0.406 1.00 38.05 C ATOM 171 C TYR U 34 -41.806 -28.193 -0.236 1.00 43.81 C ATOM 172 O TYR U 34 -42.193 -27.699 0.842 1.00 44.08 O ATOM 173 CB TYR U 34 -40.219 -30.099 -0.103 1.00 38.42 C ATOM 174 CG TYR U 34 -38.827 -30.682 -0.271 1.00 40.38 C ATOM 175 CD1 TYR U 34 -37.865 -30.531 0.728 1.00 35.24 C ATOM 176 CD2 TYR U 34 -38.474 -31.406 -1.427 1.00 37.61 C ATOM 177 CE1 TYR U 34 -36.598 -31.066 0.589 1.00 36.90 C ATOM 178 CE2 TYR U 34 -37.200 -31.951 -1.572 1.00 37.30 C ATOM 179 CZ TYR U 34 -36.255 -31.764 -0.578 1.00 35.62 C ATOM 180 OH TYR U 34 -34.981 -32.296 -0.700 1.00 33.20 O ATOM 181 HH TYR U 34 -35.042 -33.281 -0.780 1.00 0.00 H ATOM 182 H TYR U 34 -39.800 -27.843 1.518 1.00 0.00 H ATOM 183 N ARG U 35 -42.616 -28.427 -1.251 1.00 46.31 N ATOM 184 CA ARG U 35 -44.041 -28.165 -1.177 1.00 54.39 C ATOM 185 C ARG U 35 -44.843 -29.433 -1.409 1.00 60.51 C ATOM 186 O ARG U 35 -44.618 -30.127 -2.377 1.00 59.02 O ATOM 187 CB ARG U 35 -44.421 -27.109 -2.200 1.00 58.90 C ATOM 188 CG ARG U 35 -45.907 -26.920 -2.391 1.00 66.74 C ATOM 189 CD ARG U 35 -46.237 -25.543 -2.930 1.00 70.04 C ATOM 190 NE ARG U 35 -45.785 -25.355 -4.299 1.00 76.49 N ATOM 191 CZ ARG U 35 -44.811 -24.529 -4.657 1.00 83.09 C ATOM 192 NH1 ARG U 35 -44.457 -24.429 -5.920 1.00 84.35 N ATOM 193 NH2 ARG U 35 -44.189 -23.796 -3.751 1.00 84.59 N ATOM 194 HE ARG U 35 -46.256 -25.904 -5.046 1.00 0.00 H ATOM 195 HH12 ARG U 35 -43.693 -23.780 -6.196 1.00 0.00 H ATOM 196 HH11 ARG U 35 -44.941 -24.999 -6.643 1.00 0.00 H ATOM 197 HH22 ARG U 35 -43.426 -23.150 -4.039 1.00 0.00 H ATOM 198 HH21 ARG U 35 -44.462 -23.865 -2.750 1.00 0.00 H ATOM 199 H ARG U 35 -42.220 -28.812 -2.132 1.00 0.00 H ATOM 200 N ARG U 36 -45.769 -29.746 -0.513 1.00 66.00 N ATOM 201 CA ARG U 36 -46.604 -30.920 -0.711 1.00 70.58 C ATOM 202 C ARG U 36 -47.736 -30.648 -1.657 1.00 72.41 C ATOM 203 O ARG U 36 -48.345 -29.606 -1.624 1.00 73.83 O ATOM 204 CB ARG U 36 -47.133 -31.511 0.577 1.00 70.28 C ATOM 205 CG ARG U 36 -46.858 -30.709 1.809 1.00 74.25 C ATOM 206 CD ARG U 36 -47.646 -31.270 2.970 1.00 73.64 C ATOM 207 NE ARG U 36 -46.834 -32.089 3.834 1.00 73.84 N ATOM 208 CZ ARG U 36 -46.548 -31.779 5.084 1.00 74.06 C ATOM 209 NH1 ARG U 36 -45.807 -32.583 5.811 1.00 74.46 N ATOM 210 NH2 ARG U 36 -46.995 -30.665 5.602 1.00 76.45 N ATOM 211 HE ARG U 36 -46.451 -32.976 3.450 1.00 0.00 H ATOM 212 HH12 ARG U 36 -45.583 -32.335 6.796 1.00 0.00 H ATOM 213 HH11 ARG U 36 -45.444 -33.467 5.402 1.00 0.00 H ATOM 214 HH22 ARG U 36 -46.769 -30.422 6.588 1.00 0.00 H ATOM 215 HH21 ARG U 36 -47.577 -30.022 5.028 1.00 0.00 H ATOM 216 H ARG U 36 -45.898 -29.152 0.331 1.00 0.00 H ATOM 217 N HIS U 37 -48.016 -31.609 -2.507 1.00 74.10 N ATOM 218 CA HIS U 37 -48.981 -31.398 -3.546 1.00 80.56 C ATOM 219 C HIS U 37 -50.269 -32.127 -3.247 1.00 83.82 C ATOM 220 O HIS U 37 -50.280 -33.126 -2.530 1.00 87.07 O ATOM 221 CB HIS U 37 -48.402 -31.816 -4.877 1.00 81.05 C ATOM 222 CG HIS U 37 -47.305 -30.925 -5.350 1.00 82.05 C ATOM 223 ND1 HIS U 37 -47.533 -29.797 -6.098 1.00 83.48 N ATOM 224 CD2 HIS U 37 -45.969 -30.991 -5.175 1.00 82.85 C ATOM 225 CE1 HIS U 37 -46.387 -29.211 -6.373 1.00 81.59 C ATOM 226 NE2 HIS U 37 -45.422 -29.918 -5.827 1.00 81.73 N ATOM 227 H HIS U 37 -47.535 -32.528 -2.426 1.00 0.00 H ATOM 228 N ARG U 37A -51.357 -31.610 -3.798 1.00111.20 N ATOM 229 CA ARG U 37A -52.691 -32.059 -3.453 1.00110.86 C ATOM 230 C ARG U 37A -52.755 -33.536 -3.802 1.00106.16 C ATOM 231 O ARG U 37A -53.456 -34.303 -3.169 1.00 97.51 O ATOM 232 CB ARG U 37A -53.761 -31.206 -4.148 1.00112.62 C ATOM 233 CG ARG U 37A -53.446 -29.710 -4.116 1.00115.23 C ATOM 234 CD ARG U 37A -54.545 -28.841 -4.718 1.00118.67 C ATOM 235 NE ARG U 37A -55.756 -28.852 -3.900 1.00123.02 N ATOM 236 CZ ARG U 37A -56.452 -27.779 -3.538 1.00125.64 C ATOM 237 NH1 ARG U 37A -56.086 -26.569 -3.924 1.00129.17 N ATOM 238 NH2 ARG U 37A -57.529 -27.922 -2.790 1.00125.04 N ATOM 239 HE ARG U 37A -56.102 -29.777 -3.574 1.00 0.00 H ATOM 240 HH12 ARG U 37A -56.642 -25.740 -3.632 1.00 0.00 H ATOM 241 HH11 ARG U 37A -55.242 -26.446 -4.520 1.00 0.00 H ATOM 242 HH22 ARG U 37A -58.078 -27.086 -2.503 1.00 0.00 H ATOM 243 HH21 ARG U 37A -57.829 -28.870 -2.487 1.00 0.00 H ATOM 244 H ARG U 37A -51.250 -30.854 -4.504 1.00 0.00 H ATOM 245 N GLY U 37B -51.978 -33.940 -4.789 1.00102.44 N ATOM 246 CA GLY U 37B -51.807 -35.351 -5.066 1.00103.90 C ATOM 247 C GLY U 37B -51.190 -36.108 -3.899 1.00104.24 C ATOM 248 O GLY U 37B -51.521 -37.238 -3.609 1.00102.54 O ATOM 249 H GLY U 37B -51.483 -33.237 -5.374 1.00 0.00 H ATOM 250 N GLY U 37C -50.274 -35.471 -3.207 1.00 77.17 N ATOM 251 CA GLY U 37C -49.393 -36.178 -2.314 1.00 80.51 C ATOM 252 C GLY U 37C -48.008 -36.232 -2.917 1.00 84.23 C ATOM 253 O GLY U 37C -47.083 -36.725 -2.286 1.00 83.50 O ATOM 254 H GLY U 37C -50.183 -34.440 -3.305 1.00 0.00 H ATOM 255 N SER U 37D -47.853 -35.688 -4.122 1.00 78.92 N ATOM 256 CA SER U 37D -46.545 -35.403 -4.638 1.00 80.27 C ATOM 257 C SER U 37D -45.936 -34.277 -3.833 1.00 78.51 C ATOM 258 O SER U 37D -46.613 -33.330 -3.467 1.00 77.55 O ATOM 259 CB SER U 37D -46.611 -35.009 -6.098 1.00 83.02 C ATOM 260 OG SER U 37D -47.942 -34.818 -6.491 1.00 87.81 O ATOM 261 HG SER U 37D -47.969 -34.561 -7.447 1.00 0.00 H ATOM 262 H SER U 37D -48.691 -35.467 -4.697 1.00 0.00 H ATOM 263 N VAL U 38 -44.646 -34.411 -3.570 1.00 76.08 N ATOM 264 CA VAL U 38 -43.829 -33.416 -2.911 1.00 69.86 C ATOM 265 C VAL U 38 -42.628 -33.052 -3.785 1.00 63.50 C ATOM 266 O VAL U 38 -41.856 -33.905 -4.150 1.00 58.34 O ATOM 267 CB VAL U 38 -43.320 -33.992 -1.596 1.00 70.53 C ATOM 268 CG1 VAL U 38 -42.304 -33.078 -0.951 1.00 69.37 C ATOM 269 CG2 VAL U 38 -44.484 -34.261 -0.674 1.00 68.11 C ATOM 270 H VAL U 38 -44.185 -35.298 -3.859 1.00 0.00 H ATOM 271 N THR U 39 -42.456 -31.775 -4.076 1.00 56.87 N ATOM 272 CA THR U 39 -41.393 -31.345 -4.944 1.00 51.83 C ATOM 273 C THR U 39 -40.630 -30.205 -4.325 1.00 46.15 C ATOM 274 O THR U 39 -41.149 -29.487 -3.529 1.00 45.59 O ATOM 275 CB THR U 39 -41.942 -30.869 -6.267 1.00 52.57 C ATOM 276 OG1 THR U 39 -42.867 -29.837 -6.013 1.00 55.45 O ATOM 277 CG2 THR U 39 -42.655 -31.963 -6.962 1.00 55.49 C ATOM 278 HG1 THR U 39 -43.600 -30.184 -5.445 1.00 0.00 H ATOM 279 H THR U 39 -43.101 -31.068 -3.670 1.00 0.00 H ATOM 280 N TYR U 40 -39.381 -30.068 -4.703 1.00 43.29 N ATOM 281 CA TYR U 40 -38.482 -29.074 -4.134 1.00 41.57 C ATOM 282 C TYR U 40 -38.915 -27.706 -4.563 1.00 41.58 C ATOM 283 O TYR U 40 -39.397 -27.529 -5.668 1.00 42.00 O ATOM 284 CB TYR U 40 -37.086 -29.313 -4.624 1.00 39.30 C ATOM 285 CG TYR U 40 -36.026 -28.465 -3.990 1.00 34.36 C ATOM 286 CD1 TYR U 40 -35.644 -28.679 -2.679 1.00 33.54 C ATOM 287 CD2 TYR U 40 -35.348 -27.509 -4.723 1.00 32.64 C ATOM 288 CE1 TYR U 40 -34.623 -27.957 -2.097 1.00 34.32 C ATOM 289 CE2 TYR U 40 -34.337 -26.751 -4.154 1.00 33.22 C ATOM 290 CZ TYR U 40 -33.979 -26.986 -2.826 1.00 35.42 C ATOM 291 OH TYR U 40 -32.952 -26.284 -2.245 1.00 33.17 O ATOM 292 HH TYR U 40 -32.115 -26.450 -2.747 1.00 0.00 H ATOM 293 H TYR U 40 -39.016 -30.699 -5.444 1.00 0.00 H ATOM 294 N VAL U 41 -38.801 -26.748 -3.661 1.00 39.79 N ATOM 295 CA VAL U 41 -39.213 -25.394 -3.958 1.00 41.50 C ATOM 296 C VAL U 41 -37.996 -24.520 -4.083 1.00 40.49 C ATOM 297 O VAL U 41 -37.768 -23.900 -5.115 1.00 36.33 O ATOM 298 CB VAL U 41 -40.138 -24.839 -2.859 1.00 43.58 C ATOM 299 CG1 VAL U 41 -40.355 -23.354 -3.025 1.00 45.95 C ATOM 300 CG2 VAL U 41 -41.482 -25.539 -2.902 1.00 48.15 C ATOM 301 H VAL U 41 -38.409 -26.971 -2.724 1.00 0.00 H ATOM 302 N CYS U 42 -37.180 -24.523 -3.034 1.00 37.79 N ATOM 303 CA CYS U 42 -36.166 -23.516 -2.852 1.00 36.36 C ATOM 304 C CYS U 42 -35.206 -23.868 -1.727 1.00 35.53 C ATOM 305 O CYS U 42 -35.465 -24.755 -0.922 1.00 33.82 O ATOM 306 CB CYS U 42 -36.839 -22.210 -2.470 1.00 37.79 C ATOM 307 SG CYS U 42 -37.313 -21.106 -3.831 1.00 38.35 S ATOM 308 H CYS U 42 -37.276 -25.275 -2.323 1.00 0.00 H ATOM 309 N GLY U 43 -34.101 -23.145 -1.667 1.00 35.66 N ATOM 310 CA GLY U 43 -33.202 -23.260 -0.542 1.00 38.37 C ATOM 311 C GLY U 43 -33.535 -22.234 0.522 1.00 35.55 C ATOM 312 O GLY U 43 -34.451 -21.394 0.377 1.00 32.65 O ATOM 313 H GLY U 43 -33.876 -22.485 -2.439 1.00 0.00 H ATOM 314 N GLY U 44 -32.789 -22.348 1.616 1.00 37.01 N ATOM 315 CA GLY U 44 -32.863 -21.436 2.732 1.00 33.76 C ATOM 316 C GLY U 44 -31.647 -21.627 3.634 1.00 35.83 C ATOM 317 O GLY U 44 -30.769 -22.472 3.362 1.00 34.91 O ATOM 318 H GLY U 44 -32.115 -23.138 1.671 1.00 0.00 H ATOM 319 N SER U 45 -31.626 -20.860 4.722 1.00 34.79 N ATOM 320 CA SER U 45 -30.531 -20.832 5.658 1.00 34.43 C ATOM 321 C SER U 45 -31.067 -20.757 7.082 1.00 38.45 C ATOM 322 O SER U 45 -31.959 -19.959 7.359 1.00 37.52 O ATOM 323 CB SER U 45 -29.654 -19.625 5.383 1.00 38.00 C ATOM 324 OG SER U 45 -29.166 -19.644 4.057 1.00 42.00 O ATOM 325 HG SER U 45 -29.929 -19.633 3.426 1.00 0.00 H ATOM 326 H SER U 45 -32.446 -20.247 4.907 1.00 0.00 H ATOM 327 N LEU U 46 -30.493 -21.582 7.962 1.00 36.00 N ATOM 328 CA LEU U 46 -30.874 -21.677 9.351 1.00 41.73 C ATOM 329 C LEU U 46 -30.169 -20.574 10.153 1.00 41.40 C ATOM 330 O LEU U 46 -28.976 -20.661 10.422 1.00 42.83 O ATOM 331 CB LEU U 46 -30.477 -23.045 9.884 1.00 40.75 C ATOM 332 CG LEU U 46 -30.946 -23.349 11.312 1.00 40.88 C ATOM 333 CD1 LEU U 46 -32.460 -23.386 11.371 1.00 37.44 C ATOM 334 CD2 LEU U 46 -30.370 -24.660 11.832 1.00 39.75 C ATOM 335 H LEU U 46 -29.723 -22.195 7.625 1.00 0.00 H ATOM 336 N ILE U 47 -30.891 -19.516 10.495 1.00 41.72 N ATOM 337 CA ILE U 47 -30.252 -18.375 11.190 1.00 43.75 C ATOM 338 C ILE U 47 -30.432 -18.422 12.699 1.00 44.22 C ATOM 339 O ILE U 47 -29.799 -17.663 13.425 1.00 53.46 O ATOM 340 CB ILE U 47 -30.780 -17.008 10.719 1.00 42.71 C ATOM 341 CG1 ILE U 47 -32.301 -16.898 10.908 1.00 42.36 C ATOM 342 CG2 ILE U 47 -30.370 -16.738 9.283 1.00 45.40 C ATOM 343 CD1 ILE U 47 -32.800 -15.480 10.705 1.00 45.46 C ATOM 344 H ILE U 47 -31.907 -19.487 10.275 1.00 0.00 H ATOM 345 N SER U 48 -31.328 -19.277 13.158 1.00 45.32 N ATOM 346 CA SER U 48 -31.430 -19.602 14.563 1.00 48.37 C ATOM 347 C SER U 48 -32.214 -20.897 14.657 1.00 48.96 C ATOM 348 O SER U 48 -32.800 -21.320 13.665 1.00 53.11 O ATOM 349 CB SER U 48 -32.105 -18.459 15.338 1.00 51.30 C ATOM 350 OG SER U 48 -33.433 -18.272 14.916 1.00 50.24 O ATOM 351 HG SER U 48 -33.841 -17.532 15.431 1.00 0.00 H ATOM 352 H SER U 48 -31.981 -19.731 12.487 1.00 0.00 H ATOM 353 N PRO U 49 -32.232 -21.538 15.843 1.00 50.72 N ATOM 354 CA PRO U 49 -32.841 -22.850 15.958 1.00 49.36 C ATOM 355 C PRO U 49 -34.231 -22.957 15.385 1.00 50.37 C ATOM 356 O PRO U 49 -34.555 -23.995 14.817 1.00 55.31 O ATOM 357 CB PRO U 49 -32.879 -23.089 17.464 1.00 51.01 C ATOM 358 CG PRO U 49 -31.712 -22.334 17.973 1.00 50.67 C ATOM 359 CD PRO U 49 -31.612 -21.118 17.112 1.00 50.33 C ATOM 360 N CYS U 50 -35.049 -21.919 15.531 1.00 47.51 N ATOM 361 CA CYS U 50 -36.448 -21.981 15.081 1.00 48.08 C ATOM 362 C CYS U 50 -36.718 -21.270 13.768 1.00 44.23 C ATOM 363 O CYS U 50 -37.863 -21.249 13.316 1.00 42.80 O ATOM 364 CB CYS U 50 -37.364 -21.369 16.146 1.00 56.60 C ATOM 365 SG CYS U 50 -37.256 -22.213 17.741 1.00 67.08 S ATOM 366 H CYS U 50 -34.693 -21.047 15.972 1.00 0.00 H ATOM 367 N TRP U 51 -35.688 -20.675 13.170 1.00 42.96 N ATOM 368 CA TRP U 51 -35.891 -19.749 12.056 1.00 48.51 C ATOM 369 C TRP U 51 -35.000 -20.041 10.861 1.00 47.23 C ATOM 370 O TRP U 51 -33.758 -20.076 10.975 1.00 42.27 O ATOM 371 CB TRP U 51 -35.652 -18.294 12.476 1.00 48.51 C ATOM 372 CG TRP U 51 -36.721 -17.743 13.358 1.00 52.09 C ATOM 373 CD1 TRP U 51 -36.670 -17.599 14.717 1.00 50.23 C ATOM 374 CD2 TRP U 51 -38.015 -17.267 12.951 1.00 52.32 C ATOM 375 NE1 TRP U 51 -37.846 -17.057 15.182 1.00 50.91 N ATOM 376 CE2 TRP U 51 -38.694 -16.850 14.126 1.00 54.06 C ATOM 377 CE3 TRP U 51 -38.666 -17.157 11.720 1.00 53.07 C ATOM 378 CZ2 TRP U 51 -39.987 -16.317 14.101 1.00 52.84 C ATOM 379 CZ3 TRP U 51 -39.973 -16.636 11.695 1.00 53.59 C ATOM 380 CH2 TRP U 51 -40.613 -16.221 12.887 1.00 55.03 C ATOM 381 HE1 TRP U 51 -38.058 -16.839 16.177 1.00 0.00 H ATOM 382 H TRP U 51 -34.722 -20.872 13.501 1.00 0.00 H ATOM 383 N VAL U 52 -35.657 -20.203 9.717 1.00 43.81 N ATOM 384 CA VAL U 52 -34.989 -20.319 8.449 1.00 43.34 C ATOM 385 C VAL U 52 -35.335 -19.098 7.616 1.00 43.49 C ATOM 386 O VAL U 52 -36.498 -18.674 7.561 1.00 45.21 O ATOM 387 CB VAL U 52 -35.416 -21.617 7.742 1.00 43.79 C ATOM 388 CG1 VAL U 52 -35.064 -21.574 6.256 1.00 44.57 C ATOM 389 CG2 VAL U 52 -34.773 -22.807 8.442 1.00 43.43 C ATOM 390 H VAL U 52 -36.696 -20.248 9.740 1.00 0.00 H ATOM 391 N ILE U 53 -34.319 -18.522 6.984 1.00 40.38 N ATOM 392 CA ILE U 53 -34.513 -17.419 6.060 1.00 40.01 C ATOM 393 C ILE U 53 -34.376 -17.884 4.596 1.00 39.39 C ATOM 394 O ILE U 53 -33.523 -18.736 4.272 1.00 39.14 O ATOM 395 CB ILE U 53 -33.553 -16.251 6.386 1.00 43.60 C ATOM 396 CG1 ILE U 53 -34.101 -14.929 5.841 1.00 44.53 C ATOM 397 CG2 ILE U 53 -32.157 -16.505 5.858 1.00 44.39 C ATOM 398 CD1 ILE U 53 -33.468 -13.716 6.482 1.00 48.23 C ATOM 399 H ILE U 53 -33.355 -18.872 7.156 1.00 0.00 H ATOM 400 N SER U 54 -35.220 -17.325 3.729 1.00 38.64 N ATOM 401 CA SER U 54 -35.256 -17.655 2.295 1.00 36.76 C ATOM 402 C SER U 54 -35.737 -16.442 1.491 1.00 40.32 C ATOM 403 O SER U 54 -35.573 -15.295 1.927 1.00 39.82 O ATOM 404 CB SER U 54 -36.178 -18.856 2.057 1.00 37.57 C ATOM 405 OG SER U 54 -36.117 -19.351 0.720 1.00 39.13 O ATOM 406 HG SER U 54 -35.191 -19.638 0.517 1.00 0.00 H ATOM 407 H SER U 54 -35.891 -16.615 4.086 1.00 0.00 H ATOM 408 N ALA U 55 -36.295 -16.699 0.302 1.00 40.98 N ATOM 409 CA ALA U 55 -36.776 -15.641 -0.574 1.00 42.18 C ATOM 410 C ALA U 55 -38.305 -15.669 -0.662 1.00 44.12 C ATOM 411 O ALA U 55 -38.916 -16.739 -0.701 1.00 42.16 O ATOM 412 CB ALA U 55 -36.163 -15.806 -1.949 1.00 42.30 C ATOM 413 H ALA U 55 -36.388 -17.688 -0.006 1.00 0.00 H ATOM 414 N THR U 56 -38.923 -14.492 -0.718 1.00 45.17 N ATOM 415 CA THR U 56 -40.393 -14.401 -0.780 1.00 43.53 C ATOM 416 C THR U 56 -40.953 -15.006 -2.049 1.00 40.34 C ATOM 417 O THR U 56 -42.022 -15.609 -2.025 1.00 38.87 O ATOM 418 CB THR U 56 -40.872 -12.946 -0.662 1.00 43.81 C ATOM 419 OG1 THR U 56 -40.824 -12.557 0.710 1.00 46.34 O ATOM 420 CG2 THR U 56 -42.292 -12.781 -1.146 1.00 45.95 C ATOM 421 HG1 THR U 56 -39.894 -12.633 1.041 1.00 0.00 H ATOM 422 H THR U 56 -38.358 -13.619 -0.718 1.00 0.00 H ATOM 423 N HIS U 57 -40.238 -14.855 -3.156 1.00 41.23 N ATOM 424 CA HIS U 57 -40.739 -15.325 -4.439 1.00 42.32 C ATOM 425 C HIS U 57 -40.961 -16.845 -4.501 1.00 47.56 C ATOM 426 O HIS U 57 -41.710 -17.319 -5.355 1.00 51.53 O ATOM 427 CB HIS U 57 -39.825 -14.862 -5.578 1.00 46.58 C ATOM 428 CG HIS U 57 -38.560 -15.652 -5.712 1.00 50.01 C ATOM 429 ND1 HIS U 57 -37.319 -15.124 -5.444 1.00 49.01 N ATOM 430 CD2 HIS U 57 -38.345 -16.930 -6.111 1.00 56.11 C ATOM 431 CE1 HIS U 57 -36.393 -16.042 -5.666 1.00 55.00 C ATOM 432 NE2 HIS U 57 -36.991 -17.147 -6.074 1.00 55.24 N ATOM 433 H HIS U 57 -39.307 -14.395 -3.106 1.00 0.00 H ATOM 434 N CYS U 58 -40.311 -17.616 -3.629 1.00 44.00 N ATOM 435 CA CYS U 58 -40.550 -19.071 -3.567 1.00 44.55 C ATOM 436 C CYS U 58 -41.945 -19.478 -3.087 1.00 47.20 C ATOM 437 O CYS U 58 -42.363 -20.625 -3.273 1.00 43.26 O ATOM 438 CB CYS U 58 -39.630 -19.709 -2.553 1.00 48.46 C ATOM 439 SG CYS U 58 -37.871 -19.497 -2.739 1.00 46.71 S ATOM 440 H CYS U 58 -39.623 -17.184 -2.980 1.00 0.00 H ATOM 441 N PHE U 59 -42.583 -18.583 -2.364 1.00 47.22 N ATOM 442 CA PHE U 59 -43.831 -18.860 -1.707 1.00 46.19 C ATOM 443 C PHE U 59 -45.006 -17.974 -2.122 1.00 49.48 C ATOM 444 O PHE U 59 -46.117 -18.214 -1.741 1.00 45.36 O ATOM 445 CB PHE U 59 -43.638 -18.759 -0.198 1.00 42.13 C ATOM 446 CG PHE U 59 -42.373 -19.393 0.302 1.00 42.64 C ATOM 447 CD1 PHE U 59 -42.322 -20.723 0.611 1.00 42.57 C ATOM 448 CD2 PHE U 59 -41.245 -18.648 0.482 1.00 43.61 C ATOM 449 CE1 PHE U 59 -41.168 -21.296 1.077 1.00 42.26 C ATOM 450 CE2 PHE U 59 -40.084 -19.219 0.939 1.00 43.86 C ATOM 451 CZ PHE U 59 -40.047 -20.543 1.235 1.00 39.25 C ATOM 452 H PHE U 59 -42.167 -17.635 -2.264 1.00 0.00 H ATOM 453 N ILE U 60 -44.743 -16.920 -2.864 1.00 50.75 N ATOM 454 CA ILE U 60 -45.742 -15.900 -3.090 1.00 55.02 C ATOM 455 C ILE U 60 -46.933 -16.483 -3.826 1.00 55.63 C ATOM 456 O ILE U 60 -48.042 -16.119 -3.565 1.00 55.17 O ATOM 457 CB ILE U 60 -45.175 -14.699 -3.836 1.00 58.11 C ATOM 458 CG1 ILE U 60 -46.102 -13.510 -3.695 1.00 60.50 C ATOM 459 CG2 ILE U 60 -44.950 -15.043 -5.288 1.00 57.73 C ATOM 460 CD1 ILE U 60 -46.087 -12.873 -2.334 1.00 59.51 C ATOM 461 H ILE U 60 -43.802 -16.819 -3.295 1.00 0.00 H ATOM 462 N ASP U 60A -46.676 -17.387 -4.753 1.00 57.42 N ATOM 463 CA ASP U 60A -47.715 -18.117 -5.443 1.00 60.74 C ATOM 464 C ASP U 60A -48.609 -19.066 -4.619 1.00 64.67 C ATOM 465 O ASP U 60A -49.777 -19.191 -4.894 1.00 55.29 O ATOM 466 CB ASP U 60A -47.130 -18.835 -6.628 1.00 66.93 C ATOM 467 CG ASP U 60A -46.300 -17.936 -7.489 1.00 72.91 C ATOM 468 OD1 ASP U 60A -46.347 -16.723 -7.309 1.00 80.73 O ATOM 469 OD2 ASP U 60A -45.581 -18.424 -8.360 1.00 83.15 O ATOM 470 H ASP U 60A -45.684 -17.582 -4.997 1.00 0.00 H ATOM 471 N TYR U 60B -48.047 -19.757 -3.641 1.00 66.71 N ATOM 472 CA TYR U 60B -48.790 -20.683 -2.810 1.00 76.65 C ATOM 473 C TYR U 60B -48.527 -20.352 -1.317 1.00 77.00 C ATOM 474 O TYR U 60B -47.751 -21.042 -0.696 1.00 73.91 O ATOM 475 CB TYR U 60B -48.345 -22.114 -3.100 1.00 83.88 C ATOM 476 CG TYR U 60B -48.493 -22.611 -4.519 1.00 91.56 C ATOM 477 CD1 TYR U 60B -47.936 -21.943 -5.581 1.00 95.87 C ATOM 478 CD2 TYR U 60B -49.186 -23.777 -4.775 1.00 99.03 C ATOM 479 CE1 TYR U 60B -48.090 -22.412 -6.874 1.00100.53 C ATOM 480 CE2 TYR U 60B -49.345 -24.252 -6.054 1.00100.57 C ATOM 481 CZ TYR U 60B -48.795 -23.565 -7.100 1.00103.97 C ATOM 482 OH TYR U 60B -48.958 -24.071 -8.369 1.00109.94 O ATOM 483 HH TYR U 60B -48.511 -23.475 -9.021 1.00 0.00 H ATOM 484 H TYR U 60B -47.031 -19.631 -3.461 1.00 0.00 H ATOM 485 N PRO U 60C -49.191 -19.234 -0.788 1.00 63.06 N ATOM 486 CA PRO U 60C -48.706 -18.753 0.534 1.00 64.02 C ATOM 487 C PRO U 60C -49.324 -19.227 1.853 1.00 60.68 C ATOM 488 O PRO U 60C -49.825 -18.519 2.715 1.00 65.17 O ATOM 489 CB PRO U 60C -48.820 -17.261 0.421 1.00 66.33 C ATOM 490 CG PRO U 60C -49.963 -17.022 -0.466 1.00 66.32 C ATOM 491 CD PRO U 60C -50.370 -18.310 -1.085 1.00 67.00 C ATOM 492 N LYS U 61 -49.171 -20.514 1.951 1.00 62.08 N ATOM 493 CA LYS U 61 -49.873 -21.196 2.884 1.00 61.60 C ATOM 494 C LYS U 61 -48.926 -22.148 3.497 1.00 60.77 C ATOM 495 O LYS U 61 -48.489 -23.089 2.883 1.00 56.43 O ATOM 496 CB LYS U 61 -50.938 -21.907 2.130 1.00 69.65 C ATOM 497 CG LYS U 61 -51.693 -22.754 3.055 1.00 75.49 C ATOM 498 CD LYS U 61 -52.198 -23.944 2.345 1.00 80.32 C ATOM 499 CE LYS U 61 -53.647 -24.112 2.690 1.00 84.83 C ATOM 500 NZ LYS U 61 -54.332 -24.988 1.706 1.00 88.60 N ATOM 501 HZ1 LYS U 61 -54.262 -24.565 0.759 1.00 0.00 H ATOM 502 HZ2 LYS U 61 -53.879 -25.924 1.703 1.00 0.00 H ATOM 503 HZ3 LYS U 61 -55.333 -25.087 1.970 1.00 0.00 H ATOM 504 H LYS U 61 -48.515 -21.014 1.318 1.00 0.00 H ATOM 505 N LYS U 62 -48.632 -21.902 4.758 1.00 54.11 N ATOM 506 CA LYS U 62 -47.611 -22.571 5.479 1.00 56.38 C ATOM 507 C LYS U 62 -47.766 -24.081 5.575 1.00 52.99 C ATOM 508 O LYS U 62 -46.839 -24.802 5.682 1.00 53.12 O ATOM 509 CB LYS U 62 -47.472 -21.953 6.857 1.00 54.68 C ATOM 510 CG LYS U 62 -48.741 -21.904 7.672 1.00 58.98 C ATOM 511 CD LYS U 62 -48.449 -21.521 9.117 1.00 63.42 C ATOM 512 CE LYS U 62 -49.660 -21.603 10.024 1.00 67.62 C ATOM 513 NZ LYS U 62 -49.430 -20.887 11.302 1.00 69.83 N ATOM 514 HZ1 LYS U 62 -48.619 -21.312 11.795 1.00 0.00 H ATOM 515 HZ2 LYS U 62 -49.232 -19.885 11.106 1.00 0.00 H ATOM 516 HZ3 LYS U 62 -50.279 -20.963 11.898 1.00 0.00 H ATOM 517 H LYS U 62 -49.183 -21.173 5.254 1.00 0.00 H ATOM 518 N GLU U 62A -49.013 -24.546 5.537 1.00 69.53 N ATOM 519 CA GLU U 62A -49.290 -25.966 5.673 1.00 66.42 C ATOM 520 C GLU U 62A -48.721 -26.826 4.573 1.00 60.81 C ATOM 521 O GLU U 62A -48.433 -27.977 4.794 1.00 59.41 O ATOM 522 CB GLU U 62A -50.774 -26.217 5.801 1.00 65.03 C ATOM 523 CG GLU U 62A -51.274 -25.974 7.191 1.00 67.39 C ATOM 524 CD GLU U 62A -51.735 -24.559 7.396 1.00 68.00 C ATOM 525 OE1 GLU U 62A -52.108 -23.898 6.418 1.00 67.30 O ATOM 526 OE2 GLU U 62A -51.724 -24.111 8.543 1.00 66.88 O ATOM 527 H GLU U 62A -49.802 -23.881 5.408 1.00 0.00 H ATOM 528 N ASP U 63 -48.640 -26.302 3.370 1.00 56.42 N ATOM 529 CA ASP U 63 -48.130 -27.080 2.257 1.00 57.82 C ATOM 530 C ASP U 63 -46.633 -27.377 2.241 1.00 55.12 C ATOM 531 O ASP U 63 -46.187 -28.169 1.455 1.00 55.74 O ATOM 532 CB ASP U 63 -48.561 -26.484 0.938 1.00 60.33 C ATOM 533 CG ASP U 63 -50.048 -26.526 0.752 1.00 66.56 C ATOM 534 OD1 ASP U 63 -50.663 -27.593 0.916 1.00 68.69 O ATOM 535 OD2 ASP U 63 -50.616 -25.478 0.460 1.00 69.37 O ATOM 536 H ASP U 63 -48.945 -25.320 3.215 1.00 0.00 H ATOM 537 N TYR U 64 -45.869 -26.722 3.094 1.00 54.04 N ATOM 538 CA TYR U 64 -44.419 -26.784 3.056 1.00 50.81 C ATOM 539 C TYR U 64 -43.758 -27.595 4.140 1.00 48.99 C ATOM 540 O TYR U 64 -44.174 -27.578 5.266 1.00 50.16 O ATOM 541 CB TYR U 64 -43.862 -25.379 3.106 1.00 50.19 C ATOM 542 CG TYR U 64 -44.312 -24.526 1.976 1.00 48.09 C ATOM 543 CD1 TYR U 64 -43.639 -24.536 0.781 1.00 48.04 C ATOM 544 CD2 TYR U 64 -45.414 -23.730 2.088 1.00 46.28 C ATOM 545 CE1 TYR U 64 -44.048 -23.765 -0.274 1.00 47.81 C ATOM 546 CE2 TYR U 64 -45.824 -22.950 1.035 1.00 52.86 C ATOM 547 CZ TYR U 64 -45.129 -22.981 -0.141 1.00 48.71 C ATOM 548 OH TYR U 64 -45.508 -22.232 -1.179 1.00 53.15 O ATOM 549 HH TYR U 64 -46.428 -22.481 -1.446 1.00 0.00 H ATOM 550 H TYR U 64 -46.324 -26.137 3.824 1.00 0.00 H ATOM 551 N ILE U 65 -42.719 -28.311 3.756 1.00 48.07 N ATOM 552 CA ILE U 65 -41.842 -29.038 4.643 1.00 48.25 C ATOM 553 C ILE U 65 -40.437 -28.462 4.494 1.00 49.52 C ATOM 554 O ILE U 65 -40.012 -28.092 3.389 1.00 44.43 O ATOM 555 CB ILE U 65 -41.753 -30.529 4.283 1.00 52.55 C ATOM 556 CG1 ILE U 65 -43.135 -31.142 4.049 1.00 56.86 C ATOM 557 CG2 ILE U 65 -41.032 -31.286 5.387 1.00 55.29 C ATOM 558 CD1 ILE U 65 -43.073 -32.591 3.588 1.00 58.26 C ATOM 559 H ILE U 65 -42.516 -28.355 2.737 1.00 0.00 H ATOM 560 N VAL U 66 -39.701 -28.425 5.597 1.00 42.77 N ATOM 561 CA VAL U 66 -38.321 -27.981 5.583 1.00 41.81 C ATOM 562 C VAL U 66 -37.446 -29.112 6.115 1.00 40.80 C ATOM 563 O VAL U 66 -37.711 -29.669 7.190 1.00 42.11 O ATOM 564 CB VAL U 66 -38.091 -26.731 6.474 1.00 42.15 C ATOM 565 CG1 VAL U 66 -36.619 -26.327 6.483 1.00 42.63 C ATOM 566 CG2 VAL U 66 -38.944 -25.563 6.031 1.00 43.02 C ATOM 567 H VAL U 66 -40.126 -28.723 6.498 1.00 0.00 H ATOM 568 N TYR U 67 -36.392 -29.433 5.383 1.00 37.34 N ATOM 569 CA TYR U 67 -35.389 -30.384 5.855 1.00 37.53 C ATOM 570 C TYR U 67 -34.116 -29.642 6.142 1.00 38.10 C ATOM 571 O TYR U 67 -33.772 -28.683 5.441 1.00 40.71 O ATOM 572 CB TYR U 67 -35.073 -31.436 4.797 1.00 36.98 C ATOM 573 CG TYR U 67 -36.068 -32.532 4.708 1.00 42.80 C ATOM 574 CD1 TYR U 67 -37.182 -32.411 3.878 1.00 43.20 C ATOM 575 CD2 TYR U 67 -35.913 -33.709 5.444 1.00 43.69 C ATOM 576 CE1 TYR U 67 -38.112 -33.426 3.776 1.00 45.60 C ATOM 577 CE2 TYR U 67 -36.855 -34.729 5.348 1.00 46.75 C ATOM 578 CZ TYR U 67 -37.942 -34.581 4.506 1.00 46.42 C ATOM 579 OH TYR U 67 -38.888 -35.577 4.384 1.00 56.17 O ATOM 580 HH TYR U 67 -38.454 -36.404 4.057 1.00 0.00 H ATOM 581 H TYR U 67 -36.274 -28.997 4.446 1.00 0.00 H ATOM 582 N LEU U 68 -33.422 -30.117 7.167 1.00 37.88 N ATOM 583 CA LEU U 68 -32.108 -29.653 7.532 1.00 33.77 C ATOM 584 C LEU U 68 -31.311 -30.915 7.610 1.00 32.22 C ATOM 585 O LEU U 68 -31.876 -31.989 7.728 1.00 36.25 O ATOM 586 CB LEU U 68 -32.148 -28.964 8.906 1.00 36.70 C ATOM 587 CG LEU U 68 -32.969 -27.681 9.035 1.00 37.26 C ATOM 588 CD1 LEU U 68 -32.963 -27.228 10.492 1.00 41.04 C ATOM 589 CD2 LEU U 68 -32.445 -26.542 8.185 1.00 37.57 C ATOM 590 H LEU U 68 -33.852 -30.870 7.742 1.00 0.00 H ATOM 591 N GLY U 69 -30.002 -30.809 7.494 1.00 33.34 N ATOM 592 CA GLY U 69 -29.137 -31.989 7.542 1.00 36.46 C ATOM 593 C GLY U 69 -29.238 -32.845 6.291 1.00 37.49 C ATOM 594 O GLY U 69 -28.874 -34.006 6.309 1.00 39.12 O ATOM 595 H GLY U 69 -29.576 -29.869 7.366 1.00 0.00 H ATOM 596 N ARG U 70 -29.769 -32.272 5.210 1.00 36.82 N ATOM 597 CA ARG U 70 -30.090 -33.042 4.001 1.00 38.90 C ATOM 598 C ARG U 70 -29.111 -32.686 2.892 1.00 36.22 C ATOM 599 O ARG U 70 -28.933 -31.515 2.555 1.00 35.51 O ATOM 600 CB ARG U 70 -31.512 -32.722 3.589 1.00 44.01 C ATOM 601 CG ARG U 70 -31.998 -33.390 2.328 1.00 46.27 C ATOM 602 CD ARG U 70 -33.269 -34.124 2.629 1.00 48.68 C ATOM 603 NE ARG U 70 -34.061 -34.405 1.458 1.00 54.34 N ATOM 604 CZ ARG U 70 -35.025 -35.320 1.414 1.00 52.99 C ATOM 605 NH1 ARG U 70 -35.314 -36.068 2.475 1.00 55.01 N ATOM 606 NH2 ARG U 70 -35.703 -35.485 0.296 1.00 53.26 N ATOM 607 HE ARG U 70 -33.867 -33.859 0.595 1.00 0.00 H ATOM 608 HH12 ARG U 70 -36.072 -36.778 2.420 1.00 0.00 H ATOM 609 HH11 ARG U 70 -34.782 -35.943 3.360 1.00 0.00 H ATOM 610 HH22 ARG U 70 -36.460 -36.197 0.247 1.00 0.00 H ATOM 611 HH21 ARG U 70 -35.481 -34.903 -0.537 1.00 0.00 H ATOM 612 H ARG U 70 -29.961 -31.250 5.223 1.00 0.00 H ATOM 613 N SER U 71 -28.472 -33.717 2.352 1.00 37.55 N ATOM 614 CA SER U 71 -27.442 -33.592 1.324 1.00 37.11 C ATOM 615 C SER U 71 -27.970 -33.956 -0.076 1.00 38.89 C ATOM 616 O SER U 71 -27.293 -33.696 -1.081 1.00 33.10 O ATOM 617 CB SER U 71 -26.279 -34.544 1.620 1.00 37.18 C ATOM 618 OG SER U 71 -25.168 -33.878 2.177 1.00 43.77 O ATOM 619 HG SER U 71 -24.445 -34.532 2.350 1.00 0.00 H ATOM 620 H SER U 71 -28.720 -34.672 2.681 1.00 0.00 H ATOM 621 N ARG U 72 -29.119 -34.611 -0.130 1.00 34.80 N ATOM 622 CA ARG U 72 -29.630 -35.104 -1.402 1.00 37.86 C ATOM 623 C ARG U 72 -31.037 -34.611 -1.655 1.00 40.26 C ATOM 624 O ARG U 72 -31.817 -34.408 -0.708 1.00 40.44 O ATOM 625 CB ARG U 72 -29.527 -36.619 -1.463 1.00 38.76 C ATOM 626 CG ARG U 72 -28.084 -37.093 -1.386 1.00 41.76 C ATOM 627 CD ARG U 72 -27.906 -38.525 -1.855 1.00 47.53 C ATOM 628 NE ARG U 72 -28.353 -38.708 -3.240 1.00 52.63 N ATOM 629 CZ ARG U 72 -27.608 -38.498 -4.338 1.00 53.79 C ATOM 630 NH1 ARG U 72 -26.345 -38.090 -4.256 1.00 52.87 N ATOM 631 NH2 ARG U 72 -28.137 -38.720 -5.533 1.00 56.84 N ATOM 632 HE ARG U 72 -29.332 -39.028 -3.385 1.00 0.00 H ATOM 633 HH12 ARG U 72 -25.791 -37.935 -5.123 1.00 0.00 H ATOM 634 HH11 ARG U 72 -25.911 -37.926 -3.325 1.00 0.00 H ATOM 635 HH22 ARG U 72 -27.570 -38.561 -6.390 1.00 0.00 H ATOM 636 HH21 ARG U 72 -29.119 -39.053 -5.613 1.00 0.00 H ATOM 637 H ARG U 72 -29.661 -34.775 0.742 1.00 0.00 H ATOM 638 N LEU U 73 -31.344 -34.393 -2.937 1.00 35.99 N ATOM 639 CA LEU U 73 -32.571 -33.711 -3.321 1.00 38.01 C ATOM 640 C LEU U 73 -33.803 -34.575 -3.119 1.00 38.25 C ATOM 641 O LEU U 73 -34.800 -34.126 -2.562 1.00 38.75 O ATOM 642 CB LEU U 73 -32.489 -33.280 -4.787 1.00 42.07 C ATOM 643 CG LEU U 73 -33.605 -32.350 -5.275 1.00 44.40 C ATOM 644 CD1 LEU U 73 -33.670 -31.087 -4.426 1.00 45.11 C ATOM 645 CD2 LEU U 73 -33.399 -31.996 -6.746 1.00 46.32 C ATOM 646 H LEU U 73 -30.691 -34.718 -3.678 1.00 0.00 H ATOM 647 N ASN U 74 -33.745 -35.814 -3.594 1.00 42.25 N ATOM 648 CA ASN U 74 -34.937 -36.671 -3.663 1.00 44.84 C ATOM 649 C ASN U 74 -34.775 -37.967 -2.906 1.00 48.28 C ATOM 650 O ASN U 74 -35.561 -38.881 -3.083 1.00 51.32 O ATOM 651 CB ASN U 74 -35.273 -36.982 -5.121 1.00 45.78 C ATOM 652 CG ASN U 74 -35.853 -35.794 -5.835 1.00 47.08 C ATOM 653 OD1 ASN U 74 -36.875 -35.275 -5.432 1.00 51.85 O ATOM 654 ND2 ASN U 74 -35.202 -35.350 -6.888 1.00 51.70 N ATOM 655 HD22 ASN U 74 -34.330 -35.825 -7.199 1.00 0.00 H ATOM 656 HD21 ASN U 74 -35.559 -34.524 -7.410 1.00 0.00 H ATOM 657 H ASN U 74 -32.833 -36.187 -3.926 1.00 0.00 H ATOM 658 N SER U 75 -33.755 -38.040 -2.063 1.00 47.97 N ATOM 659 CA SER U 75 -33.567 -39.177 -1.185 1.00 48.15 C ATOM 660 C SER U 75 -33.064 -38.695 0.194 1.00 47.10 C ATOM 661 O SER U 75 -32.642 -37.552 0.349 1.00 42.63 O ATOM 662 CB SER U 75 -32.613 -40.179 -1.821 1.00 49.46 C ATOM 663 OG SER U 75 -31.290 -39.707 -1.783 1.00 57.36 O ATOM 664 HG SER U 75 -30.691 -40.375 -2.201 1.00 0.00 H ATOM 665 H SER U 75 -33.070 -37.258 -2.031 1.00 0.00 H ATOM 666 N ASN U 76 -33.128 -39.570 1.186 1.00 49.91 N ATOM 667 CA ASN U 76 -32.868 -39.196 2.583 1.00 52.86 C ATOM 668 C ASN U 76 -31.377 -39.245 2.903 1.00 51.69 C ATOM 669 O ASN U 76 -30.665 -40.069 2.361 1.00 49.94 O ATOM 670 CB ASN U 76 -33.649 -40.121 3.515 1.00 57.26 C ATOM 671 CG ASN U 76 -35.149 -40.095 3.235 1.00 60.05 C ATOM 672 OD1 ASN U 76 -35.717 -41.082 2.781 1.00 62.49 O ATOM 673 ND2 ASN U 76 -35.783 -38.953 3.471 1.00 59.73 N ATOM 674 HD22 ASN U 76 -35.263 -38.139 3.857 1.00 0.00 H ATOM 675 HD21 ASN U 76 -36.800 -38.872 3.270 1.00 0.00 H ATOM 676 H ASN U 76 -33.371 -40.558 0.968 1.00 0.00 H ATOM 677 N THR U 77 -30.916 -38.333 3.757 1.00 45.11 N ATOM 678 CA THR U 77 -29.547 -38.303 4.229 1.00 45.47 C ATOM 679 C THR U 77 -29.642 -38.721 5.678 1.00 47.06 C ATOM 680 O THR U 77 -30.627 -38.404 6.346 1.00 41.91 O ATOM 681 CB THR U 77 -28.978 -36.863 4.215 1.00 44.97 C ATOM 682 OG1 THR U 77 -28.920 -36.372 2.894 1.00 47.88 O ATOM 683 CG2 THR U 77 -27.586 -36.783 4.830 1.00 50.16 C ATOM 684 HG1 THR U 77 -28.555 -35.452 2.901 1.00 0.00 H ATOM 685 H THR U 77 -31.573 -37.605 4.103 1.00 0.00 H ATOM 686 N GLN U 78 -28.642 -39.420 6.187 1.00 49.87 N ATOM 687 CA GLN U 78 -28.664 -39.741 7.607 1.00 56.51 C ATOM 688 C GLN U 78 -28.266 -38.513 8.419 1.00 53.34 C ATOM 689 O GLN U 78 -27.297 -37.818 8.098 1.00 53.10 O ATOM 690 CB GLN U 78 -27.766 -40.930 7.940 1.00 64.03 C ATOM 691 CG GLN U 78 -28.104 -41.621 9.265 1.00 73.81 C ATOM 692 CD GLN U 78 -29.585 -41.884 9.491 1.00 82.25 C ATOM 693 OE1 GLN U 78 -30.316 -41.025 10.000 1.00 90.78 O ATOM 694 NE2 GLN U 78 -30.030 -43.094 9.145 1.00 86.71 N ATOM 695 HE22 GLN U 78 -29.380 -43.785 8.720 1.00 0.00 H ATOM 696 HE21 GLN U 78 -31.027 -43.345 9.301 1.00 0.00 H ATOM 697 H GLN U 78 -27.855 -39.735 5.585 1.00 0.00 H ATOM 698 N GLY U 79 -29.029 -38.246 9.467 1.00 55.22 N ATOM 699 CA GLY U 79 -28.812 -37.065 10.292 1.00 55.82 C ATOM 700 C GLY U 79 -29.770 -35.951 9.936 1.00 56.13 C ATOM 701 O GLY U 79 -29.804 -34.927 10.630 1.00 57.04 O ATOM 702 H GLY U 79 -29.804 -38.896 9.708 1.00 0.00 H ATOM 703 N GLU U 80 -30.552 -36.132 8.864 1.00 51.47 N ATOM 704 CA GLU U 80 -31.514 -35.106 8.463 1.00 49.24 C ATOM 705 C GLU U 80 -32.656 -35.042 9.450 1.00 48.74 C ATOM 706 O GLU U 80 -32.958 -36.002 10.147 1.00 48.22 O ATOM 707 CB GLU U 80 -32.079 -35.355 7.073 1.00 49.82 C ATOM 708 CG GLU U 80 -33.132 -36.439 7.019 1.00 52.94 C ATOM 709 CD GLU U 80 -33.525 -36.820 5.598 1.00 56.02 C ATOM 710 OE1 GLU U 80 -32.866 -36.368 4.640 1.00 57.00 O ATOM 711 OE2 GLU U 80 -34.495 -37.584 5.443 1.00 58.47 O ATOM 712 H GLU U 80 -30.475 -37.010 8.312 1.00 0.00 H ATOM 713 N MET U 81 -33.306 -33.896 9.477 1.00 47.62 N ATOM 714 CA MET U 81 -34.436 -33.698 10.341 1.00 48.37 C ATOM 715 C MET U 81 -35.465 -32.943 9.529 1.00 46.86 C ATOM 716 O MET U 81 -35.137 -32.015 8.785 1.00 46.59 O ATOM 717 CB MET U 81 -34.021 -32.893 11.579 1.00 53.28 C ATOM 718 CG MET U 81 -32.864 -33.478 12.398 1.00 55.66 C ATOM 719 SD MET U 81 -33.113 -35.112 13.133 1.00 64.93 S ATOM 720 CE MET U 81 -34.856 -35.052 13.560 1.00 67.92 C ATOM 721 H MET U 81 -32.994 -33.119 8.860 1.00 0.00 H ATOM 722 N LYS U 82 -36.712 -33.348 9.685 1.00 45.75 N ATOM 723 CA LYS U 82 -37.830 -32.798 8.944 1.00 44.82 C ATOM 724 C LYS U 82 -38.665 -31.859 9.823 1.00 45.98 C ATOM 725 O LYS U 82 -38.942 -32.169 10.984 1.00 44.01 O ATOM 726 CB LYS U 82 -38.688 -33.947 8.451 1.00 42.27 C ATOM 727 CG LYS U 82 -39.970 -33.539 7.760 1.00 50.10 C ATOM 728 CD LYS U 82 -40.529 -34.688 6.926 1.00 54.01 C ATOM 729 CE LYS U 82 -42.049 -34.731 6.950 1.00 57.20 C ATOM 730 NZ LYS U 82 -42.520 -36.035 6.409 1.00 62.51 N ATOM 731 HZ1 LYS U 82 -42.186 -36.144 5.430 1.00 0.00 H ATOM 732 HZ2 LYS U 82 -42.142 -36.808 6.993 1.00 0.00 H ATOM 733 HZ3 LYS U 82 -43.560 -36.061 6.427 1.00 0.00 H ATOM 734 H LYS U 82 -36.902 -34.102 10.376 1.00 0.00 H ATOM 735 N PHE U 83 -39.096 -30.738 9.248 1.00 45.91 N ATOM 736 CA PHE U 83 -39.823 -29.717 9.987 1.00 46.86 C ATOM 737 C PHE U 83 -41.025 -29.177 9.234 1.00 49.94 C ATOM 738 O PHE U 83 -41.032 -29.101 7.998 1.00 45.25 O ATOM 739 CB PHE U 83 -38.912 -28.551 10.349 1.00 46.70 C ATOM 740 CG PHE U 83 -37.752 -28.938 11.206 1.00 47.76 C ATOM 741 CD1 PHE U 83 -37.893 -29.020 12.589 1.00 47.65 C ATOM 742 CD2 PHE U 83 -36.517 -29.232 10.637 1.00 45.16 C ATOM 743 CE1 PHE U 83 -36.824 -29.379 13.391 1.00 46.20 C ATOM 744 CE2 PHE U 83 -35.446 -29.596 11.431 1.00 45.20 C ATOM 745 CZ PHE U 83 -35.597 -29.661 12.817 1.00 47.54 C ATOM 746 H PHE U 83 -38.907 -30.587 8.237 1.00 0.00 H ATOM 747 N GLU U 84 -42.045 -28.816 10.013 1.00 52.57 N ATOM 748 CA GLU U 84 -43.216 -28.109 9.513 1.00 52.47 C ATOM 749 C GLU U 84 -42.990 -26.627 9.669 1.00 48.76 C ATOM 750 O GLU U 84 -42.144 -26.196 10.455 1.00 48.95 O ATOM 751 CB GLU U 84 -44.469 -28.501 10.299 1.00 61.14 C ATOM 752 CG GLU U 84 -44.884 -29.958 10.143 1.00 66.69 C ATOM 753 CD GLU U 84 -45.140 -30.352 8.690 1.00 72.98 C ATOM 754 OE1 GLU U 84 -45.781 -29.564 7.951 1.00 77.05 O ATOM 755 OE2 GLU U 84 -44.689 -31.450 8.280 1.00 76.58 O ATOM 756 H GLU U 84 -42.002 -29.050 11.025 1.00 0.00 H ATOM 757 N VAL U 85 -43.736 -25.852 8.899 1.00 50.93 N ATOM 758 CA VAL U 85 -43.664 -24.408 8.965 1.00 54.57 C ATOM 759 C VAL U 85 -44.758 -23.922 9.913 1.00 57.14 C ATOM 760 O VAL U 85 -45.943 -24.138 9.664 1.00 53.91 O ATOM 761 CB VAL U 85 -43.840 -23.745 7.589 1.00 53.89 C ATOM 762 CG1 VAL U 85 -43.669 -22.235 7.713 1.00 52.60 C ATOM 763 CG2 VAL U 85 -42.830 -24.304 6.603 1.00 55.17 C ATOM 764 H VAL U 85 -44.394 -26.294 8.226 1.00 0.00 H ATOM 765 N GLU U 86 -44.331 -23.281 10.996 1.00 61.18 N ATOM 766 CA GLU U 86 -45.228 -22.784 12.028 1.00 64.97 C ATOM 767 C GLU U 86 -45.742 -21.414 11.639 1.00 63.38 C ATOM 768 O GLU U 86 -46.900 -21.102 11.896 1.00 68.00 O ATOM 769 CB GLU U 86 -44.502 -22.722 13.368 1.00 69.40 C ATOM 770 CG GLU U 86 -45.367 -22.244 14.513 1.00 74.45 C ATOM 771 CD GLU U 86 -44.936 -22.816 15.848 1.00 81.23 C ATOM 772 OE1 GLU U 86 -44.928 -24.057 15.982 1.00 89.75 O ATOM 773 OE2 GLU U 86 -44.627 -22.029 16.769 1.00 86.88 O ATOM 774 H GLU U 86 -43.309 -23.128 11.111 1.00 0.00 H ATOM 775 N ASN U 87 -44.880 -20.584 11.053 1.00 57.95 N ATOM 776 CA ASN U 87 -45.368 -19.452 10.258 1.00 59.89 C ATOM 777 C ASN U 87 -44.458 -19.018 9.122 1.00 56.20 C ATOM 778 O ASN U 87 -43.221 -19.131 9.168 1.00 50.58 O ATOM 779 CB ASN U 87 -45.820 -18.245 11.102 1.00 65.15 C ATOM 780 CG ASN U 87 -44.818 -17.839 12.147 1.00 72.52 C ATOM 781 OD1 ASN U 87 -44.348 -18.670 12.931 1.00 84.27 O ATOM 782 ND2 ASN U 87 -44.513 -16.546 12.201 1.00 74.29 N ATOM 783 HD22 ASN U 87 -44.934 -15.883 11.519 1.00 0.00 H ATOM 784 HD21 ASN U 87 -43.853 -16.197 12.925 1.00 0.00 H ATOM 785 H ASN U 87 -43.857 -20.739 11.160 1.00 0.00 H ATOM 786 N LEU U 88 -45.124 -18.517 8.094 1.00 51.90 N ATOM 787 CA LEU U 88 -44.508 -18.194 6.841 1.00 50.82 C ATOM 788 C LEU U 88 -44.641 -16.701 6.678 1.00 50.11 C ATOM 789 O LEU U 88 -45.737 -16.196 6.466 1.00 53.95 O ATOM 790 CB LEU U 88 -45.229 -18.925 5.730 1.00 50.08 C ATOM 791 CG LEU U 88 -44.781 -18.643 4.300 1.00 49.60 C ATOM 792 CD1 LEU U 88 -43.299 -18.928 4.134 1.00 50.48 C ATOM 793 CD2 LEU U 88 -45.605 -19.485 3.350 1.00 47.49 C ATOM 794 H LEU U 88 -46.145 -18.349 8.201 1.00 0.00 H ATOM 795 N ILE U 89 -43.521 -16.001 6.804 1.00 45.67 N ATOM 796 CA ILE U 89 -43.515 -14.563 6.842 1.00 45.10 C ATOM 797 C ILE U 89 -42.933 -14.033 5.564 1.00 46.62 C ATOM 798 O ILE U 89 -41.715 -14.068 5.375 1.00 47.05 O ATOM 799 CB ILE U 89 -42.647 -14.057 8.008 1.00 46.99 C ATOM 800 CG1 ILE U 89 -43.055 -14.755 9.304 1.00 49.28 C ATOM 801 CG2 ILE U 89 -42.721 -12.546 8.114 1.00 48.74 C ATOM 802 CD1 ILE U 89 -42.462 -14.150 10.552 1.00 51.74 C ATOM 803 H ILE U 89 -42.617 -16.509 6.878 1.00 0.00 H ATOM 804 N LEU U 90 -43.793 -13.534 4.688 1.00 43.78 N ATOM 805 CA LEU U 90 -43.333 -12.899 3.485 1.00 47.57 C ATOM 806 C LEU U 90 -43.076 -11.420 3.749 1.00 52.68 C ATOM 807 O LEU U 90 -43.535 -10.868 4.755 1.00 57.06 O ATOM 808 CB LEU U 90 -44.347 -13.109 2.366 1.00 49.17 C ATOM 809 CG LEU U 90 -44.728 -14.581 2.141 1.00 49.47 C ATOM 810 CD1 LEU U 90 -45.541 -14.726 0.868 1.00 51.51 C ATOM 811 CD2 LEU U 90 -43.505 -15.495 2.094 1.00 50.73 C ATOM 812 H LEU U 90 -44.814 -13.603 4.874 1.00 0.00 H ATOM 813 N HIS U 91 -42.301 -10.797 2.868 1.00 53.79 N ATOM 814 CA HIS U 91 -42.057 -9.365 2.950 1.00 57.16 C ATOM 815 C HIS U 91 -43.228 -8.605 2.310 1.00 55.74 C ATOM 816 O HIS U 91 -43.656 -8.904 1.184 1.00 51.95 O ATOM 817 CB HIS U 91 -40.737 -8.986 2.270 1.00 58.05 C ATOM 818 CG HIS U 91 -40.181 -7.673 2.727 1.00 64.97 C ATOM 819 ND1 HIS U 91 -40.507 -6.474 2.129 1.00 68.50 N ATOM 820 CD2 HIS U 91 -39.330 -7.370 3.735 1.00 65.33 C ATOM 821 CE1 HIS U 91 -39.871 -5.493 2.744 1.00 66.63 C ATOM 822 NE2 HIS U 91 -39.153 -6.010 3.723 1.00 66.12 N ATOM 823 H HIS U 91 -41.859 -11.345 2.103 1.00 0.00 H ATOM 824 N LYS U 92 -43.721 -7.597 3.018 1.00 60.12 N ATOM 825 CA LYS U 92 -44.935 -6.910 2.600 1.00 61.57 C ATOM 826 C LYS U 92 -44.643 -5.947 1.447 1.00 59.53 C ATOM 827 O LYS U 92 -45.532 -5.631 0.665 1.00 62.95 O ATOM 828 CB LYS U 92 -45.601 -6.220 3.789 1.00 65.97 C ATOM 829 CG LYS U 92 -46.371 -7.181 4.707 1.00 72.80 C ATOM 830 CD LYS U 92 -45.568 -8.400 5.194 1.00 75.51 C ATOM 831 CE LYS U 92 -44.328 -8.032 6.018 1.00 76.13 C ATOM 832 NZ LYS U 92 -44.592 -7.928 7.480 1.00 77.07 N ATOM 833 HZ1 LYS U 92 -45.308 -7.193 7.650 1.00 0.00 H ATOM 834 HZ2 LYS U 92 -44.941 -8.842 7.834 1.00 0.00 H ATOM 835 HZ3 LYS U 92 -43.711 -7.677 7.973 1.00 0.00 H ATOM 836 H LYS U 92 -43.233 -7.293 3.885 1.00 0.00 H ATOM 837 N ASP U 93 -43.396 -5.508 1.318 1.00 56.73 N ATOM 838 CA ASP U 93 -42.975 -4.740 0.139 1.00 56.05 C ATOM 839 C ASP U 93 -42.354 -5.583 -0.978 1.00 52.29 C ATOM 840 O ASP U 93 -41.738 -5.041 -1.897 1.00 54.04 O ATOM 841 CB ASP U 93 -42.029 -3.601 0.546 1.00 60.23 C ATOM 842 CG ASP U 93 -42.732 -2.523 1.368 1.00 65.85 C ATOM 843 OD1 ASP U 93 -43.880 -2.163 1.021 1.00 70.48 O ATOM 844 OD2 ASP U 93 -42.136 -2.025 2.349 1.00 66.29 O ATOM 845 H ASP U 93 -42.704 -5.712 2.067 1.00 0.00 H ATOM 846 N TYR U 94 -42.532 -6.900 -0.938 1.00 52.71 N ATOM 847 CA TYR U 94 -42.108 -7.728 -2.065 1.00 54.20 C ATOM 848 C TYR U 94 -42.711 -7.197 -3.341 1.00 56.27 C ATOM 849 O TYR U 94 -43.858 -6.748 -3.349 1.00 61.68 O ATOM 850 CB TYR U 94 -42.560 -9.171 -1.902 1.00 52.05 C ATOM 851 CG TYR U 94 -42.343 -10.043 -3.127 1.00 52.25 C ATOM 852 CD1 TYR U 94 -41.096 -10.613 -3.397 1.00 53.51 C ATOM 853 CD2 TYR U 94 -43.391 -10.336 -3.998 1.00 48.75 C ATOM 854 CE1 TYR U 94 -40.900 -11.428 -4.504 1.00 50.35 C ATOM 855 CE2 TYR U 94 -43.199 -11.144 -5.110 1.00 49.01 C ATOM 856 CZ TYR U 94 -41.957 -11.701 -5.352 1.00 49.40 C ATOM 857 OH TYR U 94 -41.772 -12.520 -6.457 1.00 47.89 O ATOM 858 HH TYR U 94 -40.833 -12.832 -6.481 1.00 0.00 H ATOM 859 H TYR U 94 -42.973 -7.341 -0.105 1.00 0.00 H ATOM 860 N SER U 95 -41.946 -7.209 -4.411 1.00 56.47 N ATOM 861 CA SER U 95 -42.476 -6.890 -5.710 1.00 59.73 C ATOM 862 C SER U 95 -41.696 -7.600 -6.780 1.00 63.36 C ATOM 863 O SER U 95 -40.511 -7.713 -6.669 1.00 70.03 O ATOM 864 CB SER U 95 -42.387 -5.408 -5.951 1.00 58.29 C ATOM 865 OG SER U 95 -42.698 -5.119 -7.281 1.00 61.61 O ATOM 866 HG SER U 95 -42.636 -4.142 -7.428 1.00 0.00 H ATOM 867 H SER U 95 -40.940 -7.454 -4.316 1.00 0.00 H ATOM 868 N ALA U 96 -42.346 -8.031 -7.845 1.00 65.86 N ATOM 869 CA ALA U 96 -41.633 -8.639 -8.947 1.00 66.08 C ATOM 870 C ALA U 96 -41.776 -7.841 -10.233 1.00 68.71 C ATOM 871 O ALA U 96 -42.859 -7.575 -10.687 1.00 73.06 O ATOM 872 CB ALA U 96 -42.093 -10.063 -9.144 1.00 63.61 C ATOM 873 H ALA U 96 -43.380 -7.933 -7.892 1.00 0.00 H ATOM 874 N ASP U 97 -40.657 -7.461 -10.803 1.00 70.50 N ATOM 875 CA ASP U 97 -40.614 -6.693 -12.018 1.00 75.94 C ATOM 876 C ASP U 97 -40.522 -7.547 -13.239 1.00 78.73 C ATOM 877 O ASP U 97 -40.594 -8.746 -13.161 1.00 83.20 O ATOM 878 CB ASP U 97 -39.418 -5.777 -11.997 1.00 79.65 C ATOM 879 CG ASP U 97 -39.544 -4.698 -10.971 1.00 88.88 C ATOM 880 OD1 ASP U 97 -40.318 -4.897 -10.028 1.00 91.85 O ATOM 881 OD2 ASP U 97 -38.876 -3.646 -11.101 1.00 95.76 O ATOM 882 H ASP U 97 -39.758 -7.728 -10.354 1.00 0.00 H ATOM 883 N THR U 97A -40.360 -6.904 -14.382 1.00 86.24 N ATOM 884 CA THR U 97A -40.085 -7.602 -15.613 1.00 90.71 C ATOM 885 C THR U 97A -38.764 -8.340 -15.552 1.00 86.35 C ATOM 886 O THR U 97A -38.623 -9.383 -16.150 1.00 88.10 O ATOM 887 CB THR U 97A -40.140 -6.682 -16.857 1.00 92.26 C ATOM 888 OG1 THR U 97A -39.279 -5.551 -16.690 1.00 90.74 O ATOM 889 CG2 THR U 97A -41.545 -6.205 -17.087 1.00 91.60 C ATOM 890 HG1 THR U 97A -39.330 -4.977 -17.495 1.00 0.00 H ATOM 891 H THR U 97A -40.433 -5.867 -14.394 1.00 0.00 H ATOM 892 N LEU U 97B -37.768 -7.760 -14.905 1.00 64.83 N ATOM 893 CA LEU U 97B -36.498 -8.434 -14.771 1.00 66.44 C ATOM 894 C LEU U 97B -36.166 -9.015 -13.404 1.00 63.98 C ATOM 895 O LEU U 97B -35.698 -10.107 -13.310 1.00 68.49 O ATOM 896 CB LEU U 97B -35.390 -7.510 -15.232 1.00 69.14 C ATOM 897 CG LEU U 97B -35.281 -7.409 -16.746 1.00 73.67 C ATOM 898 CD1 LEU U 97B -36.646 -7.320 -17.395 1.00 74.94 C ATOM 899 CD2 LEU U 97B -34.424 -6.238 -17.158 1.00 71.78 C ATOM 900 H LEU U 97B -37.899 -6.815 -14.491 1.00 0.00 H ATOM 901 N ALA U 98 -36.448 -8.283 -12.352 1.00 61.96 N ATOM 902 CA ALA U 98 -35.879 -8.538 -11.054 1.00 63.69 C ATOM 903 C ALA U 98 -36.909 -8.602 -9.935 1.00 60.53 C ATOM 904 O ALA U 98 -38.047 -8.245 -10.123 1.00 55.63 O ATOM 905 CB ALA U 98 -34.846 -7.485 -10.743 1.00 62.60 C ATOM 906 H ALA U 98 -37.109 -7.487 -12.460 1.00 0.00 H ATOM 907 N TYR U 99 -36.495 -9.095 -8.782 1.00 52.89 N ATOM 908 CA TYR U 99 -37.341 -9.112 -7.621 1.00 51.64 C ATOM 909 C TYR U 99 -36.875 -8.025 -6.684 1.00 49.81 C ATOM 910 O TYR U 99 -35.735 -7.680 -6.702 1.00 52.99 O ATOM 911 CB TYR U 99 -37.232 -10.443 -6.888 1.00 53.80 C ATOM 912 CG TYR U 99 -37.746 -11.666 -7.587 1.00 51.93 C ATOM 913 CD1 TYR U 99 -39.092 -11.914 -7.697 1.00 56.81 C ATOM 914 CD2 TYR U 99 -36.891 -12.587 -8.094 1.00 50.81 C ATOM 915 CE1 TYR U 99 -39.557 -13.042 -8.317 1.00 54.13 C ATOM 916 CE2 TYR U 99 -37.350 -13.713 -8.703 1.00 48.65 C ATOM 917 CZ TYR U 99 -38.683 -13.930 -8.813 1.00 48.86 C ATOM 918 OH TYR U 99 -39.127 -15.051 -9.423 1.00 46.92 O ATOM 919 HH TYR U 99 -38.799 -15.069 -10.357 1.00 0.00 H ATOM 920 H TYR U 99 -35.532 -9.481 -8.713 1.00 0.00 H ATOM 921 N HIS U 100 -37.761 -7.498 -5.859 1.00 48.89 N ATOM 922 CA HIS U 100 -37.408 -6.511 -4.848 1.00 49.16 C ATOM 923 C HIS U 100 -37.859 -6.963 -3.482 1.00 45.59 C ATOM 924 O HIS U 100 -38.865 -7.595 -3.375 1.00 44.06 O ATOM 925 CB HIS U 100 -38.083 -5.194 -5.166 1.00 54.90 C ATOM 926 CG HIS U 100 -37.528 -4.513 -6.365 1.00 56.24 C ATOM 927 ND1 HIS U 100 -37.963 -4.783 -7.634 1.00 61.21 N ATOM 928 CD2 HIS U 100 -36.566 -3.581 -6.489 1.00 62.24 C ATOM 929 CE1 HIS U 100 -37.289 -4.057 -8.495 1.00 64.59 C ATOM 930 NE2 HIS U 100 -36.430 -3.320 -7.825 1.00 66.45 N ATOM 931 H HIS U 100 -38.753 -7.801 -5.934 1.00 0.00 H ATOM 932 N ASN U 101 -37.115 -6.617 -2.443 1.00 44.78 N ATOM 933 CA ASN U 101 -37.394 -7.073 -1.069 1.00 48.87 C ATOM 934 C ASN U 101 -37.659 -8.587 -1.014 1.00 48.41 C ATOM 935 O ASN U 101 -38.570 -9.078 -0.325 1.00 48.62 O ATOM 936 CB ASN U 101 -38.563 -6.293 -0.474 1.00 51.84 C ATOM 937 CG ASN U 101 -38.274 -4.791 -0.362 1.00 57.91 C ATOM 938 OD1 ASN U 101 -37.358 -4.368 0.355 1.00 55.66 O ATOM 939 ND2 ASN U 101 -39.059 -3.983 -1.070 1.00 56.57 N ATOM 940 HD22 ASN U 101 -39.818 -4.381 -1.660 1.00 0.00 H ATOM 941 HD21 ASN U 101 -38.914 -2.954 -1.033 1.00 0.00 H ATOM 942 H ASN U 101 -36.297 -5.995 -2.603 1.00 0.00 H ATOM 943 N ASP U 102 -36.842 -9.318 -1.757 1.00 45.14 N ATOM 944 CA ASP U 102 -37.037 -10.735 -1.936 1.00 42.50 C ATOM 945 C ASP U 102 -36.436 -11.493 -0.752 1.00 44.49 C ATOM 946 O ASP U 102 -35.310 -12.007 -0.814 1.00 45.13 O ATOM 947 CB ASP U 102 -36.409 -11.148 -3.249 1.00 41.35 C ATOM 948 CG ASP U 102 -36.830 -12.512 -3.688 1.00 38.41 C ATOM 949 OD1 ASP U 102 -37.820 -13.057 -3.164 1.00 39.60 O ATOM 950 OD2 ASP U 102 -36.176 -13.028 -4.593 1.00 40.71 O ATOM 951 H ASP U 102 -36.036 -8.856 -2.225 1.00 0.00 H ATOM 952 N ILE U 103 -37.202 -11.531 0.331 1.00 44.08 N ATOM 953 CA ILE U 103 -36.784 -12.129 1.577 1.00 45.16 C ATOM 954 C ILE U 103 -37.992 -12.643 2.334 1.00 44.23 C ATOM 955 O ILE U 103 -39.055 -12.026 2.290 1.00 48.31 O ATOM 956 CB ILE U 103 -36.021 -11.132 2.470 1.00 49.60 C ATOM 957 CG1 ILE U 103 -35.569 -11.811 3.770 1.00 50.19 C ATOM 958 CG2 ILE U 103 -36.860 -9.890 2.775 1.00 48.52 C ATOM 959 CD1 ILE U 103 -34.490 -11.048 4.519 1.00 50.15 C ATOM 960 H ILE U 103 -38.151 -11.109 0.280 1.00 0.00 H ATOM 961 N ALA U 104 -37.810 -13.763 3.030 1.00 40.64 N ATOM 962 CA ALA U 104 -38.887 -14.424 3.754 1.00 42.34 C ATOM 963 C ALA U 104 -38.375 -15.158 4.974 1.00 41.59 C ATOM 964 O ALA U 104 -37.198 -15.554 5.026 1.00 41.90 O ATOM 965 CB ALA U 104 -39.613 -15.388 2.837 1.00 42.85 C ATOM 966 H ALA U 104 -36.859 -14.183 3.058 1.00 0.00 H ATOM 967 N LEU U 105 -39.260 -15.347 5.952 1.00 41.84 N ATOM 968 CA LEU U 105 -38.942 -16.147 7.130 1.00 41.54 C ATOM 969 C LEU U 105 -39.902 -17.298 7.351 1.00 41.70 C ATOM 970 O LEU U 105 -41.121 -17.170 7.219 1.00 42.21 O ATOM 971 CB LEU U 105 -38.914 -15.276 8.386 1.00 46.89 C ATOM 972 CG LEU U 105 -37.721 -14.323 8.533 1.00 45.07 C ATOM 973 CD1 LEU U 105 -38.117 -13.076 9.326 1.00 44.94 C ATOM 974 CD2 LEU U 105 -36.563 -15.060 9.205 1.00 46.98 C ATOM 975 H LEU U 105 -40.202 -14.913 5.874 1.00 0.00 H ATOM 976 N LEU U 106 -39.333 -18.438 7.709 1.00 41.29 N ATOM 977 CA LEU U 106 -40.102 -19.604 8.103 1.00 43.29 C ATOM 978 C LEU U 106 -39.727 -19.925 9.523 1.00 43.20 C ATOM 979 O LEU U 106 -38.536 -20.071 9.844 1.00 46.21 O ATOM 980 CB LEU U 106 -39.786 -20.812 7.213 1.00 45.11 C ATOM 981 CG LEU U 106 -40.189 -20.661 5.739 1.00 46.51 C ATOM 982 CD1 LEU U 106 -39.290 -19.664 5.021 1.00 49.68 C ATOM 983 CD2 LEU U 106 -40.175 -22.020 5.054 1.00 48.77 C ATOM 984 H LEU U 106 -38.295 -18.501 7.708 1.00 0.00 H ATOM 985 N LYS U 107 -40.731 -20.053 10.373 1.00 46.94 N ATOM 986 CA LYS U 107 -40.512 -20.573 11.711 1.00 50.09 C ATOM 987 C LYS U 107 -40.771 -22.055 11.643 1.00 49.62 C ATOM 988 O LYS U 107 -41.852 -22.489 11.220 1.00 50.62 O ATOM 989 CB LYS U 107 -41.436 -19.904 12.733 1.00 57.31 C ATOM 990 CG LYS U 107 -41.052 -20.168 14.191 1.00 61.33 C ATOM 991 CD LYS U 107 -41.655 -19.113 15.114 1.00 66.42 C ATOM 992 CE LYS U 107 -41.193 -19.257 16.562 1.00 66.55 C ATOM 993 NZ LYS U 107 -42.216 -19.964 17.381 1.00 67.13 N ATOM 994 HZ1 LYS U 107 -43.104 -19.423 17.366 1.00 0.00 H ATOM 995 HZ2 LYS U 107 -42.379 -20.912 16.987 1.00 0.00 H ATOM 996 HZ3 LYS U 107 -41.876 -20.048 18.360 1.00 0.00 H ATOM 997 H LYS U 107 -41.690 -19.778 10.080 1.00 0.00 H ATOM 998 N ILE U 108 -39.804 -22.851 12.044 1.00 48.87 N ATOM 999 CA ILE U 108 -39.903 -24.297 11.915 1.00 49.77 C ATOM 1000 C ILE U 108 -40.191 -24.978 13.248 1.00 51.09 C ATOM 1001 O ILE U 108 -39.721 -24.545 14.268 1.00 47.61 O ATOM 1002 CB ILE U 108 -38.622 -24.889 11.312 1.00 48.83 C ATOM 1003 CG1 ILE U 108 -37.399 -24.359 12.035 1.00 47.85 C ATOM 1004 CG2 ILE U 108 -38.497 -24.501 9.868 1.00 48.15 C ATOM 1005 CD1 ILE U 108 -36.109 -24.993 11.611 1.00 50.11 C ATOM 1006 H ILE U 108 -38.947 -22.437 12.464 1.00 0.00 H ATOM 1007 N ARG U 109 -41.024 -25.999 13.218 1.00 50.77 N ATOM 1008 CA ARG U 109 -41.181 -26.905 14.334 1.00 60.20 C ATOM 1009 C ARG U 109 -41.419 -28.326 13.895 1.00 56.11 C ATOM 1010 O ARG U 109 -42.151 -28.578 12.970 1.00 54.58 O ATOM 1011 CB ARG U 109 -42.321 -26.477 15.247 1.00 67.31 C ATOM 1012 CG ARG U 109 -41.927 -25.386 16.211 1.00 77.56 C ATOM 1013 CD ARG U 109 -42.440 -25.618 17.623 1.00 85.67 C ATOM 1014 NE ARG U 109 -41.896 -24.613 18.531 1.00 91.31 N ATOM 1015 CZ ARG U 109 -41.067 -24.865 19.532 1.00 90.25 C ATOM 1016 NH1 ARG U 109 -40.688 -26.102 19.790 1.00 92.51 N ATOM 1017 NH2 ARG U 109 -40.623 -23.873 20.282 1.00 90.37 N ATOM 1018 HE ARG U 109 -42.181 -23.624 18.380 1.00 0.00 H ATOM 1019 HH12 ARG U 109 -40.037 -26.293 20.578 1.00 0.00 H ATOM 1020 HH11 ARG U 109 -41.041 -26.887 19.205 1.00 0.00 H ATOM 1021 HH22 ARG U 109 -39.972 -24.067 21.069 1.00 0.00 H ATOM 1022 HH21 ARG U 109 -40.925 -22.897 20.086 1.00 0.00 H ATOM 1023 H ARG U 109 -41.589 -26.159 12.360 1.00 0.00 H ATOM 1024 N SER U 110 -40.832 -29.256 14.612 1.00 54.52 N ATOM 1025 CA SER U 110 -41.032 -30.652 14.341 1.00 54.72 C ATOM 1026 C SER U 110 -42.423 -31.015 14.800 1.00 57.35 C ATOM 1027 O SER U 110 -43.039 -30.264 15.491 1.00 56.66 O ATOM 1028 CB SER U 110 -39.972 -31.479 15.033 1.00 55.56 C ATOM 1029 OG SER U 110 -40.347 -31.809 16.337 1.00 58.28 O ATOM 1030 HG SER U 110 -39.632 -32.349 16.758 1.00 0.00 H ATOM 1031 H SER U 110 -40.207 -28.975 15.395 1.00 0.00 H ATOM 1032 N LYS U 110A -42.943 -32.131 14.350 1.00 90.60 N ATOM 1033 CA LYS U 110A -44.274 -32.546 14.755 1.00 89.38 C ATOM 1034 C LYS U 110A -44.233 -32.782 16.254 1.00 86.55 C ATOM 1035 O LYS U 110A -45.210 -32.604 16.954 1.00 75.24 O ATOM 1036 CB LYS U 110A -44.788 -33.726 13.943 1.00 91.77 C ATOM 1037 CG LYS U 110A -45.588 -33.284 12.718 1.00 90.10 C ATOM 1038 CD LYS U 110A -46.297 -34.436 12.023 1.00 91.27 C ATOM 1039 CE LYS U 110A -47.216 -33.961 10.899 1.00 90.21 C ATOM 1040 NZ LYS U 110A -47.213 -34.829 9.681 1.00 89.47 N ATOM 1041 HZ1 LYS U 110A -46.251 -34.869 9.287 1.00 0.00 H ATOM 1042 HZ2 LYS U 110A -47.523 -35.788 9.939 1.00 0.00 H ATOM 1043 HZ3 LYS U 110A -47.863 -34.432 8.972 1.00 0.00 H ATOM 1044 H LYS U 110A -42.396 -32.726 13.695 1.00 0.00 H ATOM 1045 N GLU U 110B -43.068 -33.162 16.738 1.00 94.67 N ATOM 1046 CA GLU U 110B -42.840 -33.283 18.164 1.00 96.70 C ATOM 1047 C GLU U 110B -42.819 -31.935 18.878 1.00 92.28 C ATOM 1048 O GLU U 110B -42.894 -31.889 20.090 1.00 88.37 O ATOM 1049 CB GLU U 110B -41.550 -34.029 18.443 1.00102.23 C ATOM 1050 CG GLU U 110B -41.284 -35.175 17.509 1.00106.57 C ATOM 1051 CD GLU U 110B -42.520 -35.982 17.251 1.00112.22 C ATOM 1052 OE1 GLU U 110B -42.575 -37.136 17.731 1.00119.86 O ATOM 1053 OE2 GLU U 110B -43.431 -35.468 16.579 1.00117.11 O ATOM 1054 H GLU U 110B -42.293 -33.381 16.080 1.00 0.00 H ATOM 1055 N GLY U 110C -42.707 -30.844 18.135 1.00 75.81 N ATOM 1056 CA GLY U 110C -42.664 -29.518 18.726 1.00 73.78 C ATOM 1057 C GLY U 110C -41.305 -28.909 18.987 1.00 76.75 C ATOM 1058 O GLY U 110C -41.206 -27.899 19.657 1.00 75.12 O ATOM 1059 H GLY U 110C -42.648 -30.940 17.101 1.00 0.00 H ATOM 1060 N ARG U 110D -40.248 -29.536 18.488 1.00 71.35 N ATOM 1061 CA ARG U 110D -38.897 -29.035 18.673 1.00 70.69 C ATOM 1062 C ARG U 110D -38.354 -28.202 17.523 1.00 66.60 C ATOM 1063 O ARG U 110D -38.750 -28.390 16.408 1.00 68.53 O ATOM 1064 CB ARG U 110D -37.965 -30.205 18.877 1.00 75.12 C ATOM 1065 CG ARG U 110D -38.033 -30.838 20.248 1.00 77.79 C ATOM 1066 CD ARG U 110D -37.487 -32.237 20.205 1.00 78.85 C ATOM 1067 NE ARG U 110D -36.098 -32.290 20.603 1.00 82.77 N ATOM 1068 CZ ARG U 110D -35.582 -33.265 21.330 1.00 87.85 C ATOM 1069 NH1 ARG U 110D -36.348 -34.264 21.733 1.00 90.20 N ATOM 1070 NH2 ARG U 110D -34.307 -33.250 21.650 1.00 91.21 N ATOM 1071 HE ARG U 110D -35.470 -31.518 20.300 1.00 0.00 H ATOM 1072 HH12 ARG U 110D -35.943 -35.032 22.305 1.00 0.00 H ATOM 1073 HH11 ARG U 110D -37.356 -34.282 21.478 1.00 0.00 H ATOM 1074 HH22 ARG U 110D -33.905 -34.020 22.222 1.00 0.00 H ATOM 1075 HH21 ARG U 110D -33.700 -32.468 21.331 1.00 0.00 H ATOM 1076 H ARG U 110D -40.391 -30.413 17.948 1.00 0.00 H ATOM 1077 N CYS U 111 -37.416 -27.315 17.812 1.00 64.77 N ATOM 1078 CA CYS U 111 -36.698 -26.556 16.797 1.00 65.19 C ATOM 1079 C CYS U 111 -35.366 -27.265 16.450 1.00 61.12 C ATOM 1080 O CYS U 111 -35.100 -28.330 16.951 1.00 59.46 O ATOM 1081 CB CYS U 111 -36.452 -25.114 17.257 1.00 62.84 C ATOM 1082 SG CYS U 111 -37.885 -24.044 17.526 1.00 64.96 S ATOM 1083 H CYS U 111 -37.180 -27.152 18.812 1.00 0.00 H ATOM 1084 N ALA U 112 -34.535 -26.680 15.603 1.00 55.31 N ATOM 1085 CA ALA U 112 -33.343 -27.382 15.129 1.00 55.18 C ATOM 1086 C ALA U 112 -32.355 -27.628 16.251 1.00 58.23 C ATOM 1087 O ALA U 112 -32.207 -26.807 17.156 1.00 61.37 O ATOM 1088 CB ALA U 112 -32.668 -26.615 13.998 1.00 52.05 C ATOM 1089 H ALA U 112 -34.731 -25.714 15.272 1.00 0.00 H ATOM 1090 N GLN U 113 -31.673 -28.766 16.171 1.00 60.61 N ATOM 1091 CA GLN U 113 -30.636 -29.110 17.116 1.00 59.26 C ATOM 1092 C GLN U 113 -29.280 -29.309 16.437 1.00 58.39 C ATOM 1093 O GLN U 113 -29.099 -30.244 15.652 1.00 59.02 O ATOM 1094 CB GLN U 113 -31.037 -30.362 17.852 1.00 63.05 C ATOM 1095 CG GLN U 113 -31.924 -30.087 19.051 1.00 66.78 C ATOM 1096 CD GLN U 113 -31.980 -31.294 19.945 1.00 68.47 C ATOM 1097 OE1 GLN U 113 -31.069 -31.536 20.739 1.00 68.42 O ATOM 1098 NE2 GLN U 113 -33.026 -32.090 19.786 1.00 72.80 N ATOM 1099 HE22 GLN U 113 -33.769 -31.842 19.102 1.00 0.00 H ATOM 1100 HE21 GLN U 113 -33.104 -32.964 20.345 1.00 0.00 H ATOM 1101 H GLN U 113 -31.893 -29.431 15.402 1.00 0.00 H ATOM 1102 N PRO U 114 -28.314 -28.440 16.757 1.00 56.67 N ATOM 1103 CA PRO U 114 -26.987 -28.538 16.168 1.00 59.04 C ATOM 1104 C PRO U 114 -26.439 -29.956 16.240 1.00 57.71 C ATOM 1105 O PRO U 114 -26.737 -30.690 17.170 1.00 55.35 O ATOM 1106 CB PRO U 114 -26.136 -27.608 17.021 1.00 60.08 C ATOM 1107 CG PRO U 114 -27.091 -26.661 17.647 1.00 62.74 C ATOM 1108 CD PRO U 114 -28.415 -27.344 17.735 1.00 61.68 C ATOM 1109 N SER U 115 -25.614 -30.295 15.268 1.00 51.46 N ATOM 1110 CA SER U 115 -25.261 -31.663 14.970 1.00 49.18 C ATOM 1111 C SER U 115 -24.086 -31.606 13.994 1.00 44.56 C ATOM 1112 O SER U 115 -23.723 -30.544 13.513 1.00 43.72 O ATOM 1113 CB SER U 115 -26.487 -32.344 14.350 1.00 54.49 C ATOM 1114 OG SER U 115 -26.168 -33.123 13.214 1.00 61.23 O ATOM 1115 HG SER U 115 -26.993 -33.537 12.857 1.00 0.00 H ATOM 1116 H SER U 115 -25.197 -29.539 14.688 1.00 0.00 H ATOM 1117 N ARG U 116 -23.489 -32.747 13.706 1.00 44.80 N ATOM 1118 CA ARG U 116 -22.536 -32.854 12.613 1.00 45.03 C ATOM 1119 C ARG U 116 -23.064 -32.179 11.331 1.00 41.32 C ATOM 1120 O ARG U 116 -22.306 -31.585 10.566 1.00 38.66 O ATOM 1121 CB ARG U 116 -22.300 -34.345 12.322 1.00 53.13 C ATOM 1122 CG ARG U 116 -20.985 -34.703 11.656 1.00 54.15 C ATOM 1123 CD ARG U 116 -20.697 -36.196 11.769 1.00 60.70 C ATOM 1124 NE ARG U 116 -21.836 -37.046 11.409 1.00 69.21 N ATOM 1125 CZ ARG U 116 -22.236 -37.325 10.163 1.00 75.32 C ATOM 1126 NH1 ARG U 116 -23.291 -38.109 9.966 1.00 79.29 N ATOM 1127 NH2 ARG U 116 -21.599 -36.831 9.110 1.00 74.11 N ATOM 1128 HE ARG U 116 -22.380 -37.468 12.189 1.00 0.00 H ATOM 1129 HH12 ARG U 116 -23.603 -38.327 8.998 1.00 0.00 H ATOM 1130 HH11 ARG U 116 -23.804 -38.504 10.780 1.00 0.00 H ATOM 1131 HH22 ARG U 116 -21.926 -37.060 8.150 1.00 0.00 H ATOM 1132 HH21 ARG U 116 -20.772 -36.214 9.244 1.00 0.00 H ATOM 1133 H ARG U 116 -23.705 -33.590 14.275 1.00 0.00 H ATOM 1134 N THR U 117 -24.361 -32.298 11.101 1.00 38.29 N ATOM 1135 CA THR U 117 -24.954 -31.943 9.819 1.00 41.12 C ATOM 1136 C THR U 117 -25.859 -30.705 9.868 1.00 43.00 C ATOM 1137 O THR U 117 -26.396 -30.311 8.824 1.00 39.25 O ATOM 1138 CB THR U 117 -25.746 -33.132 9.249 1.00 39.10 C ATOM 1139 OG1 THR U 117 -26.700 -33.599 10.208 1.00 37.92 O ATOM 1140 CG2 THR U 117 -24.829 -34.265 8.900 1.00 40.46 C ATOM 1141 HG1 THR U 117 -26.227 -33.888 11.028 1.00 0.00 H ATOM 1142 H THR U 117 -24.976 -32.656 11.859 1.00 0.00 H ATOM 1143 N ILE U 118 -26.022 -30.099 11.064 1.00 40.51 N ATOM 1144 CA ILE U 118 -26.917 -28.959 11.261 1.00 40.50 C ATOM 1145 C ILE U 118 -26.290 -27.920 12.189 1.00 48.34 C ATOM 1146 O ILE U 118 -25.863 -28.242 13.311 1.00 46.29 O ATOM 1147 CB ILE U 118 -28.253 -29.359 11.871 1.00 41.31 C ATOM 1148 CG1 ILE U 118 -28.903 -30.501 11.070 1.00 41.91 C ATOM 1149 CG2 ILE U 118 -29.184 -28.144 11.931 1.00 43.67 C ATOM 1150 CD1 ILE U 118 -30.180 -31.018 11.680 1.00 41.73 C ATOM 1151 H ILE U 118 -25.488 -30.459 11.881 1.00 0.00 H ATOM 1152 N GLN U 119 -26.219 -26.688 11.693 1.00 45.77 N ATOM 1153 CA GLN U 119 -25.691 -25.550 12.440 1.00 45.32 C ATOM 1154 C GLN U 119 -26.318 -24.277 11.888 1.00 47.40 C ATOM 1155 O GLN U 119 -26.611 -24.178 10.670 1.00 37.59 O ATOM 1156 CB GLN U 119 -24.174 -25.418 12.292 1.00 47.67 C ATOM 1157 CG GLN U 119 -23.324 -26.614 12.713 1.00 53.01 C ATOM 1158 CD GLN U 119 -23.150 -26.734 14.220 1.00 54.32 C ATOM 1159 OE1 GLN U 119 -23.225 -25.741 14.950 1.00 61.18 O ATOM 1160 NE2 GLN U 119 -22.928 -27.953 14.692 1.00 49.16 N ATOM 1161 HE22 GLN U 119 -22.872 -28.761 14.040 1.00 0.00 H ATOM 1162 HE21 GLN U 119 -22.809 -28.101 15.715 1.00 0.00 H ATOM 1163 H GLN U 119 -26.557 -26.527 10.723 1.00 0.00 H ATOM 1164 N THR U 120 -26.473 -23.292 12.776 1.00 41.90 N ATOM 1165 CA THR U 120 -27.041 -21.996 12.433 1.00 40.20 C ATOM 1166 C THR U 120 -25.928 -21.208 11.773 1.00 41.63 C ATOM 1167 O THR U 120 -24.766 -21.591 11.852 1.00 40.11 O ATOM 1168 CB THR U 120 -27.575 -21.269 13.712 1.00 43.44 C ATOM 1169 OG1 THR U 120 -26.499 -21.058 14.635 1.00 43.92 O ATOM 1170 CG2 THR U 120 -28.628 -22.105 14.407 1.00 40.94 C ATOM 1171 HG1 THR U 120 -26.110 -21.931 14.892 1.00 0.00 H ATOM 1172 H THR U 120 -26.174 -23.458 13.758 1.00 0.00 H ATOM 1173 N ILE U 121 -26.285 -20.126 11.091 1.00 41.86 N ATOM 1174 CA ILE U 121 -25.320 -19.267 10.395 1.00 43.83 C ATOM 1175 C ILE U 121 -25.576 -17.850 10.927 1.00 48.04 C ATOM 1176 O ILE U 121 -26.733 -17.454 11.112 1.00 48.64 O ATOM 1177 CB ILE U 121 -25.508 -19.344 8.852 1.00 41.85 C ATOM 1178 CG1 ILE U 121 -24.506 -18.494 8.094 1.00 41.12 C ATOM 1179 CG2 ILE U 121 -26.904 -18.894 8.415 1.00 39.86 C ATOM 1180 CD1 ILE U 121 -23.113 -19.072 8.023 1.00 46.31 C ATOM 1181 H ILE U 121 -27.294 -19.876 11.048 1.00 0.00 H ATOM 1182 N ALA U 122 -24.511 -17.102 11.165 1.00 48.26 N ATOM 1183 CA ALA U 122 -24.629 -15.762 11.735 1.00 52.45 C ATOM 1184 C ALA U 122 -25.134 -14.726 10.725 1.00 53.69 C ATOM 1185 O ALA U 122 -24.792 -14.761 9.547 1.00 52.89 O ATOM 1186 CB ALA U 122 -23.289 -15.319 12.310 1.00 52.91 C ATOM 1187 H ALA U 122 -23.567 -17.477 10.941 1.00 0.00 H ATOM 1188 N LEU U 123 -25.955 -13.801 11.209 1.00 57.94 N ATOM 1189 CA LEU U 123 -26.360 -12.641 10.424 1.00 59.02 C ATOM 1190 C LEU U 123 -25.262 -11.608 10.519 1.00 56.87 C ATOM 1191 O LEU U 123 -24.550 -11.573 11.517 1.00 56.32 O ATOM 1192 CB LEU U 123 -27.658 -12.047 10.983 1.00 60.27 C ATOM 1193 CG LEU U 123 -28.879 -12.947 10.807 1.00 61.58 C ATOM 1194 CD1 LEU U 123 -30.049 -12.430 11.630 1.00 62.62 C ATOM 1195 CD2 LEU U 123 -29.254 -13.043 9.334 1.00 59.24 C ATOM 1196 H LEU U 123 -26.320 -13.907 12.177 1.00 0.00 H ATOM 1197 N PRO U 124 -25.128 -10.748 9.499 1.00 54.06 N ATOM 1198 CA PRO U 124 -24.171 -9.667 9.620 1.00 54.02 C ATOM 1199 C PRO U 124 -24.739 -8.543 10.489 1.00 54.92 C ATOM 1200 O PRO U 124 -25.934 -8.539 10.804 1.00 51.03 O ATOM 1201 CB PRO U 124 -24.029 -9.175 8.182 1.00 54.50 C ATOM 1202 CG PRO U 124 -25.363 -9.442 7.568 1.00 55.63 C ATOM 1203 CD PRO U 124 -26.051 -10.513 8.377 1.00 53.87 C ATOM 1204 N SER U 125 -23.883 -7.601 10.862 1.00 59.23 N ATOM 1205 CA SER U 125 -24.324 -6.403 11.562 1.00 61.38 C ATOM 1206 C SER U 125 -24.933 -5.455 10.546 1.00 59.53 C ATOM 1207 O SER U 125 -24.586 -5.485 9.359 1.00 56.03 O ATOM 1208 CB SER U 125 -23.162 -5.740 12.303 1.00 63.38 C ATOM 1209 OG SER U 125 -22.849 -6.476 13.472 1.00 70.99 O ATOM 1210 HG SER U 125 -22.096 -6.039 13.944 1.00 0.00 H ATOM 1211 H SER U 125 -22.872 -7.721 10.649 1.00 0.00 H ATOM 1212 N MET U 126 -25.840 -4.606 11.017 1.00 63.83 N ATOM 1213 CA MET U 126 -26.688 -3.847 10.108 1.00 61.92 C ATOM 1214 C MET U 126 -25.850 -2.950 9.214 1.00 58.74 C ATOM 1215 O MET U 126 -24.971 -2.217 9.674 1.00 55.49 O ATOM 1216 CB MET U 126 -27.810 -3.086 10.841 1.00 70.98 C ATOM 1217 CG MET U 126 -27.404 -2.129 11.955 1.00 75.85 C ATOM 1218 SD MET U 126 -28.722 -1.923 13.186 1.00 85.64 S ATOM 1219 CE MET U 126 -30.145 -1.649 12.130 1.00 81.53 C ATOM 1220 H MET U 126 -25.945 -4.482 12.044 1.00 0.00 H ATOM 1221 N TYR U 127 -26.106 -3.086 7.919 1.00 58.31 N ATOM 1222 CA TYR U 127 -25.413 -2.355 6.862 1.00 57.93 C ATOM 1223 C TYR U 127 -23.920 -2.726 6.723 1.00 58.53 C ATOM 1224 O TYR U 127 -23.245 -2.222 5.823 1.00 57.55 O ATOM 1225 CB TYR U 127 -25.713 -0.848 6.992 1.00 56.46 C ATOM 1226 CG TYR U 127 -27.202 -0.625 6.809 1.00 54.74 C ATOM 1227 CD1 TYR U 127 -28.080 -0.724 7.880 1.00 56.83 C ATOM 1228 CD2 TYR U 127 -27.744 -0.430 5.540 1.00 56.25 C ATOM 1229 CE1 TYR U 127 -29.449 -0.584 7.705 1.00 56.22 C ATOM 1230 CE2 TYR U 127 -29.109 -0.280 5.354 1.00 55.08 C ATOM 1231 CZ TYR U 127 -29.957 -0.364 6.437 1.00 56.98 C ATOM 1232 OH TYR U 127 -31.310 -0.214 6.255 1.00 55.57 O ATOM 1233 HH TYR U 127 -31.771 -0.302 7.127 1.00 0.00 H ATOM 1234 H TYR U 127 -26.849 -3.757 7.639 1.00 0.00 H ATOM 1235 N ASN U 128 -23.443 -3.653 7.566 1.00 56.93 N ATOM 1236 CA ASN U 128 -22.075 -4.177 7.484 1.00 62.94 C ATOM 1237 C ASN U 128 -21.967 -5.355 6.498 1.00 62.16 C ATOM 1238 O ASN U 128 -22.436 -6.468 6.797 1.00 55.80 O ATOM 1239 CB ASN U 128 -21.576 -4.615 8.874 1.00 64.81 C ATOM 1240 CG ASN U 128 -20.139 -5.130 8.857 1.00 67.80 C ATOM 1241 OD1 ASN U 128 -19.707 -5.831 9.773 1.00 64.30 O ATOM 1242 ND2 ASN U 128 -19.395 -4.791 7.808 1.00 72.74 N ATOM 1243 HD22 ASN U 128 -19.798 -4.197 7.055 1.00 0.00 H ATOM 1244 HD21 ASN U 128 -18.411 -5.120 7.741 1.00 0.00 H ATOM 1245 H ASN U 128 -24.071 -4.017 8.311 1.00 0.00 H ATOM 1246 N ASP U 129 -21.342 -5.080 5.348 1.00 61.56 N ATOM 1247 CA ASP U 129 -21.066 -6.056 4.281 1.00 66.73 C ATOM 1248 C ASP U 129 -19.567 -6.081 3.974 1.00 66.41 C ATOM 1249 O ASP U 129 -18.899 -5.073 4.140 1.00 64.66 O ATOM 1250 CB ASP U 129 -21.781 -5.638 2.992 1.00 70.18 C ATOM 1251 CG ASP U 129 -23.275 -5.470 3.179 1.00 76.20 C ATOM 1252 OD1 ASP U 129 -23.918 -6.448 3.595 1.00 82.97 O ATOM 1253 OD2 ASP U 129 -23.810 -4.367 2.913 1.00 76.78 O ATOM 1254 H ASP U 129 -21.027 -4.101 5.196 1.00 0.00 H ATOM 1255 N PRO U 130 -19.033 -7.216 3.479 1.00 69.59 N ATOM 1256 CA PRO U 130 -17.601 -7.224 3.138 1.00 66.75 C ATOM 1257 C PRO U 130 -17.302 -6.350 1.916 1.00 63.48 C ATOM 1258 O PRO U 130 -18.216 -5.831 1.299 1.00 55.01 O ATOM 1259 CB PRO U 130 -17.293 -8.704 2.850 1.00 67.10 C ATOM 1260 CG PRO U 130 -18.558 -9.461 3.101 1.00 69.55 C ATOM 1261 CD PRO U 130 -19.692 -8.480 3.117 1.00 68.08 C ATOM 1262 N GLN U 131 -16.041 -6.215 1.565 1.00 67.25 N ATOM 1263 CA GLN U 131 -15.635 -5.356 0.480 1.00 69.94 C ATOM 1264 C GLN U 131 -15.647 -6.055 -0.860 1.00 68.44 C ATOM 1265 O GLN U 131 -15.430 -7.230 -0.911 1.00 65.14 O ATOM 1266 CB GLN U 131 -14.254 -4.802 0.781 1.00 78.61 C ATOM 1267 CG GLN U 131 -13.250 -5.854 1.195 1.00 84.30 C ATOM 1268 CD GLN U 131 -12.739 -5.704 2.614 1.00 90.09 C ATOM 1269 OE1 GLN U 131 -11.701 -5.082 2.843 1.00 98.14 O ATOM 1270 NE2 GLN U 131 -13.434 -6.317 3.568 1.00 89.94 N ATOM 1271 HE22 GLN U 131 -14.306 -6.831 3.328 1.00 0.00 H ATOM 1272 HE21 GLN U 131 -13.106 -6.283 4.554 1.00 0.00 H ATOM 1273 H GLN U 131 -15.314 -6.745 2.087 1.00 0.00 H ATOM 1274 N PHE U 132 -15.884 -5.326 -1.943 1.00 66.94 N ATOM 1275 CA PHE U 132 -15.926 -5.953 -3.261 1.00 72.40 C ATOM 1276 C PHE U 132 -14.623 -6.715 -3.494 1.00 69.46 C ATOM 1277 O PHE U 132 -13.580 -6.355 -2.936 1.00 64.31 O ATOM 1278 CB PHE U 132 -16.221 -4.940 -4.385 1.00 78.88 C ATOM 1279 CG PHE U 132 -15.070 -4.023 -4.726 1.00 88.80 C ATOM 1280 CD1 PHE U 132 -14.026 -4.460 -5.540 1.00 92.96 C ATOM 1281 CD2 PHE U 132 -15.051 -2.705 -4.273 1.00 94.39 C ATOM 1282 CE1 PHE U 132 -12.976 -3.616 -5.865 1.00 95.50 C ATOM 1283 CE2 PHE U 132 -14.004 -1.856 -4.599 1.00 95.75 C ATOM 1284 CZ PHE U 132 -12.965 -2.312 -5.395 1.00 96.54 C ATOM 1285 H PHE U 132 -16.041 -4.302 -1.853 1.00 0.00 H ATOM 1286 N GLY U 133 -14.699 -7.789 -4.281 1.00 65.74 N ATOM 1287 CA GLY U 133 -13.546 -8.662 -4.513 1.00 62.99 C ATOM 1288 C GLY U 133 -13.364 -9.739 -3.453 1.00 61.23 C ATOM 1289 O GLY U 133 -12.530 -10.641 -3.627 1.00 59.00 O ATOM 1290 H GLY U 133 -15.603 -8.013 -4.743 1.00 0.00 H ATOM 1291 N THR U 134 -14.134 -9.653 -2.360 1.00 55.97 N ATOM 1292 CA THR U 134 -14.162 -10.712 -1.358 1.00 56.54 C ATOM 1293 C THR U 134 -14.823 -11.963 -1.922 1.00 51.27 C ATOM 1294 O THR U 134 -15.909 -11.886 -2.493 1.00 49.09 O ATOM 1295 CB THR U 134 -14.961 -10.321 -0.101 1.00 56.40 C ATOM 1296 OG1 THR U 134 -14.453 -9.099 0.448 1.00 61.17 O ATOM 1297 CG2 THR U 134 -14.881 -11.435 0.950 1.00 56.91 C ATOM 1298 HG1 THR U 134 -14.533 -8.378 -0.225 1.00 0.00 H ATOM 1299 H THR U 134 -14.727 -8.810 -2.223 1.00 0.00 H ATOM 1300 N SER U 135 -14.157 -13.098 -1.746 1.00 51.07 N ATOM 1301 CA SER U 135 -14.699 -14.406 -2.092 1.00 51.66 C ATOM 1302 C SER U 135 -15.746 -14.913 -1.094 1.00 50.66 C ATOM 1303 O SER U 135 -15.527 -14.874 0.119 1.00 51.65 O ATOM 1304 CB SER U 135 -13.568 -15.428 -2.155 1.00 51.88 C ATOM 1305 OG SER U 135 -12.575 -14.995 -3.046 1.00 55.48 O ATOM 1306 HG SER U 135 -12.212 -14.127 -2.738 1.00 0.00 H ATOM 1307 H SER U 135 -13.200 -13.051 -1.341 1.00 0.00 H ATOM 1308 N CYS U 136 -16.854 -15.435 -1.628 1.00 47.95 N ATOM 1309 CA CYS U 136 -17.976 -15.954 -0.848 1.00 47.62 C ATOM 1310 C CYS U 136 -18.457 -17.303 -1.408 1.00 44.50 C ATOM 1311 O CYS U 136 -18.088 -17.697 -2.509 1.00 41.71 O ATOM 1312 CB CYS U 136 -19.111 -14.931 -0.887 1.00 54.98 C ATOM 1313 SG CYS U 136 -18.608 -13.307 -0.252 1.00 57.34 S ATOM 1314 H CYS U 136 -16.923 -15.475 -2.665 1.00 0.00 H ATOM 1315 N GLU U 137 -19.290 -18.006 -0.661 1.00 41.24 N ATOM 1316 CA GLU U 137 -19.731 -19.332 -1.074 1.00 41.76 C ATOM 1317 C GLU U 137 -21.222 -19.362 -1.230 1.00 40.63 C ATOM 1318 O GLU U 137 -21.960 -18.855 -0.383 1.00 40.16 O ATOM 1319 CB GLU U 137 -19.398 -20.372 -0.033 1.00 46.55 C ATOM 1320 CG GLU U 137 -17.928 -20.646 0.176 1.00 52.72 C ATOM 1321 CD GLU U 137 -17.661 -21.252 1.542 1.00 55.82 C ATOM 1322 OE1 GLU U 137 -18.514 -21.128 2.449 1.00 61.63 O ATOM 1323 OE2 GLU U 137 -16.594 -21.855 1.703 1.00 58.71 O ATOM 1324 H GLU U 137 -19.636 -17.607 0.235 1.00 0.00 H ATOM 1325 N ILE U 138 -21.659 -19.985 -2.313 1.00 37.04 N ATOM 1326 CA ILE U 138 -23.071 -20.224 -2.541 1.00 39.37 C ATOM 1327 C ILE U 138 -23.278 -21.734 -2.614 1.00 37.41 C ATOM 1328 O ILE U 138 -22.375 -22.449 -3.024 1.00 38.01 O ATOM 1329 CB ILE U 138 -23.568 -19.488 -3.791 1.00 40.12 C ATOM 1330 CG1 ILE U 138 -22.742 -19.855 -5.023 1.00 41.44 C ATOM 1331 CG2 ILE U 138 -23.443 -17.995 -3.584 1.00 43.53 C ATOM 1332 CD1 ILE U 138 -23.204 -19.180 -6.298 1.00 44.64 C ATOM 1333 H ILE U 138 -20.970 -20.312 -3.020 1.00 0.00 H ATOM 1334 N THR U 139 -24.450 -22.193 -2.176 1.00 38.62 N ATOM 1335 CA THR U 139 -24.784 -23.610 -2.085 1.00 36.70 C ATOM 1336 C THR U 139 -26.160 -23.842 -2.650 1.00 35.99 C ATOM 1337 O THR U 139 -27.032 -22.996 -2.495 1.00 35.59 O ATOM 1338 CB THR U 139 -24.865 -24.062 -0.613 1.00 41.17 C ATOM 1339 OG1 THR U 139 -23.772 -23.494 0.128 1.00 49.05 O ATOM 1340 CG2 THR U 139 -24.774 -25.551 -0.516 1.00 39.72 C ATOM 1341 HG1 THR U 139 -23.823 -22.506 0.084 1.00 0.00 H ATOM 1342 H THR U 139 -25.168 -21.501 -1.882 1.00 0.00 H ATOM 1343 N GLY U 140 -26.405 -25.006 -3.243 1.00 31.26 N ATOM 1344 CA GLY U 140 -27.761 -25.324 -3.640 1.00 29.91 C ATOM 1345 C GLY U 140 -27.959 -26.550 -4.494 1.00 31.85 C ATOM 1346 O GLY U 140 -26.999 -27.192 -4.912 1.00 30.41 O ATOM 1347 H GLY U 140 -25.633 -25.680 -3.420 1.00 0.00 H ATOM 1348 N PHE U 141 -29.236 -26.848 -4.762 1.00 33.42 N ATOM 1349 CA PHE U 141 -29.642 -27.954 -5.621 1.00 36.16 C ATOM 1350 C PHE U 141 -30.085 -27.422 -6.979 1.00 36.02 C ATOM 1351 O PHE U 141 -30.878 -28.047 -7.664 1.00 37.22 O ATOM 1352 CB PHE U 141 -30.810 -28.705 -5.008 1.00 37.12 C ATOM 1353 CG PHE U 141 -30.443 -29.539 -3.826 1.00 38.97 C ATOM 1354 CD1 PHE U 141 -29.668 -30.674 -3.989 1.00 38.16 C ATOM 1355 CD2 PHE U 141 -30.901 -29.214 -2.565 1.00 40.66 C ATOM 1356 CE1 PHE U 141 -29.351 -31.472 -2.908 1.00 39.22 C ATOM 1357 CE2 PHE U 141 -30.590 -30.006 -1.474 1.00 42.12 C ATOM 1358 CZ PHE U 141 -29.811 -31.139 -1.648 1.00 40.48 C ATOM 1359 H PHE U 141 -29.979 -26.259 -4.334 1.00 0.00 H ATOM 1360 N GLY U 142 -29.562 -26.276 -7.369 1.00 39.25 N ATOM 1361 CA GLY U 142 -29.929 -25.697 -8.646 1.00 39.67 C ATOM 1362 C GLY U 142 -29.259 -26.394 -9.817 1.00 40.36 C ATOM 1363 O GLY U 142 -28.247 -27.094 -9.694 1.00 31.85 O ATOM 1364 H GLY U 142 -28.881 -25.784 -6.756 1.00 0.00 H ATOM 1365 N LYS U 143 -29.823 -26.142 -10.985 1.00 43.05 N ATOM 1366 CA LYS U 143 -29.289 -26.648 -12.231 1.00 40.32 C ATOM 1367 C LYS U 143 -27.797 -26.429 -12.386 1.00 38.91 C ATOM 1368 O LYS U 143 -27.257 -25.389 -11.999 1.00 37.94 O ATOM 1369 CB LYS U 143 -30.030 -25.994 -13.414 1.00 44.19 C ATOM 1370 CG LYS U 143 -31.507 -26.362 -13.474 1.00 44.98 C ATOM 1371 CD LYS U 143 -32.178 -25.816 -14.738 1.00 49.12 C ATOM 1372 CE LYS U 143 -33.658 -26.157 -14.746 1.00 53.53 C ATOM 1373 NZ LYS U 143 -34.331 -25.782 -16.021 1.00 57.80 N ATOM 1374 HZ1 LYS U 143 -34.240 -24.757 -16.171 1.00 0.00 H ATOM 1375 HZ2 LYS U 143 -33.883 -26.290 -16.810 1.00 0.00 H ATOM 1376 HZ3 LYS U 143 -35.338 -26.038 -15.969 1.00 0.00 H ATOM 1377 H LYS U 143 -30.683 -25.558 -11.010 1.00 0.00 H ATOM 1378 N GLU U 144 -27.156 -27.436 -12.943 1.00 37.40 N ATOM 1379 CA GLU U 144 -25.766 -27.393 -13.237 1.00 42.46 C ATOM 1380 C GLU U 144 -25.485 -26.728 -14.580 1.00 42.81 C ATOM 1381 O GLU U 144 -24.370 -26.432 -14.882 1.00 40.18 O ATOM 1382 CB GLU U 144 -25.194 -28.784 -13.246 1.00 43.57 C ATOM 1383 CG GLU U 144 -25.302 -29.550 -11.955 1.00 45.89 C ATOM 1384 CD GLU U 144 -24.495 -30.803 -12.009 1.00 46.22 C ATOM 1385 OE1 GLU U 144 -25.068 -31.863 -12.220 1.00 47.78 O ATOM 1386 OE2 GLU U 144 -23.280 -30.721 -11.885 1.00 49.28 O ATOM 1387 H GLU U 144 -27.689 -28.298 -13.177 1.00 0.00 H ATOM 1388 N GLN U 145 -26.511 -26.541 -15.384 1.00 49.13 N ATOM 1389 CA GLN U 145 -26.422 -25.784 -16.618 1.00 49.83 C ATOM 1390 C GLN U 145 -27.727 -25.116 -16.885 1.00 44.71 C ATOM 1391 O GLN U 145 -28.753 -25.648 -16.581 1.00 42.15 O ATOM 1392 CB GLN U 145 -26.096 -26.694 -17.771 1.00 57.90 C ATOM 1393 CG GLN U 145 -24.660 -26.604 -18.204 1.00 69.32 C ATOM 1394 CD GLN U 145 -23.955 -27.937 -18.106 1.00 80.10 C ATOM 1395 OE1 GLN U 145 -24.347 -28.920 -18.749 1.00 87.34 O ATOM 1396 NE2 GLN U 145 -22.906 -27.984 -17.297 1.00 78.01 N ATOM 1397 HE22 GLN U 145 -22.612 -27.133 -16.776 1.00 0.00 H ATOM 1398 HE21 GLN U 145 -22.377 -28.872 -17.183 1.00 0.00 H ATOM 1399 H GLN U 145 -27.428 -26.956 -15.122 1.00 0.00 H ATOM 1400 N SER U 146 -27.685 -23.965 -17.511 1.00 44.90 N ATOM 1401 CA SER U 146 -28.883 -23.196 -17.715 1.00 52.26 C ATOM 1402 C SER U 146 -29.873 -23.954 -18.547 1.00 50.02 C ATOM 1403 O SER U 146 -31.032 -23.794 -18.381 1.00 52.79 O ATOM 1404 CB SER U 146 -28.594 -21.860 -18.354 1.00 57.22 C ATOM 1405 OG SER U 146 -29.728 -21.048 -18.246 1.00 61.70 O ATOM 1406 HG SER U 146 -30.488 -21.482 -18.708 1.00 0.00 H ATOM 1407 H SER U 146 -26.776 -23.604 -17.864 1.00 0.00 H ATOM 1408 N THR U 147 -29.378 -24.760 -19.458 1.00 47.37 N ATOM 1409 CA THR U 147 -30.194 -25.519 -20.395 1.00 52.32 C ATOM 1410 C THR U 147 -30.733 -26.856 -19.889 1.00 52.27 C ATOM 1411 O THR U 147 -31.599 -27.445 -20.542 1.00 53.89 O ATOM 1412 CB THR U 147 -29.377 -25.781 -21.672 1.00 53.09 C ATOM 1413 OG1 THR U 147 -28.177 -26.491 -21.330 1.00 54.10 O ATOM 1414 CG2 THR U 147 -29.002 -24.435 -22.313 1.00 54.26 C ATOM 1415 HG1 THR U 147 -27.650 -26.660 -22.151 1.00 0.00 H ATOM 1416 H THR U 147 -28.344 -24.862 -19.513 1.00 0.00 H ATOM 1417 N ASP U 148 -30.225 -27.346 -18.751 1.00 52.43 N ATOM 1418 CA ASP U 148 -30.684 -28.630 -18.179 1.00 53.30 C ATOM 1419 C ASP U 148 -32.179 -28.558 -17.849 1.00 51.32 C ATOM 1420 O ASP U 148 -32.728 -27.456 -17.646 1.00 45.54 O ATOM 1421 CB ASP U 148 -29.918 -28.990 -16.872 1.00 54.73 C ATOM 1422 CG ASP U 148 -28.471 -29.433 -17.116 1.00 55.70 C ATOM 1423 OD1 ASP U 148 -28.035 -29.521 -18.280 1.00 55.55 O ATOM 1424 OD2 ASP U 148 -27.750 -29.689 -16.128 1.00 56.22 O ATOM 1425 H ASP U 148 -29.486 -26.808 -18.255 1.00 0.00 H ATOM 1426 N TYR U 149 -32.814 -29.729 -17.797 1.00 48.42 N ATOM 1427 CA TYR U 149 -34.204 -29.868 -17.327 1.00 54.02 C ATOM 1428 C TYR U 149 -34.356 -30.614 -16.002 1.00 51.60 C ATOM 1429 O TYR U 149 -35.410 -30.539 -15.381 1.00 54.06 O ATOM 1430 CB TYR U 149 -35.064 -30.534 -18.397 1.00 59.13 C ATOM 1431 CG TYR U 149 -35.417 -29.533 -19.456 1.00 70.76 C ATOM 1432 CD1 TYR U 149 -34.553 -29.281 -20.525 1.00 74.26 C ATOM 1433 CD2 TYR U 149 -36.576 -28.762 -19.345 1.00 76.89 C ATOM 1434 CE1 TYR U 149 -34.864 -28.327 -21.483 1.00 77.26 C ATOM 1435 CE2 TYR U 149 -36.894 -27.806 -20.297 1.00 80.08 C ATOM 1436 CZ TYR U 149 -36.032 -27.591 -21.361 1.00 78.60 C ATOM 1437 OH TYR U 149 -36.354 -26.641 -22.298 1.00 84.72 O ATOM 1438 HH TYR U 149 -35.645 -26.607 -22.988 1.00 0.00 H ATOM 1439 H TYR U 149 -32.305 -30.583 -18.102 1.00 0.00 H ATOM 1440 N LEU U 150 -33.310 -31.324 -15.588 1.00 50.40 N ATOM 1441 CA LEU U 150 -33.263 -32.019 -14.308 1.00 54.90 C ATOM 1442 C LEU U 150 -32.367 -31.255 -13.355 1.00 51.62 C ATOM 1443 O LEU U 150 -31.473 -30.516 -13.780 1.00 49.05 O ATOM 1444 CB LEU U 150 -32.698 -33.432 -14.484 1.00 57.69 C ATOM 1445 CG LEU U 150 -33.554 -34.376 -15.340 1.00 64.78 C ATOM 1446 CD1 LEU U 150 -32.727 -35.539 -15.871 1.00 68.79 C ATOM 1447 CD2 LEU U 150 -34.747 -34.883 -14.545 1.00 62.73 C ATOM 1448 H LEU U 150 -32.480 -31.387 -16.212 1.00 0.00 H ATOM 1449 N TYR U 151 -32.597 -31.460 -12.065 1.00 44.54 N ATOM 1450 CA TYR U 151 -31.745 -30.876 -11.038 1.00 44.59 C ATOM 1451 C TYR U 151 -30.812 -31.948 -10.530 1.00 40.31 C ATOM 1452 O TYR U 151 -31.130 -33.133 -10.616 1.00 39.66 O ATOM 1453 CB TYR U 151 -32.599 -30.315 -9.928 1.00 43.53 C ATOM 1454 CG TYR U 151 -33.436 -29.197 -10.447 1.00 45.38 C ATOM 1455 CD1 TYR U 151 -34.642 -29.452 -11.110 1.00 51.53 C ATOM 1456 CD2 TYR U 151 -33.010 -27.881 -10.336 1.00 45.86 C ATOM 1457 CE1 TYR U 151 -35.411 -28.411 -11.624 1.00 55.59 C ATOM 1458 CE2 TYR U 151 -33.771 -26.839 -10.828 1.00 51.20 C ATOM 1459 CZ TYR U 151 -34.965 -27.104 -11.475 1.00 55.09 C ATOM 1460 OH TYR U 151 -35.703 -26.055 -11.964 1.00 61.04 O ATOM 1461 HH TYR U 151 -36.523 -26.403 -12.396 1.00 0.00 H ATOM 1462 H TYR U 151 -33.404 -32.051 -11.780 1.00 0.00 H ATOM 1463 N PRO U 152 -29.639 -31.542 -10.039 1.00 37.54 N ATOM 1464 CA PRO U 152 -28.698 -32.510 -9.481 1.00 39.12 C ATOM 1465 C PRO U 152 -29.237 -33.078 -8.180 1.00 38.10 C ATOM 1466 O PRO U 152 -29.931 -32.369 -7.449 1.00 42.10 O ATOM 1467 CB PRO U 152 -27.448 -31.676 -9.215 1.00 36.35 C ATOM 1468 CG PRO U 152 -27.982 -30.301 -8.965 1.00 36.22 C ATOM 1469 CD PRO U 152 -29.133 -30.166 -9.916 1.00 37.96 C ATOM 1470 N GLU U 153 -28.916 -34.335 -7.918 1.00 35.97 N ATOM 1471 CA GLU U 153 -29.414 -35.048 -6.746 1.00 41.55 C ATOM 1472 C GLU U 153 -28.547 -34.806 -5.527 1.00 38.58 C ATOM 1473 O GLU U 153 -29.009 -34.996 -4.414 1.00 45.93 O ATOM 1474 CB GLU U 153 -29.491 -36.549 -7.021 1.00 43.49 C ATOM 1475 CG GLU U 153 -30.816 -36.978 -7.615 1.00 48.49 C ATOM 1476 CD GLU U 153 -31.949 -36.835 -6.605 1.00 54.39 C ATOM 1477 OE1 GLU U 153 -31.815 -37.334 -5.439 1.00 53.34 O ATOM 1478 OE2 GLU U 153 -32.966 -36.212 -6.992 1.00 50.64 O ATOM 1479 H GLU U 153 -28.283 -34.835 -8.574 1.00 0.00 H ATOM 1480 N GLN U 154 -27.296 -34.414 -5.753 1.00 37.07 N ATOM 1481 CA GLN U 154 -26.361 -34.091 -4.689 1.00 39.03 C ATOM 1482 C GLN U 154 -26.147 -32.569 -4.594 1.00 41.60 C ATOM 1483 O GLN U 154 -26.018 -31.844 -5.616 1.00 33.68 O ATOM 1484 CB GLN U 154 -25.034 -34.811 -4.927 1.00 39.04 C ATOM 1485 CG GLN U 154 -23.985 -34.699 -3.827 1.00 37.76 C ATOM 1486 CD GLN U 154 -24.371 -35.411 -2.527 1.00 39.38 C ATOM 1487 OE1 GLN U 154 -25.130 -36.364 -2.534 1.00 38.98 O ATOM 1488 NE2 GLN U 154 -23.853 -34.921 -1.409 1.00 40.57 N ATOM 1489 HE22 GLN U 154 -23.209 -34.106 -1.448 1.00 0.00 H ATOM 1490 HE21 GLN U 154 -24.091 -35.352 -0.493 1.00 0.00 H ATOM 1491 H GLN U 154 -26.972 -34.335 -6.738 1.00 0.00 H ATOM 1492 N LEU U 155 -26.070 -32.101 -3.350 1.00 34.86 N ATOM 1493 CA LEU U 155 -25.878 -30.686 -3.077 1.00 33.04 C ATOM 1494 C LEU U 155 -24.588 -30.189 -3.680 1.00 32.87 C ATOM 1495 O LEU U 155 -23.576 -30.883 -3.675 1.00 39.21 O ATOM 1496 CB LEU U 155 -25.837 -30.478 -1.563 1.00 31.98 C ATOM 1497 CG LEU U 155 -25.814 -29.074 -1.037 1.00 31.66 C ATOM 1498 CD1 LEU U 155 -27.101 -28.367 -1.407 1.00 30.09 C ATOM 1499 CD2 LEU U 155 -25.625 -29.154 0.490 1.00 34.10 C ATOM 1500 H LEU U 155 -26.149 -32.765 -2.553 1.00 0.00 H ATOM 1501 N LYS U 156 -24.592 -28.961 -4.154 1.00 31.24 N ATOM 1502 CA LYS U 156 -23.375 -28.382 -4.688 1.00 33.24 C ATOM 1503 C LYS U 156 -23.032 -27.037 -4.051 1.00 31.48 C ATOM 1504 O LYS U 156 -23.883 -26.344 -3.507 1.00 32.37 O ATOM 1505 CB LYS U 156 -23.540 -28.175 -6.198 1.00 34.00 C ATOM 1506 CG LYS U 156 -23.700 -29.463 -7.001 1.00 35.68 C ATOM 1507 CD LYS U 156 -23.629 -29.217 -8.511 1.00 38.25 C ATOM 1508 CE LYS U 156 -22.219 -28.931 -9.016 1.00 42.06 C ATOM 1509 NZ LYS U 156 -22.270 -28.137 -10.286 1.00 45.00 N ATOM 1510 HZ1 LYS U 156 -22.787 -28.676 -11.010 1.00 0.00 H ATOM 1511 HZ2 LYS U 156 -22.757 -27.235 -10.110 1.00 0.00 H ATOM 1512 HZ3 LYS U 156 -21.302 -27.951 -10.616 1.00 0.00 H ATOM 1513 H LYS U 156 -25.471 -28.405 -4.145 1.00 0.00 H ATOM 1514 N MET U 157 -21.782 -26.652 -4.170 1.00 34.22 N ATOM 1515 CA MET U 157 -21.395 -25.310 -3.807 1.00 37.76 C ATOM 1516 C MET U 157 -20.355 -24.778 -4.744 1.00 33.59 C ATOM 1517 O MET U 157 -19.684 -25.517 -5.445 1.00 37.44 O ATOM 1518 CB MET U 157 -20.866 -25.271 -2.376 1.00 38.49 C ATOM 1519 CG MET U 157 -19.473 -25.838 -2.217 1.00 51.20 C ATOM 1520 SD MET U 157 -19.031 -25.760 -0.473 1.00 72.46 S ATOM 1521 CE MET U 157 -18.965 -23.979 -0.292 1.00 67.26 C ATOM 1522 H MET U 157 -21.067 -27.318 -4.528 1.00 0.00 H ATOM 1523 N THR U 158 -20.181 -23.480 -4.705 1.00 33.50 N ATOM 1524 CA THR U 158 -19.094 -22.875 -5.410 1.00 38.06 C ATOM 1525 C THR U 158 -18.685 -21.555 -4.749 1.00 40.91 C ATOM 1526 O THR U 158 -19.291 -21.105 -3.787 1.00 40.65 O ATOM 1527 CB THR U 158 -19.472 -22.653 -6.898 1.00 42.14 C ATOM 1528 OG1 THR U 158 -18.280 -22.517 -7.683 1.00 41.30 O ATOM 1529 CG2 THR U 158 -20.371 -21.436 -7.060 1.00 42.81 C ATOM 1530 HG1 THR U 158 -18.525 -22.376 -8.632 1.00 0.00 H ATOM 1531 H THR U 158 -20.837 -22.886 -4.158 1.00 0.00 H ATOM 1532 N VAL U 159 -17.645 -20.953 -5.305 1.00 41.73 N ATOM 1533 CA VAL U 159 -17.110 -19.703 -4.847 1.00 42.44 C ATOM 1534 C VAL U 159 -17.305 -18.610 -5.904 1.00 45.71 C ATOM 1535 O VAL U 159 -17.007 -18.803 -7.090 1.00 44.08 O ATOM 1536 CB VAL U 159 -15.625 -19.899 -4.514 1.00 45.86 C ATOM 1537 CG1 VAL U 159 -14.903 -18.557 -4.412 1.00 50.05 C ATOM 1538 CG2 VAL U 159 -15.519 -20.703 -3.219 1.00 45.10 C ATOM 1539 H VAL U 159 -17.190 -21.412 -6.120 1.00 0.00 H ATOM 1540 N VAL U 160 -17.839 -17.480 -5.457 1.00 45.14 N ATOM 1541 CA VAL U 160 -17.991 -16.295 -6.279 1.00 45.84 C ATOM 1542 C VAL U 160 -17.429 -15.084 -5.525 1.00 49.87 C ATOM 1543 O VAL U 160 -17.170 -15.145 -4.320 1.00 45.49 O ATOM 1544 CB VAL U 160 -19.469 -16.037 -6.676 1.00 46.39 C ATOM 1545 CG1 VAL U 160 -19.916 -17.041 -7.733 1.00 47.42 C ATOM 1546 CG2 VAL U 160 -20.394 -16.062 -5.470 1.00 45.82 C ATOM 1547 H VAL U 160 -18.164 -17.443 -4.470 1.00 0.00 H ATOM 1548 N LYS U 161 -17.245 -13.988 -6.252 1.00 52.09 N ATOM 1549 CA LYS U 161 -16.684 -12.773 -5.701 1.00 54.77 C ATOM 1550 C LYS U 161 -17.696 -11.630 -5.754 1.00 51.63 C ATOM 1551 O LYS U 161 -18.322 -11.386 -6.785 1.00 50.21 O ATOM 1552 CB LYS U 161 -15.409 -12.394 -6.471 1.00 60.88 C ATOM 1553 CG LYS U 161 -14.140 -13.072 -5.963 1.00 63.72 C ATOM 1554 CD LYS U 161 -12.964 -12.801 -6.891 1.00 72.27 C ATOM 1555 CE LYS U 161 -11.619 -12.965 -6.192 1.00 76.06 C ATOM 1556 NZ LYS U 161 -10.485 -12.881 -7.161 1.00 81.28 N ATOM 1557 HZ1 LYS U 161 -10.581 -13.634 -7.872 1.00 0.00 H ATOM 1558 HZ2 LYS U 161 -10.501 -11.954 -7.632 1.00 0.00 H ATOM 1559 HZ3 LYS U 161 -9.586 -12.997 -6.651 1.00 0.00 H ATOM 1560 H LYS U 161 -17.515 -14.003 -7.256 1.00 0.00 H ATOM 1561 N LEU U 162 -17.827 -10.935 -4.630 1.00 48.65 N ATOM 1562 CA LEU U 162 -18.657 -9.749 -4.511 1.00 53.40 C ATOM 1563 C LEU U 162 -18.230 -8.659 -5.493 1.00 56.29 C ATOM 1564 O LEU U 162 -17.034 -8.376 -5.673 1.00 47.16 O ATOM 1565 CB LEU U 162 -18.602 -9.198 -3.084 1.00 54.75 C ATOM 1566 CG LEU U 162 -19.680 -9.603 -2.068 1.00 60.35 C ATOM 1567 CD1 LEU U 162 -20.372 -10.914 -2.409 1.00 62.79 C ATOM 1568 CD2 LEU U 162 -19.083 -9.655 -0.665 1.00 61.97 C ATOM 1569 H LEU U 162 -17.307 -11.258 -3.789 1.00 0.00 H ATOM 1570 N ILE U 163 -19.236 -8.055 -6.113 1.00 57.24 N ATOM 1571 CA ILE U 163 -19.043 -6.999 -7.096 1.00 64.37 C ATOM 1572 C ILE U 163 -19.518 -5.672 -6.504 1.00 65.89 C ATOM 1573 O ILE U 163 -20.431 -5.648 -5.670 1.00 67.08 O ATOM 1574 CB ILE U 163 -19.777 -7.373 -8.398 1.00 64.18 C ATOM 1575 CG1 ILE U 163 -19.004 -8.509 -9.077 1.00 67.11 C ATOM 1576 CG2 ILE U 163 -19.906 -6.184 -9.345 1.00 68.78 C ATOM 1577 CD1 ILE U 163 -19.842 -9.421 -9.940 1.00 68.32 C ATOM 1578 H ILE U 163 -20.207 -8.350 -5.886 1.00 0.00 H ATOM 1579 N SER U 164 -18.864 -4.581 -6.901 1.00 64.70 N ATOM 1580 CA SER U 164 -19.284 -3.229 -6.497 1.00 65.63 C ATOM 1581 C SER U 164 -20.622 -2.866 -7.159 1.00 63.59 C ATOM 1582 O SER U 164 -20.925 -3.314 -8.265 1.00 64.91 O ATOM 1583 CB SER U 164 -18.203 -2.184 -6.866 1.00 63.26 C ATOM 1584 OG SER U 164 -18.069 -2.005 -8.283 1.00 58.49 O ATOM 1585 HG SER U 164 -18.931 -1.696 -8.658 1.00 0.00 H ATOM 1586 H SER U 164 -18.031 -4.688 -7.515 1.00 0.00 H ATOM 1587 N HIS U 165 -21.422 -2.062 -6.480 1.00 69.93 N ATOM 1588 CA HIS U 165 -22.611 -1.490 -7.107 1.00 79.48 C ATOM 1589 C HIS U 165 -22.223 -0.616 -8.288 1.00 78.21 C ATOM 1590 O HIS U 165 -22.875 -0.646 -9.329 1.00 77.53 O ATOM 1591 CB HIS U 165 -23.415 -0.692 -6.090 1.00 81.08 C ATOM 1592 CG HIS U 165 -24.159 -1.558 -5.132 1.00 86.08 C ATOM 1593 ND1 HIS U 165 -25.396 -2.084 -5.426 1.00 90.13 N ATOM 1594 CD2 HIS U 165 -23.828 -2.027 -3.906 1.00 87.53 C ATOM 1595 CE1 HIS U 165 -25.808 -2.821 -4.411 1.00 89.53 C ATOM 1596 NE2 HIS U 165 -24.875 -2.805 -3.477 1.00 89.03 N ATOM 1597 H HIS U 165 -21.203 -1.834 -5.489 1.00 0.00 H ATOM 1598 N ARG U 166 -21.151 0.149 -8.110 1.00 82.55 N ATOM 1599 CA ARG U 166 -20.514 0.873 -9.205 1.00 87.22 C ATOM 1600 C ARG U 166 -20.491 0.032 -10.465 1.00 82.49 C ATOM 1601 O ARG U 166 -21.028 0.431 -11.497 1.00 84.46 O ATOM 1602 CB ARG U 166 -19.077 1.267 -8.823 1.00 94.76 C ATOM 1603 CG ARG U 166 -18.117 1.400 -10.004 1.00100.09 C ATOM 1604 CD ARG U 166 -16.923 2.289 -9.691 1.00101.25 C ATOM 1605 NE ARG U 166 -16.232 2.693 -10.913 1.00103.40 N ATOM 1606 CZ ARG U 166 -16.696 3.586 -11.788 1.00108.77 C ATOM 1607 NH1 ARG U 166 -15.985 3.880 -12.871 1.00111.79 N ATOM 1608 NH2 ARG U 166 -17.867 4.187 -11.596 1.00109.26 N ATOM 1609 HE ARG U 166 -15.312 2.252 -11.115 1.00 0.00 H ATOM 1610 HH12 ARG U 166 -16.344 4.576 -13.555 1.00 0.00 H ATOM 1611 HH11 ARG U 166 -15.070 3.414 -13.034 1.00 0.00 H ATOM 1612 HH22 ARG U 166 -18.215 4.881 -12.288 1.00 0.00 H ATOM 1613 HH21 ARG U 166 -18.435 3.963 -10.754 1.00 0.00 H ATOM 1614 H ARG U 166 -20.751 0.235 -7.154 1.00 0.00 H ATOM 1615 N GLU U 167 -19.867 -1.137 -10.373 1.00 81.12 N ATOM 1616 CA GLU U 167 -19.685 -1.982 -11.541 1.00 78.08 C ATOM 1617 C GLU U 167 -20.963 -2.704 -11.959 1.00 78.36 C ATOM 1618 O GLU U 167 -21.204 -2.876 -13.159 1.00 76.17 O ATOM 1619 CB GLU U 167 -18.574 -2.994 -11.315 1.00 79.97 C ATOM 1620 CG GLU U 167 -18.125 -3.653 -12.607 1.00 86.94 C ATOM 1621 CD GLU U 167 -17.056 -4.695 -12.395 1.00 93.52 C ATOM 1622 OE1 GLU U 167 -16.247 -4.535 -11.457 1.00101.59 O ATOM 1623 OE2 GLU U 167 -17.023 -5.671 -13.171 1.00 98.80 O ATOM 1624 H GLU U 167 -19.503 -1.452 -9.451 1.00 0.00 H ATOM 1625 N CYS U 168 -21.778 -3.131 -10.991 1.00 76.88 N ATOM 1626 CA CYS U 168 -22.974 -3.923 -11.318 1.00 76.40 C ATOM 1627 C CYS U 168 -24.031 -3.095 -12.057 1.00 74.90 C ATOM 1628 O CYS U 168 -24.797 -3.629 -12.871 1.00 66.94 O ATOM 1629 CB CYS U 168 -23.588 -4.609 -10.084 1.00 73.32 C ATOM 1630 SG CYS U 168 -24.464 -6.107 -10.613 1.00 83.07 S ATOM 1631 H CYS U 168 -21.566 -2.902 -9.999 1.00 0.00 H ATOM 1632 N GLN U 169 -24.016 -1.800 -11.816 1.00 75.22 N ATOM 1633 CA GLN U 169 -24.926 -0.883 -12.471 1.00 75.76 C ATOM 1634 C GLN U 169 -24.567 -0.499 -13.896 1.00 74.33 C ATOM 1635 O GLN U 169 -25.361 0.104 -14.581 1.00 76.06 O ATOM 1636 CB GLN U 169 -25.143 0.331 -11.596 1.00 78.77 C ATOM 1637 CG GLN U 169 -25.554 -0.087 -10.200 1.00 82.90 C ATOM 1638 CD GLN U 169 -26.030 1.050 -9.334 1.00 88.25 C ATOM 1639 OE1 GLN U 169 -26.236 0.885 -8.140 1.00 89.86 O ATOM 1640 NE2 GLN U 169 -26.213 2.209 -9.932 1.00 94.06 N ATOM 1641 HE22 GLN U 169 -26.025 2.304 -10.950 1.00 0.00 H ATOM 1642 HE21 GLN U 169 -26.545 3.029 -9.386 1.00 0.00 H ATOM 1643 H GLN U 169 -23.328 -1.424 -11.133 1.00 0.00 H ATOM 1644 N GLN U 170 -23.390 -0.875 -14.354 1.00 74.72 N ATOM 1645 CA GLN U 170 -22.991 -0.541 -15.699 1.00 76.66 C ATOM 1646 C GLN U 170 -24.000 -1.124 -16.640 1.00 77.14 C ATOM 1647 O GLN U 170 -24.427 -2.248 -16.482 1.00 79.73 O ATOM 1648 CB GLN U 170 -21.622 -1.106 -16.028 1.00 76.58 C ATOM 1649 CG GLN U 170 -20.516 -0.566 -15.158 1.00 76.05 C ATOM 1650 CD GLN U 170 -19.159 -1.082 -15.554 1.00 79.75 C ATOM 1651 OE1 GLN U 170 -18.195 -0.344 -15.559 1.00 78.51 O ATOM 1652 NE2 GLN U 170 -19.077 -2.360 -15.875 1.00 82.40 N ATOM 1653 HE22 GLN U 170 -19.929 -2.956 -15.857 1.00 0.00 H ATOM 1654 HE21 GLN U 170 -18.161 -2.770 -16.146 1.00 0.00 H ATOM 1655 H GLN U 170 -22.745 -1.415 -13.742 1.00 0.00 H ATOM 1656 N PRO U 170A -24.366 -0.288 -17.703 1.00 90.67 N ATOM 1657 CA PRO U 170A -25.493 -0.796 -18.495 1.00 90.91 C ATOM 1658 C PRO U 170A -25.248 -2.147 -19.129 1.00 86.18 C ATOM 1659 O PRO U 170A -26.211 -2.845 -19.377 1.00 86.69 O ATOM 1660 CB PRO U 170A -25.663 0.253 -19.594 1.00 91.05 C ATOM 1661 CG PRO U 170A -25.266 1.511 -18.964 1.00 90.45 C ATOM 1662 CD PRO U 170A -24.013 1.099 -18.298 1.00 90.37 C ATOM 1663 N HIS U 170B -24.015 -2.479 -19.462 1.00 70.52 N ATOM 1664 CA HIS U 170B -23.771 -3.784 -20.029 1.00 70.87 C ATOM 1665 C HIS U 170B -23.865 -4.892 -18.977 1.00 70.77 C ATOM 1666 O HIS U 170B -23.915 -6.054 -19.324 1.00 70.28 O ATOM 1667 CB HIS U 170B -22.544 -3.831 -20.916 1.00 71.40 C ATOM 1668 CG HIS U 170B -21.266 -3.602 -20.200 1.00 72.84 C ATOM 1669 ND1 HIS U 170B -21.006 -2.457 -19.497 1.00 74.58 N ATOM 1670 CD2 HIS U 170B -20.169 -4.374 -20.085 1.00 75.12 C ATOM 1671 CE1 HIS U 170B -19.805 -2.537 -18.967 1.00 76.39 C ATOM 1672 NE2 HIS U 170B -19.273 -3.689 -19.316 1.00 74.84 N ATOM 1673 H HIS U 170B -23.231 -1.811 -19.318 1.00 0.00 H ATOM 1674 N TYR U 171 -23.896 -4.517 -17.701 1.00 66.96 N ATOM 1675 CA TYR U 171 -24.349 -5.419 -16.645 1.00 67.26 C ATOM 1676 C TYR U 171 -25.861 -5.331 -16.419 1.00 60.16 C ATOM 1677 O TYR U 171 -26.600 -5.822 -17.217 1.00 60.68 O ATOM 1678 CB TYR U 171 -23.631 -5.188 -15.338 1.00 66.33 C ATOM 1679 CG TYR U 171 -22.183 -5.595 -15.311 1.00 69.99 C ATOM 1680 CD1 TYR U 171 -21.361 -5.394 -16.394 1.00 71.05 C ATOM 1681 CD2 TYR U 171 -21.633 -6.131 -14.175 1.00 68.90 C ATOM 1682 CE1 TYR U 171 -20.028 -5.742 -16.342 1.00 76.33 C ATOM 1683 CE2 TYR U 171 -20.306 -6.478 -14.115 1.00 73.01 C ATOM 1684 CZ TYR U 171 -19.505 -6.286 -15.198 1.00 72.61 C ATOM 1685 OH TYR U 171 -18.195 -6.643 -15.121 1.00 67.41 O ATOM 1686 HH TYR U 171 -17.757 -6.133 -14.394 1.00 0.00 H ATOM 1687 H TYR U 171 -23.589 -3.556 -17.448 1.00 0.00 H ATOM 1688 N TYR U 172 -26.320 -4.737 -15.330 1.00 56.74 N ATOM 1689 CA TYR U 172 -27.765 -4.663 -15.080 1.00 61.60 C ATOM 1690 C TYR U 172 -28.355 -3.254 -15.015 1.00 63.73 C ATOM 1691 O TYR U 172 -29.583 -3.100 -14.901 1.00 56.40 O ATOM 1692 CB TYR U 172 -28.122 -5.426 -13.800 1.00 61.82 C ATOM 1693 CG TYR U 172 -27.964 -6.924 -13.929 1.00 62.91 C ATOM 1694 CD1 TYR U 172 -28.573 -7.621 -14.970 1.00 62.16 C ATOM 1695 CD2 TYR U 172 -27.206 -7.646 -13.010 1.00 62.11 C ATOM 1696 CE1 TYR U 172 -28.424 -8.990 -15.100 1.00 64.30 C ATOM 1697 CE2 TYR U 172 -27.060 -9.016 -13.129 1.00 60.88 C ATOM 1698 CZ TYR U 172 -27.671 -9.685 -14.170 1.00 61.23 C ATOM 1699 OH TYR U 172 -27.535 -11.043 -14.306 1.00 59.64 O ATOM 1700 HH TYR U 172 -27.892 -11.492 -13.499 1.00 0.00 H ATOM 1701 H TYR U 172 -25.655 -4.321 -14.648 1.00 0.00 H ATOM 1702 N GLY U 173 -27.495 -2.240 -15.077 1.00 69.35 N ATOM 1703 CA GLY U 173 -27.949 -0.858 -15.128 1.00 72.19 C ATOM 1704 C GLY U 173 -28.680 -0.424 -13.876 1.00 72.65 C ATOM 1705 O GLY U 173 -28.237 -0.678 -12.754 1.00 74.52 O ATOM 1706 H GLY U 173 -26.474 -2.440 -15.089 1.00 0.00 H ATOM 1707 N SER U 174 -29.823 0.221 -14.088 1.00 76.81 N ATOM 1708 CA SER U 174 -30.651 0.757 -13.011 1.00 79.01 C ATOM 1709 C SER U 174 -31.379 -0.334 -12.230 1.00 78.34 C ATOM 1710 O SER U 174 -31.912 -0.071 -11.152 1.00 77.80 O ATOM 1711 CB SER U 174 -31.681 1.740 -13.593 1.00 78.47 C ATOM 1712 OG SER U 174 -32.360 1.176 -14.711 1.00 77.08 O ATOM 1713 HG SER U 174 -33.014 1.830 -15.063 1.00 0.00 H ATOM 1714 H SER U 174 -30.143 0.350 -15.069 1.00 0.00 H ATOM 1715 N GLU U 175 -31.404 -1.553 -12.769 1.00 82.84 N ATOM 1716 CA GLU U 175 -32.201 -2.630 -12.177 1.00 83.50 C ATOM 1717 C GLU U 175 -31.584 -3.241 -10.909 1.00 76.05 C ATOM 1718 O GLU U 175 -32.260 -3.972 -10.199 1.00 74.19 O ATOM 1719 CB GLU U 175 -32.504 -3.716 -13.218 1.00 85.93 C ATOM 1720 CG GLU U 175 -33.732 -4.573 -12.896 1.00 96.07 C ATOM 1721 CD GLU U 175 -35.017 -3.770 -12.683 1.00 96.97 C ATOM 1722 OE1 GLU U 175 -35.293 -2.856 -13.489 1.00104.22 O ATOM 1723 OE2 GLU U 175 -35.756 -4.055 -11.712 1.00 91.50 O ATOM 1724 H GLU U 175 -30.847 -1.743 -13.626 1.00 0.00 H ATOM 1725 N VAL U 176 -30.320 -2.931 -10.621 1.00 73.54 N ATOM 1726 CA VAL U 176 -29.685 -3.332 -9.357 1.00 69.52 C ATOM 1727 C VAL U 176 -29.731 -2.147 -8.408 1.00 67.24 C ATOM 1728 O VAL U 176 -29.177 -1.102 -8.709 1.00 68.71 O ATOM 1729 CB VAL U 176 -28.218 -3.761 -9.566 1.00 70.29 C ATOM 1730 CG1 VAL U 176 -27.562 -4.149 -8.243 1.00 69.37 C ATOM 1731 CG2 VAL U 176 -28.142 -4.923 -10.542 1.00 70.12 C ATOM 1732 H VAL U 176 -29.765 -2.388 -11.313 1.00 0.00 H ATOM 1733 N THR U 177 -30.406 -2.310 -7.275 1.00 62.54 N ATOM 1734 CA THR U 177 -30.535 -1.245 -6.291 1.00 62.87 C ATOM 1735 C THR U 177 -29.606 -1.569 -5.134 1.00 65.41 C ATOM 1736 O THR U 177 -28.994 -2.643 -5.107 1.00 69.08 O ATOM 1737 CB THR U 177 -31.970 -1.150 -5.750 1.00 60.72 C ATOM 1738 OG1 THR U 177 -32.188 -2.218 -4.825 1.00 57.77 O ATOM 1739 CG2 THR U 177 -33.001 -1.239 -6.883 1.00 57.77 C ATOM 1740 HG1 THR U 177 -33.111 -2.164 -4.472 1.00 0.00 H ATOM 1741 H THR U 177 -30.857 -3.228 -7.085 1.00 0.00 H ATOM 1742 N THR U 178 -29.518 -0.667 -4.160 1.00 66.04 N ATOM 1743 CA THR U 178 -28.575 -0.843 -3.044 1.00 68.30 C ATOM 1744 C THR U 178 -29.020 -1.891 -2.022 1.00 66.18 C ATOM 1745 O THR U 178 -28.265 -2.218 -1.112 1.00 66.16 O ATOM 1746 CB THR U 178 -28.306 0.479 -2.290 1.00 66.96 C ATOM 1747 OG1 THR U 178 -29.508 0.940 -1.657 1.00 63.95 O ATOM 1748 CG2 THR U 178 -27.781 1.533 -3.243 1.00 67.80 C ATOM 1749 HG1 THR U 178 -29.323 1.786 -1.178 1.00 0.00 H ATOM 1750 H THR U 178 -30.126 0.177 -4.188 1.00 0.00 H ATOM 1751 N LYS U 179 -30.242 -2.398 -2.165 1.00 67.01 N ATOM 1752 CA LYS U 179 -30.766 -3.453 -1.283 1.00 67.76 C ATOM 1753 C LYS U 179 -30.436 -4.847 -1.823 1.00 62.09 C ATOM 1754 O LYS U 179 -30.888 -5.853 -1.284 1.00 57.32 O ATOM 1755 CB LYS U 179 -32.279 -3.283 -1.099 1.00 72.06 C ATOM 1756 CG LYS U 179 -32.641 -2.128 -0.175 1.00 75.50 C ATOM 1757 CD LYS U 179 -34.084 -1.686 -0.341 1.00 81.59 C ATOM 1758 CE LYS U 179 -34.472 -0.663 0.719 1.00 87.44 C ATOM 1759 NZ LYS U 179 -34.573 -1.259 2.084 1.00 90.31 N ATOM 1760 HZ1 LYS U 179 -35.296 -2.007 2.082 1.00 0.00 H ATOM 1761 HZ2 LYS U 179 -33.654 -1.665 2.353 1.00 0.00 H ATOM 1762 HZ3 LYS U 179 -34.839 -0.519 2.765 1.00 0.00 H ATOM 1763 H LYS U 179 -30.849 -2.035 -2.928 1.00 0.00 H ATOM 1764 N MET U 180 -29.643 -4.873 -2.891 1.00 57.08 N ATOM 1765 CA MET U 180 -29.195 -6.076 -3.546 1.00 56.13 C ATOM 1766 C MET U 180 -27.663 -6.110 -3.577 1.00 55.44 C ATOM 1767 O MET U 180 -26.997 -5.120 -3.300 1.00 55.81 O ATOM 1768 CB MET U 180 -29.744 -6.107 -4.967 1.00 53.84 C ATOM 1769 CG MET U 180 -31.239 -5.853 -5.045 1.00 52.82 C ATOM 1770 SD MET U 180 -31.760 -5.803 -6.758 1.00 55.19 S ATOM 1771 CE MET U 180 -33.490 -5.357 -6.611 1.00 56.70 C ATOM 1772 H MET U 180 -29.325 -3.963 -3.280 1.00 0.00 H ATOM 1773 N LEU U 181 -27.115 -7.261 -3.922 1.00 57.26 N ATOM 1774 CA LEU U 181 -25.677 -7.464 -3.946 1.00 54.99 C ATOM 1775 C LEU U 181 -25.385 -8.287 -5.176 1.00 51.86 C ATOM 1776 O LEU U 181 -26.099 -9.247 -5.446 1.00 50.60 O ATOM 1777 CB LEU U 181 -25.263 -8.241 -2.695 1.00 58.58 C ATOM 1778 CG LEU U 181 -24.114 -7.746 -1.829 1.00 64.34 C ATOM 1779 CD1 LEU U 181 -24.289 -6.275 -1.467 1.00 67.91 C ATOM 1780 CD2 LEU U 181 -24.031 -8.605 -0.576 1.00 66.25 C ATOM 1781 H LEU U 181 -27.737 -8.052 -4.186 1.00 0.00 H ATOM 1782 N CYS U 182 -24.355 -7.918 -5.928 1.00 49.20 N ATOM 1783 CA CYS U 182 -23.908 -8.715 -7.056 1.00 50.23 C ATOM 1784 C CYS U 182 -22.673 -9.560 -6.700 1.00 48.63 C ATOM 1785 O CYS U 182 -21.842 -9.162 -5.891 1.00 52.09 O ATOM 1786 CB CYS U 182 -23.609 -7.821 -8.259 1.00 55.73 C ATOM 1787 SG CYS U 182 -25.096 -7.067 -8.927 1.00 63.56 S ATOM 1788 H CYS U 182 -23.855 -7.034 -5.703 1.00 0.00 H ATOM 1789 N ALA U 183 -22.571 -10.735 -7.315 1.00 47.35 N ATOM 1790 CA ALA U 183 -21.422 -11.616 -7.119 1.00 45.75 C ATOM 1791 C ALA U 183 -21.278 -12.539 -8.317 1.00 45.36 C ATOM 1792 O ALA U 183 -22.272 -12.984 -8.909 1.00 46.45 O ATOM 1793 CB ALA U 183 -21.572 -12.408 -5.827 1.00 45.06 C ATOM 1794 H ALA U 183 -23.333 -11.036 -7.955 1.00 0.00 H ATOM 1795 N ALA U 184 -20.047 -12.760 -8.721 1.00 46.73 N ATOM 1796 CA ALA U 184 -19.747 -13.616 -9.842 1.00 48.86 C ATOM 1797 C ALA U 184 -18.306 -14.032 -9.866 1.00 47.19 C ATOM 1798 O ALA U 184 -17.508 -13.542 -9.123 1.00 46.85 O ATOM 1799 CB ALA U 184 -20.129 -12.965 -11.139 1.00 50.26 C ATOM 1800 H ALA U 184 -19.262 -12.302 -8.215 1.00 0.00 H ATOM 1801 N ASP U 185 -18.013 -14.979 -10.727 1.00 49.75 N ATOM 1802 CA ASP U 185 -16.667 -15.366 -11.043 1.00 51.26 C ATOM 1803 C ASP U 185 -15.983 -14.416 -11.997 1.00 52.61 C ATOM 1804 O ASP U 185 -16.526 -14.065 -13.012 1.00 49.64 O ATOM 1805 CB ASP U 185 -16.679 -16.727 -11.682 1.00 57.01 C ATOM 1806 CG ASP U 185 -15.325 -17.328 -11.770 1.00 58.06 C ATOM 1807 OD1 ASP U 185 -14.440 -16.891 -11.051 1.00 67.12 O ATOM 1808 OD2 ASP U 185 -15.129 -18.241 -12.556 1.00 64.51 O ATOM 1809 H ASP U 185 -18.794 -15.473 -11.203 1.00 0.00 H ATOM 1810 N PRO U 185A -14.677 -14.057 -11.640 1.00 75.25 N ATOM 1811 CA PRO U 185A -14.042 -13.112 -12.570 1.00 74.01 C ATOM 1812 C PRO U 185A -13.915 -13.635 -13.984 1.00 69.44 C ATOM 1813 O PRO U 185A -13.974 -12.872 -14.900 1.00 62.76 O ATOM 1814 CB PRO U 185A -12.681 -12.877 -11.963 1.00 77.23 C ATOM 1815 CG PRO U 185A -12.912 -12.982 -10.523 1.00 80.26 C ATOM 1816 CD PRO U 185A -13.663 -14.252 -10.494 1.00 79.15 C ATOM 1817 N GLN U 185B -13.729 -14.923 -14.155 1.00 71.65 N ATOM 1818 CA GLN U 185B -13.753 -15.502 -15.487 1.00 73.57 C ATOM 1819 C GLN U 185B -15.147 -15.877 -15.982 1.00 61.80 C ATOM 1820 O GLN U 185B -15.295 -16.373 -17.061 1.00 58.83 O ATOM 1821 CB GLN U 185B -12.835 -16.707 -15.549 1.00 84.10 C ATOM 1822 CG GLN U 185B -11.402 -16.440 -15.125 1.00 91.78 C ATOM 1823 CD GLN U 185B -10.508 -16.117 -16.297 1.00 96.43 C ATOM 1824 OE1 GLN U 185B -10.818 -15.237 -17.091 1.00101.60 O ATOM 1825 NE2 GLN U 185B -9.392 -16.821 -16.410 1.00100.37 N ATOM 1826 HE22 GLN U 185B -9.170 -17.559 -15.712 1.00 0.00 H ATOM 1827 HE21 GLN U 185B -8.738 -16.636 -17.197 1.00 0.00 H ATOM 1828 H GLN U 185B -13.563 -15.534 -13.330 1.00 0.00 H ATOM 1829 N TRP U 186 -16.154 -15.680 -15.154 1.00 61.25 N ATOM 1830 CA TRP U 186 -17.542 -16.001 -15.477 1.00 59.00 C ATOM 1831 C TRP U 186 -17.857 -17.486 -15.736 1.00 58.58 C ATOM 1832 O TRP U 186 -18.745 -17.802 -16.488 1.00 56.64 O ATOM 1833 CB TRP U 186 -18.019 -15.142 -16.642 1.00 59.63 C ATOM 1834 CG TRP U 186 -17.691 -13.695 -16.511 1.00 58.38 C ATOM 1835 CD1 TRP U 186 -16.635 -13.054 -17.040 1.00 59.75 C ATOM 1836 CD2 TRP U 186 -18.441 -12.715 -15.819 1.00 59.90 C ATOM 1837 NE1 TRP U 186 -16.659 -11.744 -16.704 1.00 59.07 N ATOM 1838 CE2 TRP U 186 -17.770 -11.507 -15.956 1.00 61.01 C ATOM 1839 CE3 TRP U 186 -19.608 -12.745 -15.080 1.00 58.18 C ATOM 1840 CZ2 TRP U 186 -18.225 -10.344 -15.393 1.00 62.71 C ATOM 1841 CZ3 TRP U 186 -20.050 -11.591 -14.524 1.00 61.47 C ATOM 1842 CH2 TRP U 186 -19.363 -10.409 -14.675 1.00 60.73 C ATOM 1843 HE1 TRP U 186 -15.946 -11.036 -16.973 1.00 0.00 H ATOM 1844 H TRP U 186 -15.949 -15.274 -14.219 1.00 0.00 H ATOM 1845 N LYS U 187 -17.123 -18.391 -15.112 1.00 57.73 N ATOM 1846 CA LYS U 187 -17.383 -19.808 -15.287 1.00 56.84 C ATOM 1847 C LYS U 187 -18.200 -20.510 -14.199 1.00 57.02 C ATOM 1848 O LYS U 187 -18.510 -21.666 -14.347 1.00 61.74 O ATOM 1849 CB LYS U 187 -16.082 -20.565 -15.517 1.00 61.29 C ATOM 1850 CG LYS U 187 -15.212 -20.026 -16.631 1.00 59.64 C ATOM 1851 CD LYS U 187 -15.801 -20.284 -17.994 1.00 58.10 C ATOM 1852 CE LYS U 187 -15.045 -19.530 -19.066 1.00 62.01 C ATOM 1853 NZ LYS U 187 -15.914 -19.201 -20.216 1.00 65.14 N ATOM 1854 HZ1 LYS U 187 -16.285 -20.079 -20.631 1.00 0.00 H ATOM 1855 HZ2 LYS U 187 -16.705 -18.608 -19.893 1.00 0.00 H ATOM 1856 HZ3 LYS U 187 -15.361 -18.685 -20.930 1.00 0.00 H ATOM 1857 H LYS U 187 -16.350 -18.084 -14.488 1.00 0.00 H ATOM 1858 N THR U 188 -18.546 -19.836 -13.120 1.00 49.90 N ATOM 1859 CA THR U 188 -19.401 -20.442 -12.107 1.00 48.45 C ATOM 1860 C THR U 188 -20.415 -19.468 -11.573 1.00 49.06 C ATOM 1861 O THR U 188 -20.159 -18.263 -11.526 1.00 52.00 O ATOM 1862 CB THR U 188 -18.585 -21.069 -10.952 1.00 50.69 C ATOM 1863 OG1 THR U 188 -19.458 -21.830 -10.102 1.00 52.51 O ATOM 1864 CG2 THR U 188 -17.844 -20.001 -10.141 1.00 48.78 C ATOM 1865 HG1 THR U 188 -19.887 -22.549 -10.630 1.00 0.00 H ATOM 1866 H THR U 188 -18.205 -18.862 -12.990 1.00 0.00 H ATOM 1867 N ASP U 189 -21.562 -19.994 -11.145 1.00 46.70 N ATOM 1868 CA ASP U 189 -22.707 -19.152 -10.830 1.00 49.33 C ATOM 1869 C ASP U 189 -23.800 -19.888 -10.056 1.00 48.60 C ATOM 1870 O ASP U 189 -23.829 -21.119 -10.010 1.00 48.24 O ATOM 1871 CB ASP U 189 -23.320 -18.663 -12.153 1.00 51.59 C ATOM 1872 CG ASP U 189 -23.698 -17.204 -12.127 1.00 55.49 C ATOM 1873 OD1 ASP U 189 -23.935 -16.631 -11.036 1.00 47.87 O ATOM 1874 OD2 ASP U 189 -23.763 -16.630 -13.238 1.00 61.70 O ATOM 1875 H ASP U 189 -21.641 -21.025 -11.034 1.00 0.00 H ATOM 1876 N SER U 190 -24.717 -19.126 -9.473 1.00 44.66 N ATOM 1877 CA SER U 190 -26.000 -19.691 -9.073 1.00 49.27 C ATOM 1878 C SER U 190 -26.865 -19.882 -10.333 1.00 51.81 C ATOM 1879 O SER U 190 -26.560 -19.323 -11.390 1.00 54.99 O ATOM 1880 CB SER U 190 -26.700 -18.797 -8.054 1.00 46.84 C ATOM 1881 OG SER U 190 -26.993 -17.515 -8.579 1.00 47.35 O ATOM 1882 HG SER U 190 -27.445 -16.971 -7.886 1.00 0.00 H ATOM 1883 H SER U 190 -24.519 -18.120 -9.300 1.00 0.00 H ATOM 1884 N CYS U 191 -27.931 -20.669 -10.226 1.00 47.56 N ATOM 1885 CA CYS U 191 -28.812 -20.882 -11.367 1.00 47.59 C ATOM 1886 C CYS U 191 -30.201 -21.255 -10.912 1.00 47.59 C ATOM 1887 O CYS U 191 -30.507 -21.189 -9.707 1.00 44.01 O ATOM 1888 CB CYS U 191 -28.213 -21.933 -12.316 1.00 50.97 C ATOM 1889 SG CYS U 191 -28.861 -21.890 -14.018 1.00 56.95 S ATOM 1890 H CYS U 191 -28.138 -21.137 -9.320 1.00 0.00 H ATOM 1891 N GLN U 192 -31.058 -21.629 -11.866 1.00 43.72 N ATOM 1892 CA GLN U 192 -32.429 -21.964 -11.545 1.00 42.56 C ATOM 1893 C GLN U 192 -32.459 -23.087 -10.527 1.00 37.27 C ATOM 1894 O GLN U 192 -31.758 -24.063 -10.696 1.00 35.65 O ATOM 1895 CB GLN U 192 -33.203 -22.385 -12.801 1.00 47.49 C ATOM 1896 CG GLN U 192 -34.718 -22.330 -12.637 1.00 48.05 C ATOM 1897 CD GLN U 192 -35.476 -22.864 -13.846 1.00 53.19 C ATOM 1898 OE1 GLN U 192 -34.884 -23.174 -14.882 1.00 58.72 O ATOM 1899 NE2 GLN U 192 -36.792 -22.990 -13.710 1.00 56.53 N ATOM 1900 HE22 GLN U 192 -37.251 -22.716 -12.818 1.00 0.00 H ATOM 1901 HE21 GLN U 192 -37.363 -23.362 -14.496 1.00 0.00 H ATOM 1902 H GLN U 192 -30.736 -21.680 -12.853 1.00 0.00 H ATOM 1903 N GLY U 193 -33.271 -22.928 -9.485 1.00 39.28 N ATOM 1904 CA GLY U 193 -33.368 -23.903 -8.419 1.00 40.99 C ATOM 1905 C GLY U 193 -32.483 -23.607 -7.207 1.00 41.68 C ATOM 1906 O GLY U 193 -32.609 -24.280 -6.178 1.00 36.62 O ATOM 1907 H GLY U 193 -33.858 -22.071 -9.434 1.00 0.00 H ATOM 1908 N ASP U 194 -31.592 -22.624 -7.330 1.00 38.72 N ATOM 1909 CA ASP U 194 -30.729 -22.203 -6.227 1.00 42.10 C ATOM 1910 C ASP U 194 -31.372 -21.090 -5.383 1.00 45.47 C ATOM 1911 O ASP U 194 -30.896 -20.779 -4.286 1.00 43.79 O ATOM 1912 CB ASP U 194 -29.351 -21.745 -6.762 1.00 39.78 C ATOM 1913 CG ASP U 194 -28.499 -22.891 -7.235 1.00 38.89 C ATOM 1914 OD1 ASP U 194 -28.555 -23.982 -6.607 1.00 39.43 O ATOM 1915 OD2 ASP U 194 -27.752 -22.719 -8.226 1.00 36.31 O ATOM 1916 H ASP U 194 -31.507 -22.138 -8.245 1.00 0.00 H ATOM 1917 N SER U 195 -32.467 -20.505 -5.874 1.00 42.82 N ATOM 1918 CA SER U 195 -33.064 -19.354 -5.214 1.00 42.03 C ATOM 1919 C SER U 195 -33.427 -19.612 -3.748 1.00 39.81 C ATOM 1920 O SER U 195 -33.730 -20.730 -3.375 1.00 37.37 O ATOM 1921 CB SER U 195 -34.267 -18.837 -6.006 1.00 43.50 C ATOM 1922 OG SER U 195 -35.363 -19.727 -5.984 1.00 46.73 O ATOM 1923 HG SER U 195 -35.091 -20.593 -6.379 1.00 0.00 H ATOM 1924 H SER U 195 -32.900 -20.878 -6.743 1.00 0.00 H ATOM 1925 N GLY U 196 -33.350 -18.573 -2.913 1.00 35.78 N ATOM 1926 CA GLY U 196 -33.585 -18.708 -1.470 1.00 34.17 C ATOM 1927 C GLY U 196 -32.353 -19.146 -0.684 1.00 36.41 C ATOM 1928 O GLY U 196 -32.247 -18.890 0.533 1.00 37.13 O ATOM 1929 H GLY U 196 -33.115 -17.636 -3.298 1.00 0.00 H ATOM 1930 N GLY U 197 -31.408 -19.777 -1.368 1.00 35.55 N ATOM 1931 CA GLY U 197 -30.156 -20.241 -0.764 1.00 38.07 C ATOM 1932 C GLY U 197 -29.130 -19.161 -0.384 1.00 40.00 C ATOM 1933 O GLY U 197 -29.211 -18.009 -0.839 1.00 37.10 O ATOM 1934 H GLY U 197 -31.563 -19.951 -2.382 1.00 0.00 H ATOM 1935 N PRO U 198 -28.138 -19.543 0.449 1.00 36.86 N ATOM 1936 CA PRO U 198 -27.218 -18.579 1.025 1.00 37.34 C ATOM 1937 C PRO U 198 -26.042 -18.157 0.157 1.00 37.98 C ATOM 1938 O PRO U 198 -25.476 -18.967 -0.570 1.00 40.41 O ATOM 1939 CB PRO U 198 -26.691 -19.316 2.247 1.00 36.76 C ATOM 1940 CG PRO U 198 -26.698 -20.759 1.829 1.00 38.52 C ATOM 1941 CD PRO U 198 -27.938 -20.895 1.001 1.00 35.50 C ATOM 1942 N LEU U 199 -25.691 -16.878 0.263 1.00 37.35 N ATOM 1943 CA LEU U 199 -24.372 -16.379 -0.092 1.00 40.10 C ATOM 1944 C LEU U 199 -23.652 -16.132 1.232 1.00 39.68 C ATOM 1945 O LEU U 199 -24.047 -15.258 2.001 1.00 38.81 O ATOM 1946 CB LEU U 199 -24.481 -15.069 -0.867 1.00 42.60 C ATOM 1947 CG LEU U 199 -23.219 -14.324 -1.315 1.00 45.42 C ATOM 1948 CD1 LEU U 199 -22.415 -15.125 -2.318 1.00 45.85 C ATOM 1949 CD2 LEU U 199 -23.622 -12.999 -1.944 1.00 49.01 C ATOM 1950 H LEU U 199 -26.396 -16.201 0.618 1.00 0.00 H ATOM 1951 N VAL U 200 -22.594 -16.893 1.479 1.00 39.76 N ATOM 1952 CA VAL U 200 -21.907 -16.867 2.769 1.00 44.03 C ATOM 1953 C VAL U 200 -20.494 -16.297 2.597 1.00 46.90 C ATOM 1954 O VAL U 200 -19.741 -16.774 1.748 1.00 42.95 O ATOM 1955 CB VAL U 200 -21.844 -18.281 3.361 1.00 46.09 C ATOM 1956 CG1 VAL U 200 -20.862 -18.345 4.533 1.00 47.80 C ATOM 1957 CG2 VAL U 200 -23.246 -18.728 3.777 1.00 44.61 C ATOM 1958 H VAL U 200 -22.243 -17.527 0.733 1.00 0.00 H ATOM 1959 N CYS U 201 -20.160 -15.272 3.387 1.00 49.47 N ATOM 1960 CA CYS U 201 -18.805 -14.702 3.420 1.00 54.81 C ATOM 1961 C CYS U 201 -18.240 -14.637 4.840 1.00 56.70 C ATOM 1962 O CYS U 201 -18.974 -14.679 5.828 1.00 52.57 O ATOM 1963 CB CYS U 201 -18.764 -13.292 2.820 1.00 57.86 C ATOM 1964 SG CYS U 201 -19.788 -13.026 1.356 1.00 61.93 S ATOM 1965 H CYS U 201 -20.889 -14.860 4.004 1.00 0.00 H ATOM 1966 N SER U 202 -16.918 -14.552 4.925 1.00 62.16 N ATOM 1967 CA SER U 202 -16.248 -14.331 6.192 1.00 67.96 C ATOM 1968 C SER U 202 -16.240 -12.822 6.402 1.00 71.41 C ATOM 1969 O SER U 202 -15.702 -12.084 5.578 1.00 66.88 O ATOM 1970 CB SER U 202 -14.824 -14.892 6.175 1.00 68.44 C ATOM 1971 OG SER U 202 -14.292 -14.952 7.489 1.00 71.11 O ATOM 1972 HG SER U 202 -13.372 -15.317 7.455 1.00 0.00 H ATOM 1973 H SER U 202 -16.348 -14.646 4.060 1.00 0.00 H ATOM 1974 N LEU U 203 -16.886 -12.364 7.468 1.00 76.06 N ATOM 1975 CA LEU U 203 -16.945 -10.938 7.759 1.00 82.51 C ATOM 1976 C LEU U 203 -16.414 -10.725 9.165 1.00 90.06 C ATOM 1977 O LEU U 203 -17.096 -11.040 10.144 1.00 85.72 O ATOM 1978 CB LEU U 203 -18.378 -10.421 7.626 1.00 83.45 C ATOM 1979 CG LEU U 203 -18.557 -8.900 7.612 1.00 84.83 C ATOM 1980 CD1 LEU U 203 -17.775 -8.261 6.470 1.00 84.76 C ATOM 1981 CD2 LEU U 203 -20.038 -8.550 7.526 1.00 84.75 C ATOM 1982 H LEU U 203 -17.358 -13.035 8.107 1.00 0.00 H ATOM 1983 N GLN U 204 -15.179 -10.226 9.254 1.00 99.67 N ATOM 1984 CA GLN U 204 -14.503 -10.010 10.537 1.00100.17 C ATOM 1985 C GLN U 204 -14.452 -11.309 11.364 1.00101.83 C ATOM 1986 O GLN U 204 -15.058 -11.405 12.440 1.00101.22 O ATOM 1987 CB GLN U 204 -15.198 -8.890 11.323 1.00101.25 C ATOM 1988 CG GLN U 204 -15.496 -7.636 10.509 1.00 97.95 C ATOM 1989 CD GLN U 204 -16.572 -6.774 11.142 1.00 98.68 C ATOM 1990 OE1 GLN U 204 -17.547 -7.284 11.696 1.00100.99 O ATOM 1991 NE2 GLN U 204 -16.404 -5.462 11.061 1.00 96.27 N ATOM 1992 HE22 GLN U 204 -15.565 -5.074 10.584 1.00 0.00 H ATOM 1993 HE21 GLN U 204 -17.111 -4.821 11.474 1.00 0.00 H ATOM 1994 H GLN U 204 -14.676 -9.980 8.378 1.00 0.00 H ATOM 1995 N GLY U 205 -13.751 -12.312 10.834 1.00 99.42 N ATOM 1996 CA GLY U 205 -13.552 -13.589 11.528 1.00 94.94 C ATOM 1997 C GLY U 205 -14.635 -14.631 11.301 1.00 92.81 C ATOM 1998 O GLY U 205 -14.354 -15.834 11.278 1.00 95.37 O ATOM 1999 H GLY U 205 -13.329 -12.184 9.892 1.00 0.00 H ATOM 2000 N ARG U 206 -15.872 -14.180 11.111 1.00 84.82 N ATOM 2001 CA ARG U 206 -17.018 -15.073 11.140 1.00 82.35 C ATOM 2002 C ARG U 206 -17.626 -15.378 9.759 1.00 74.24 C ATOM 2003 O ARG U 206 -17.759 -14.488 8.905 1.00 70.88 O ATOM 2004 CB ARG U 206 -18.090 -14.476 12.060 1.00 87.17 C ATOM 2005 CG ARG U 206 -19.242 -15.418 12.369 1.00 92.58 C ATOM 2006 CD ARG U 206 -18.780 -16.668 13.108 1.00 97.53 C ATOM 2007 NE ARG U 206 -19.767 -17.747 13.023 1.00104.97 N ATOM 2008 CZ ARG U 206 -19.965 -18.678 13.957 1.00106.90 C ATOM 2009 NH1 ARG U 206 -19.256 -18.678 15.078 1.00107.14 N ATOM 2010 NH2 ARG U 206 -20.895 -19.609 13.778 1.00108.12 N ATOM 2011 HE ARG U 206 -20.359 -17.790 12.169 1.00 0.00 H ATOM 2012 HH12 ARG U 206 -19.421 -19.410 15.798 1.00 0.00 H ATOM 2013 HH11 ARG U 206 -18.535 -17.946 15.237 1.00 0.00 H ATOM 2014 HH22 ARG U 206 -21.050 -20.336 14.506 1.00 0.00 H ATOM 2015 HH21 ARG U 206 -21.468 -19.612 12.910 1.00 0.00 H ATOM 2016 H ARG U 206 -16.022 -13.166 10.938 1.00 0.00 H ATOM 2017 N MET U 207 -17.985 -16.647 9.562 1.00 66.36 N ATOM 2018 CA MET U 207 -18.815 -17.073 8.433 1.00 63.30 C ATOM 2019 C MET U 207 -20.185 -16.439 8.592 1.00 58.29 C ATOM 2020 O MET U 207 -20.923 -16.819 9.483 1.00 53.14 O ATOM 2021 CB MET U 207 -19.022 -18.597 8.423 1.00 65.50 C ATOM 2022 CG MET U 207 -17.831 -19.454 8.007 1.00 70.26 C ATOM 2023 SD MET U 207 -17.202 -19.107 6.353 1.00 69.74 S ATOM 2024 CE MET U 207 -17.221 -20.756 5.652 1.00 69.89 C ATOM 2025 H MET U 207 -17.661 -17.366 10.240 1.00 0.00 H ATOM 2026 N THR U 208 -20.534 -15.506 7.708 1.00 55.63 N ATOM 2027 CA THR U 208 -21.796 -14.768 7.824 1.00 55.26 C ATOM 2028 C THR U 208 -22.706 -14.833 6.580 1.00 45.12 C ATOM 2029 O THR U 208 -22.228 -14.829 5.454 1.00 52.28 O ATOM 2030 CB THR U 208 -21.476 -13.307 8.199 1.00 57.15 C ATOM 2031 OG1 THR U 208 -21.015 -13.281 9.561 1.00 60.05 O ATOM 2032 CG2 THR U 208 -22.688 -12.410 8.066 1.00 57.42 C ATOM 2033 HG1 THR U 208 -20.804 -12.349 9.819 1.00 0.00 H ATOM 2034 H THR U 208 -19.895 -15.295 6.915 1.00 0.00 H ATOM 2035 N LEU U 209 -24.014 -14.867 6.821 1.00 43.57 N ATOM 2036 CA LEU U 209 -25.034 -14.812 5.766 1.00 43.96 C ATOM 2037 C LEU U 209 -25.171 -13.406 5.214 1.00 42.12 C ATOM 2038 O LEU U 209 -25.815 -12.549 5.809 1.00 53.16 O ATOM 2039 CB LEU U 209 -26.394 -15.280 6.279 1.00 40.54 C ATOM 2040 CG LEU U 209 -27.490 -15.329 5.200 1.00 41.59 C ATOM 2041 CD1 LEU U 209 -27.165 -16.418 4.190 1.00 42.10 C ATOM 2042 CD2 LEU U 209 -28.850 -15.568 5.812 1.00 41.00 C ATOM 2043 H LEU U 209 -24.331 -14.936 7.809 1.00 0.00 H ATOM 2044 N THR U 210 -24.595 -13.197 4.046 1.00 41.42 N ATOM 2045 CA THR U 210 -24.517 -11.894 3.416 1.00 43.64 C ATOM 2046 C THR U 210 -25.555 -11.706 2.303 1.00 46.00 C ATOM 2047 O THR U 210 -26.022 -10.591 2.047 1.00 45.25 O ATOM 2048 CB THR U 210 -23.102 -11.721 2.877 1.00 45.40 C ATOM 2049 OG1 THR U 210 -22.235 -11.522 3.994 1.00 52.46 O ATOM 2050 CG2 THR U 210 -22.986 -10.560 1.907 1.00 47.03 C ATOM 2051 HG1 THR U 210 -21.306 -11.406 3.673 1.00 0.00 H ATOM 2052 H THR U 210 -24.175 -14.010 3.551 1.00 0.00 H ATOM 2053 N GLY U 211 -25.938 -12.793 1.656 1.00 41.75 N ATOM 2054 CA GLY U 211 -26.945 -12.716 0.629 1.00 40.44 C ATOM 2055 C GLY U 211 -27.886 -13.907 0.532 1.00 43.11 C ATOM 2056 O GLY U 211 -27.618 -15.001 1.069 1.00 38.55 O ATOM 2057 H GLY U 211 -25.509 -13.711 1.890 1.00 0.00 H ATOM 2058 N ILE U 212 -28.979 -13.670 -0.195 1.00 40.73 N ATOM 2059 CA ILE U 212 -29.965 -14.683 -0.521 1.00 39.93 C ATOM 2060 C ILE U 212 -30.190 -14.682 -2.033 1.00 41.77 C ATOM 2061 O ILE U 212 -30.515 -13.638 -2.633 1.00 41.60 O ATOM 2062 CB ILE U 212 -31.289 -14.412 0.196 1.00 39.94 C ATOM 2063 CG1 ILE U 212 -31.065 -14.381 1.703 1.00 43.34 C ATOM 2064 CG2 ILE U 212 -32.323 -15.465 -0.164 1.00 42.18 C ATOM 2065 CD1 ILE U 212 -32.251 -13.875 2.492 1.00 45.31 C ATOM 2066 H ILE U 212 -29.133 -12.704 -0.548 1.00 0.00 H ATOM 2067 N VAL U 213 -30.039 -15.860 -2.645 1.00 38.13 N ATOM 2068 CA VAL U 213 -30.098 -15.988 -4.080 1.00 39.89 C ATOM 2069 C VAL U 213 -31.461 -15.471 -4.558 1.00 41.70 C ATOM 2070 O VAL U 213 -32.495 -15.930 -4.069 1.00 43.35 O ATOM 2071 CB VAL U 213 -29.928 -17.461 -4.535 1.00 38.99 C ATOM 2072 CG1 VAL U 213 -29.962 -17.545 -6.044 1.00 35.04 C ATOM 2073 CG2 VAL U 213 -28.621 -18.078 -4.024 1.00 39.39 C ATOM 2074 H VAL U 213 -29.874 -16.710 -2.069 1.00 0.00 H ATOM 2075 N SER U 214 -31.457 -14.542 -5.516 1.00 44.32 N ATOM 2076 CA SER U 214 -32.689 -13.885 -5.991 1.00 45.79 C ATOM 2077 C SER U 214 -32.886 -13.981 -7.504 1.00 45.10 C ATOM 2078 O SER U 214 -33.824 -14.608 -7.963 1.00 47.30 O ATOM 2079 CB SER U 214 -32.725 -12.413 -5.555 1.00 45.72 C ATOM 2080 OG SER U 214 -34.018 -11.840 -5.735 1.00 45.39 O ATOM 2081 HG SER U 214 -34.002 -10.894 -5.444 1.00 0.00 H ATOM 2082 H SER U 214 -30.549 -14.271 -5.945 1.00 0.00 H ATOM 2083 N TRP U 215 -32.004 -13.366 -8.280 1.00 46.40 N ATOM 2084 CA TRP U 215 -32.183 -13.346 -9.727 1.00 46.34 C ATOM 2085 C TRP U 215 -30.898 -13.034 -10.415 1.00 46.87 C ATOM 2086 O TRP U 215 -29.932 -12.636 -9.779 1.00 49.55 O ATOM 2087 CB TRP U 215 -33.230 -12.298 -10.134 1.00 43.66 C ATOM 2088 CG TRP U 215 -32.891 -10.922 -9.680 1.00 43.85 C ATOM 2089 CD1 TRP U 215 -33.136 -10.394 -8.469 1.00 40.49 C ATOM 2090 CD2 TRP U 215 -32.242 -9.900 -10.441 1.00 41.14 C ATOM 2091 NE1 TRP U 215 -32.693 -9.102 -8.413 1.00 43.58 N ATOM 2092 CE2 TRP U 215 -32.141 -8.772 -9.616 1.00 43.24 C ATOM 2093 CE3 TRP U 215 -31.743 -9.833 -11.740 1.00 45.38 C ATOM 2094 CZ2 TRP U 215 -31.557 -7.574 -10.043 1.00 47.73 C ATOM 2095 CZ3 TRP U 215 -31.155 -8.651 -12.169 1.00 46.84 C ATOM 2096 CH2 TRP U 215 -31.072 -7.533 -11.323 1.00 46.34 C ATOM 2097 HE1 TRP U 215 -32.765 -8.473 -7.588 1.00 0.00 H ATOM 2098 H TRP U 215 -31.180 -12.895 -7.854 1.00 0.00 H ATOM 2099 N GLY U 216 -30.844 -13.400 -11.681 1.00 49.41 N ATOM 2100 CA GLY U 216 -29.758 -13.081 -12.564 1.00 51.66 C ATOM 2101 C GLY U 216 -30.105 -13.464 -13.978 1.00 56.10 C ATOM 2102 O GLY U 216 -30.956 -14.291 -14.185 1.00 53.53 O ATOM 2103 H GLY U 216 -31.637 -13.954 -12.063 1.00 0.00 H ATOM 2104 N ARG U 217 -29.382 -12.944 -14.945 1.00 58.61 N ATOM 2105 CA ARG U 217 -29.684 -13.242 -16.327 1.00 66.74 C ATOM 2106 C ARG U 217 -28.833 -14.383 -16.766 1.00 63.68 C ATOM 2107 O ARG U 217 -27.643 -14.309 -16.641 1.00 71.22 O ATOM 2108 CB ARG U 217 -29.363 -12.016 -17.164 1.00 69.38 C ATOM 2109 CG ARG U 217 -29.738 -12.098 -18.617 1.00 75.08 C ATOM 2110 CD ARG U 217 -29.566 -10.753 -19.299 1.00 79.84 C ATOM 2111 NE ARG U 217 -30.196 -10.758 -20.606 1.00 87.71 N ATOM 2112 CZ ARG U 217 -30.011 -9.845 -21.551 1.00 88.68 C ATOM 2113 NH1 ARG U 217 -30.640 -9.965 -22.699 1.00 89.41 N ATOM 2114 NH2 ARG U 217 -29.211 -8.817 -21.353 1.00 87.80 N ATOM 2115 HE ARG U 217 -30.846 -11.541 -20.820 1.00 0.00 H ATOM 2116 HH12 ARG U 217 -30.501 -9.254 -23.445 1.00 0.00 H ATOM 2117 HH11 ARG U 217 -31.277 -10.771 -22.861 1.00 0.00 H ATOM 2118 HH22 ARG U 217 -29.077 -8.110 -22.104 1.00 0.00 H ATOM 2119 HH21 ARG U 217 -28.714 -8.712 -20.446 1.00 0.00 H ATOM 2120 H ARG U 217 -28.587 -12.314 -14.714 1.00 0.00 H ATOM 2121 N GLY U 219 -29.431 -15.444 -17.279 1.00 56.77 N ATOM 2122 CA GLY U 219 -28.680 -16.634 -17.649 1.00 57.46 C ATOM 2123 C GLY U 219 -27.921 -17.222 -16.468 1.00 57.46 C ATOM 2124 O GLY U 219 -28.157 -16.802 -15.370 1.00 49.96 O ATOM 2125 H GLY U 219 -30.461 -15.428 -17.421 1.00 0.00 H ATOM 2126 N CYS U 220 -27.013 -18.170 -16.684 1.00 54.85 N ATOM 2127 CA CYS U 220 -26.184 -18.621 -15.584 1.00 56.25 C ATOM 2128 C CYS U 220 -24.758 -18.718 -16.097 1.00 53.84 C ATOM 2129 O CYS U 220 -24.531 -19.286 -17.165 1.00 54.90 O ATOM 2130 CB CYS U 220 -26.672 -19.984 -15.075 1.00 54.23 C ATOM 2131 SG CYS U 220 -28.433 -19.995 -14.711 1.00 57.34 S ATOM 2132 H CYS U 220 -26.899 -18.583 -17.632 1.00 0.00 H ATOM 2133 N ALA U 221 -23.824 -18.120 -15.372 1.00 51.60 N ATOM 2134 CA ALA U 221 -22.451 -18.074 -15.805 1.00 54.63 C ATOM 2135 C ALA U 221 -22.308 -17.454 -17.185 1.00 56.38 C ATOM 2136 O ALA U 221 -21.647 -17.981 -18.040 1.00 58.95 O ATOM 2137 CB ALA U 221 -21.842 -19.451 -15.779 1.00 55.96 C ATOM 2138 H ALA U 221 -24.088 -17.674 -14.470 1.00 0.00 H ATOM 2139 N LEU U 222 -22.968 -16.337 -17.379 1.00 59.25 N ATOM 2140 CA LEU U 222 -22.968 -15.613 -18.624 1.00 61.25 C ATOM 2141 C LEU U 222 -22.106 -14.391 -18.459 1.00 66.44 C ATOM 2142 O LEU U 222 -22.229 -13.686 -17.484 1.00 64.98 O ATOM 2143 CB LEU U 222 -24.369 -15.146 -18.888 1.00 61.63 C ATOM 2144 CG LEU U 222 -24.881 -15.202 -20.296 1.00 65.35 C ATOM 2145 CD1 LEU U 222 -24.451 -16.523 -20.888 1.00 67.63 C ATOM 2146 CD2 LEU U 222 -26.380 -15.094 -20.230 1.00 65.40 C ATOM 2147 H LEU U 222 -23.523 -15.952 -16.588 1.00 0.00 H ATOM 2148 N LYS U 223 -21.243 -14.118 -19.422 1.00 72.90 N ATOM 2149 CA LYS U 223 -20.279 -13.042 -19.295 1.00 75.34 C ATOM 2150 C LYS U 223 -21.003 -11.736 -19.044 1.00 74.48 C ATOM 2151 O LYS U 223 -21.986 -11.455 -19.668 1.00 77.20 O ATOM 2152 CB LYS U 223 -19.499 -12.953 -20.598 1.00 77.58 C ATOM 2153 CG LYS U 223 -18.473 -11.850 -20.671 1.00 82.53 C ATOM 2154 CD LYS U 223 -17.266 -12.264 -21.494 1.00 84.16 C ATOM 2155 CE LYS U 223 -16.133 -11.254 -21.396 1.00 87.83 C ATOM 2156 NZ LYS U 223 -15.047 -11.480 -22.399 1.00 90.21 N ATOM 2157 HZ1 LYS U 223 -14.637 -12.425 -22.257 1.00 0.00 H ATOM 2158 HZ2 LYS U 223 -15.443 -11.413 -23.358 1.00 0.00 H ATOM 2159 HZ3 LYS U 223 -14.308 -10.758 -22.277 1.00 0.00 H ATOM 2160 H LYS U 223 -21.255 -14.688 -20.292 1.00 0.00 H ATOM 2161 N ASP U 223A -20.550 -10.984 -18.059 1.00 66.24 N ATOM 2162 CA ASP U 223A -21.052 -9.664 -17.771 1.00 71.00 C ATOM 2163 C ASP U 223A -22.388 -9.669 -17.073 1.00 73.75 C ATOM 2164 O ASP U 223A -22.897 -8.623 -16.719 1.00 73.40 O ATOM 2165 CB ASP U 223A -21.169 -8.834 -19.032 1.00 71.15 C ATOM 2166 CG ASP U 223A -19.858 -8.288 -19.496 1.00 72.97 C ATOM 2167 OD1 ASP U 223A -18.953 -8.093 -18.680 1.00 76.42 O ATOM 2168 OD2 ASP U 223A -19.737 -8.037 -20.694 1.00 73.16 O ATOM 2169 H ASP U 223A -19.790 -11.364 -17.459 1.00 0.00 H ATOM 2170 N LYS U 224 -22.944 -10.841 -16.821 1.00 74.78 N ATOM 2171 CA LYS U 224 -24.227 -10.906 -16.143 1.00 69.50 C ATOM 2172 C LYS U 224 -24.176 -11.717 -14.843 1.00 65.95 C ATOM 2173 O LYS U 224 -24.344 -12.916 -14.821 1.00 60.47 O ATOM 2174 CB LYS U 224 -25.292 -11.377 -17.115 1.00 73.20 C ATOM 2175 CG LYS U 224 -25.593 -10.351 -18.208 1.00 78.40 C ATOM 2176 CD LYS U 224 -26.159 -9.056 -17.628 1.00 83.37 C ATOM 2177 CE LYS U 224 -26.026 -7.811 -18.520 1.00 87.87 C ATOM 2178 NZ LYS U 224 -26.204 -6.503 -17.781 1.00 89.24 N ATOM 2179 HZ1 LYS U 224 -27.151 -6.475 -17.352 1.00 0.00 H ATOM 2180 HZ2 LYS U 224 -25.482 -6.426 -17.036 1.00 0.00 H ATOM 2181 HZ3 LYS U 224 -26.100 -5.712 -18.448 1.00 0.00 H ATOM 2182 H LYS U 224 -22.463 -11.717 -17.108 1.00 0.00 H ATOM 2183 N PRO U 225 -23.890 -10.946 -13.713 1.00 58.14 N ATOM 2184 CA PRO U 225 -23.680 -11.728 -12.491 1.00 54.09 C ATOM 2185 C PRO U 225 -24.919 -12.127 -11.707 1.00 54.65 C ATOM 2186 O PRO U 225 -25.970 -11.649 -12.007 1.00 55.42 O ATOM 2187 CB PRO U 225 -22.796 -10.830 -11.668 1.00 54.53 C ATOM 2188 CG PRO U 225 -23.368 -9.513 -11.877 1.00 56.56 C ATOM 2189 CD PRO U 225 -23.669 -9.463 -13.324 1.00 58.31 C ATOM 2190 N GLY U 226 -24.781 -12.999 -10.714 1.00 51.32 N ATOM 2191 CA GLY U 226 -25.885 -13.320 -9.820 1.00 47.97 C ATOM 2192 C GLY U 226 -26.242 -12.109 -8.972 1.00 51.30 C ATOM 2193 O GLY U 226 -25.369 -11.307 -8.629 1.00 50.87 O ATOM 2194 H GLY U 226 -23.862 -13.464 -10.572 1.00 0.00 H ATOM 2195 N VAL U 227 -27.529 -11.964 -8.652 1.00 47.17 N ATOM 2196 CA VAL U 227 -27.996 -10.893 -7.793 1.00 45.19 C ATOM 2197 C VAL U 227 -28.627 -11.531 -6.578 1.00 42.08 C ATOM 2198 O VAL U 227 -29.314 -12.542 -6.688 1.00 44.81 O ATOM 2199 CB VAL U 227 -29.038 -9.993 -8.507 1.00 45.33 C ATOM 2200 CG1 VAL U 227 -29.394 -8.800 -7.633 1.00 46.50 C ATOM 2201 CG2 VAL U 227 -28.496 -9.549 -9.853 1.00 46.01 C ATOM 2202 H VAL U 227 -28.221 -12.642 -9.031 1.00 0.00 H ATOM 2203 N TYR U 228 -28.417 -10.917 -5.426 1.00 43.02 N ATOM 2204 CA TYR U 228 -28.743 -11.514 -4.155 1.00 42.40 C ATOM 2205 C TYR U 228 -29.371 -10.450 -3.314 1.00 43.27 C ATOM 2206 O TYR U 228 -29.063 -9.280 -3.489 1.00 46.24 O ATOM 2207 CB TYR U 228 -27.470 -12.013 -3.440 1.00 42.91 C ATOM 2208 CG TYR U 228 -26.721 -13.087 -4.184 1.00 42.43 C ATOM 2209 CD1 TYR U 228 -25.903 -12.771 -5.270 1.00 42.12 C ATOM 2210 CD2 TYR U 228 -26.835 -14.423 -3.812 1.00 42.99 C ATOM 2211 CE1 TYR U 228 -25.233 -13.750 -5.967 1.00 41.18 C ATOM 2212 CE2 TYR U 228 -26.173 -15.413 -4.504 1.00 41.52 C ATOM 2213 CZ TYR U 228 -25.376 -15.071 -5.575 1.00 40.60 C ATOM 2214 OH TYR U 228 -24.748 -16.060 -6.257 1.00 43.03 O ATOM 2215 HH TYR U 228 -24.216 -15.666 -6.993 1.00 0.00 H ATOM 2216 H TYR U 228 -28.000 -9.964 -5.437 1.00 0.00 H ATOM 2217 N THR U 229 -30.248 -10.852 -2.398 1.00 44.74 N ATOM 2218 CA THR U 229 -30.802 -9.924 -1.432 1.00 47.81 C ATOM 2219 C THR U 229 -29.715 -9.568 -0.402 1.00 50.78 C ATOM 2220 O THR U 229 -29.104 -10.444 0.235 1.00 44.66 O ATOM 2221 CB THR U 229 -32.043 -10.492 -0.708 1.00 48.32 C ATOM 2222 OG1 THR U 229 -33.048 -10.876 -1.667 1.00 45.66 O ATOM 2223 CG2 THR U 229 -32.625 -9.444 0.265 1.00 47.83 C ATOM 2224 HG1 THR U 229 -33.837 -11.238 -1.190 1.00 0.00 H ATOM 2225 H THR U 229 -30.541 -11.850 -2.375 1.00 0.00 H ATOM 2226 N ARG U 230 -29.496 -8.267 -0.231 1.00 51.31 N ATOM 2227 CA ARG U 230 -28.477 -7.766 0.675 1.00 50.90 C ATOM 2228 C ARG U 230 -28.994 -7.867 2.106 1.00 52.75 C ATOM 2229 O ARG U 230 -29.701 -6.974 2.579 1.00 55.37 O ATOM 2230 CB ARG U 230 -28.127 -6.328 0.277 1.00 55.11 C ATOM 2231 CG ARG U 230 -26.827 -5.795 0.832 1.00 59.32 C ATOM 2232 CD ARG U 230 -26.500 -4.428 0.228 1.00 66.00 C ATOM 2233 NE ARG U 230 -25.166 -3.966 0.615 1.00 72.14 N ATOM 2234 CZ ARG U 230 -24.637 -2.783 0.307 1.00 75.84 C ATOM 2235 NH1 ARG U 230 -25.313 -1.898 -0.421 1.00 74.66 N ATOM 2236 NH2 ARG U 230 -23.415 -2.482 0.732 1.00 77.10 N ATOM 2237 HE ARG U 230 -24.582 -4.617 1.178 1.00 0.00 H ATOM 2238 HH12 ARG U 230 -24.884 -0.979 -0.652 1.00 0.00 H ATOM 2239 HH11 ARG U 230 -26.270 -2.125 -0.759 1.00 0.00 H ATOM 2240 HH22 ARG U 230 -22.995 -1.561 0.496 1.00 0.00 H ATOM 2241 HH21 ARG U 230 -22.879 -3.168 1.301 1.00 0.00 H ATOM 2242 H ARG U 230 -30.074 -7.586 -0.764 1.00 0.00 H ATOM 2243 N VAL U 231 -28.617 -8.942 2.807 1.00 51.15 N ATOM 2244 CA VAL U 231 -29.198 -9.277 4.125 1.00 50.47 C ATOM 2245 C VAL U 231 -28.930 -8.246 5.231 1.00 53.90 C ATOM 2246 O VAL U 231 -29.752 -8.074 6.161 1.00 45.05 O ATOM 2247 CB VAL U 231 -28.699 -10.657 4.625 1.00 50.63 C ATOM 2248 CG1 VAL U 231 -29.172 -10.936 6.044 1.00 50.81 C ATOM 2249 CG2 VAL U 231 -29.179 -11.774 3.701 1.00 51.43 C ATOM 2250 H VAL U 231 -27.887 -9.567 2.410 1.00 0.00 H ATOM 2251 N SER U 232 -27.774 -7.592 5.155 1.00 52.53 N ATOM 2252 CA SER U 232 -27.390 -6.611 6.171 1.00 54.04 C ATOM 2253 C SER U 232 -28.425 -5.490 6.241 1.00 56.23 C ATOM 2254 O SER U 232 -28.634 -4.908 7.297 1.00 58.17 O ATOM 2255 CB SER U 232 -25.971 -6.070 5.919 1.00 49.53 C ATOM 2256 OG SER U 232 -25.879 -5.355 4.697 1.00 48.71 O ATOM 2257 HG SER U 232 -24.953 -5.027 4.577 1.00 0.00 H ATOM 2258 H SER U 232 -27.132 -7.781 4.359 1.00 0.00 H ATOM 2259 N HIS U 233 -29.108 -5.236 5.124 1.00 59.15 N ATOM 2260 CA HIS U 233 -30.143 -4.202 5.043 1.00 61.55 C ATOM 2261 C HIS U 233 -31.544 -4.629 5.526 1.00 60.14 C ATOM 2262 O HIS U 233 -32.497 -3.884 5.318 1.00 65.33 O ATOM 2263 CB HIS U 233 -30.241 -3.676 3.598 1.00 64.34 C ATOM 2264 CG HIS U 233 -29.034 -2.910 3.139 1.00 67.54 C ATOM 2265 ND1 HIS U 233 -27.758 -3.156 3.605 1.00 73.85 N ATOM 2266 CD2 HIS U 233 -28.912 -1.909 2.231 1.00 69.75 C ATOM 2267 CE1 HIS U 233 -26.905 -2.338 3.011 1.00 72.76 C ATOM 2268 NE2 HIS U 233 -27.580 -1.569 2.177 1.00 69.40 N ATOM 2269 H HIS U 233 -28.897 -5.796 4.274 1.00 0.00 H ATOM 2270 N PHE U 234 -31.677 -5.790 6.179 1.00 53.10 N ATOM 2271 CA PHE U 234 -32.991 -6.294 6.611 1.00 50.14 C ATOM 2272 C PHE U 234 -33.054 -6.747 8.068 1.00 55.28 C ATOM 2273 O PHE U 234 -34.019 -7.404 8.484 1.00 55.91 O ATOM 2274 CB PHE U 234 -33.450 -7.432 5.688 1.00 49.54 C ATOM 2275 CG PHE U 234 -33.833 -6.975 4.317 1.00 48.04 C ATOM 2276 CD1 PHE U 234 -32.894 -6.899 3.310 1.00 50.09 C ATOM 2277 CD2 PHE U 234 -35.140 -6.601 4.034 1.00 51.25 C ATOM 2278 CE1 PHE U 234 -33.242 -6.467 2.033 1.00 49.52 C ATOM 2279 CE2 PHE U 234 -35.503 -6.177 2.758 1.00 49.48 C ATOM 2280 CZ PHE U 234 -34.550 -6.109 1.758 1.00 49.38 C ATOM 2281 H PHE U 234 -30.827 -6.352 6.387 1.00 0.00 H ATOM 2282 N LEU U 235 -32.063 -6.376 8.869 1.00 55.58 N ATOM 2283 CA LEU U 235 -32.054 -6.815 10.259 1.00 59.90 C ATOM 2284 C LEU U 235 -33.281 -6.385 11.064 1.00 64.11 C ATOM 2285 O LEU U 235 -33.818 -7.190 11.837 1.00 62.60 O ATOM 2286 CB LEU U 235 -30.772 -6.373 10.961 1.00 64.28 C ATOM 2287 CG LEU U 235 -29.503 -7.116 10.532 1.00 68.23 C ATOM 2288 CD1 LEU U 235 -28.335 -6.680 11.404 1.00 71.15 C ATOM 2289 CD2 LEU U 235 -29.670 -8.634 10.594 1.00 68.06 C ATOM 2290 H LEU U 235 -31.296 -5.775 8.506 1.00 0.00 H ATOM 2291 N PRO U 236 -33.739 -5.123 10.890 1.00 69.93 N ATOM 2292 CA PRO U 236 -34.919 -4.695 11.653 1.00 69.68 C ATOM 2293 C PRO U 236 -36.133 -5.562 11.331 1.00 65.13 C ATOM 2294 O PRO U 236 -36.793 -6.084 12.253 1.00 61.59 O ATOM 2295 CB PRO U 236 -35.133 -3.244 11.198 1.00 70.73 C ATOM 2296 CG PRO U 236 -33.812 -2.812 10.653 1.00 66.98 C ATOM 2297 CD PRO U 236 -33.221 -4.039 10.035 1.00 66.93 C ATOM 2298 N TRP U 237 -36.404 -5.724 10.033 1.00 62.29 N ATOM 2299 CA TRP U 237 -37.436 -6.657 9.560 1.00 61.86 C ATOM 2300 C TRP U 237 -37.237 -8.008 10.240 1.00 56.93 C ATOM 2301 O TRP U 237 -38.146 -8.555 10.879 1.00 53.75 O ATOM 2302 CB TRP U 237 -37.362 -6.804 8.032 1.00 65.21 C ATOM 2303 CG TRP U 237 -38.512 -7.564 7.433 1.00 71.31 C ATOM 2304 CD1 TRP U 237 -39.758 -7.081 7.160 1.00 72.86 C ATOM 2305 CD2 TRP U 237 -38.524 -8.944 7.037 1.00 68.58 C ATOM 2306 NE1 TRP U 237 -40.545 -8.071 6.619 1.00 71.41 N ATOM 2307 CE2 TRP U 237 -39.812 -9.223 6.532 1.00 68.06 C ATOM 2308 CE3 TRP U 237 -37.569 -9.969 7.055 1.00 64.47 C ATOM 2309 CZ2 TRP U 237 -40.171 -10.482 6.053 1.00 66.68 C ATOM 2310 CZ3 TRP U 237 -37.925 -11.221 6.575 1.00 60.43 C ATOM 2311 CH2 TRP U 237 -39.214 -11.465 6.081 1.00 65.75 C ATOM 2312 HE1 TRP U 237 -41.536 -7.962 6.324 1.00 0.00 H ATOM 2313 H TRP U 237 -35.867 -5.172 9.334 1.00 0.00 H ATOM 2314 N ILE U 238 -36.013 -8.517 10.146 1.00 61.78 N ATOM 2315 CA ILE U 238 -35.696 -9.841 10.673 1.00 60.70 C ATOM 2316 C ILE U 238 -35.956 -9.920 12.178 1.00 60.26 C ATOM 2317 O ILE U 238 -36.697 -10.791 12.634 1.00 58.85 O ATOM 2318 CB ILE U 238 -34.245 -10.272 10.318 1.00 58.98 C ATOM 2319 CG1 ILE U 238 -34.140 -10.552 8.810 1.00 59.52 C ATOM 2320 CG2 ILE U 238 -33.852 -11.523 11.093 1.00 59.59 C ATOM 2321 CD1 ILE U 238 -32.733 -10.581 8.250 1.00 62.10 C ATOM 2322 H ILE U 238 -35.264 -7.960 9.687 1.00 0.00 H ATOM 2323 N ARG U 239 -35.360 -9.010 12.943 1.00 64.64 N ATOM 2324 CA ARG U 239 -35.527 -9.020 14.404 1.00 67.02 C ATOM 2325 C ARG U 239 -36.983 -8.818 14.851 1.00 65.47 C ATOM 2326 O ARG U 239 -37.426 -9.469 15.802 1.00 70.89 O ATOM 2327 CB ARG U 239 -34.596 -8.008 15.085 1.00 70.61 C ATOM 2328 CG ARG U 239 -33.502 -8.650 15.936 1.00 76.44 C ATOM 2329 CD ARG U 239 -32.101 -8.194 15.549 1.00 83.71 C ATOM 2330 NE ARG U 239 -31.974 -6.739 15.460 1.00 89.05 N ATOM 2331 CZ ARG U 239 -30.857 -6.098 15.113 1.00 92.64 C ATOM 2332 NH1 ARG U 239 -29.746 -6.772 14.830 1.00 93.66 N ATOM 2333 NH2 ARG U 239 -30.850 -4.771 15.053 1.00 94.47 N ATOM 2334 HE ARG U 239 -32.812 -6.165 15.683 1.00 0.00 H ATOM 2335 HH12 ARG U 239 -28.882 -6.260 14.561 1.00 0.00 H ATOM 2336 HH11 ARG U 239 -29.742 -7.811 14.878 1.00 0.00 H ATOM 2337 HH22 ARG U 239 -29.981 -4.267 14.783 1.00 0.00 H ATOM 2338 HH21 ARG U 239 -31.713 -4.236 15.276 1.00 0.00 H ATOM 2339 H ARG U 239 -34.766 -8.280 12.501 1.00 0.00 H ATOM 2340 N SER U 240 -37.729 -7.957 14.163 1.00 65.19 N ATOM 2341 CA SER U 240 -39.131 -7.728 14.526 1.00 71.95 C ATOM 2342 C SER U 240 -39.841 -9.060 14.566 1.00 80.71 C ATOM 2343 O SER U 240 -40.421 -9.441 15.586 1.00 85.68 O ATOM 2344 CB SER U 240 -39.848 -6.812 13.534 1.00 73.69 C ATOM 2345 OG SER U 240 -40.387 -7.553 12.451 1.00 78.40 O ATOM 2346 HG SER U 240 -39.655 -8.022 11.977 1.00 0.00 H ATOM 2347 H SER U 240 -37.314 -7.442 13.361 1.00 0.00 H ATOM 2348 N HIS U 241 -39.749 -9.778 13.451 1.00 83.12 N ATOM 2349 CA HIS U 241 -40.477 -11.023 13.264 1.00 79.57 C ATOM 2350 C HIS U 241 -39.887 -12.198 14.014 1.00 83.00 C ATOM 2351 O HIS U 241 -40.582 -13.185 14.225 1.00 89.17 O ATOM 2352 CB HIS U 241 -40.541 -11.367 11.783 1.00 78.57 C ATOM 2353 CG HIS U 241 -41.336 -10.391 10.979 1.00 74.75 C ATOM 2354 ND1 HIS U 241 -40.751 -9.440 10.171 1.00 74.47 N ATOM 2355 CD2 HIS U 241 -42.671 -10.213 10.868 1.00 74.47 C ATOM 2356 CE1 HIS U 241 -41.694 -8.723 9.589 1.00 73.21 C ATOM 2357 NE2 HIS U 241 -42.868 -9.172 9.994 1.00 74.12 N ATOM 2358 H HIS U 241 -39.134 -9.437 12.685 1.00 0.00 H ATOM 2359 N THR U 242 -38.617 -12.109 14.405 1.00 85.58 N ATOM 2360 CA THR U 242 -37.924 -13.253 15.003 1.00 86.68 C ATOM 2361 C THR U 242 -37.838 -13.202 16.523 1.00 92.09 C ATOM 2362 O THR U 242 -37.900 -14.248 17.176 1.00 85.55 O ATOM 2363 CB THR U 242 -36.498 -13.411 14.445 1.00 87.89 C ATOM 2364 OG1 THR U 242 -35.799 -12.168 14.558 1.00 88.15 O ATOM 2365 CG2 THR U 242 -36.536 -13.842 12.988 1.00 85.10 C ATOM 2366 HG1 THR U 242 -36.280 -11.472 14.043 1.00 0.00 H ATOM 2367 H THR U 242 -38.108 -11.210 14.284 1.00 0.00 H ATOM 2368 N LYS U 243 -37.691 -12.002 17.088 1.00101.96 N ATOM 2369 CA LYS U 243 -37.557 -11.861 18.547 1.00112.58 C ATOM 2370 C LYS U 243 -38.731 -12.466 19.313 1.00113.65 C ATOM 2371 O LYS U 243 -38.590 -12.815 20.488 1.00109.26 O ATOM 2372 CB LYS U 243 -37.346 -10.399 18.964 1.00116.36 C ATOM 2373 CG LYS U 243 -35.890 -9.945 18.969 1.00116.68 C ATOM 2374 CD LYS U 243 -35.049 -10.661 20.028 1.00114.73 C ATOM 2375 CE LYS U 243 -34.210 -11.796 19.454 1.00114.81 C ATOM 2376 NZ LYS U 243 -33.325 -11.351 18.342 1.00115.23 N ATOM 2377 HZ1 LYS U 243 -33.906 -10.963 17.572 1.00 0.00 H ATOM 2378 HZ2 LYS U 243 -32.675 -10.618 18.690 1.00 0.00 H ATOM 2379 HZ3 LYS U 243 -32.778 -12.162 17.990 1.00 0.00 H ATOM 2380 H LYS U 243 -37.671 -11.153 16.488 1.00 0.00 H ATOM 2381 N GLU U 244 -39.879 -12.579 18.647 1.00117.28 N ATOM 2382 CA GLU U 244 -40.999 -13.389 19.144 1.00120.99 C ATOM 2383 C GLU U 244 -40.591 -14.855 19.376 1.00122.89 C ATOM 2384 O GLU U 244 -40.660 -15.698 18.476 1.00120.89 O ATOM 2385 CB GLU U 244 -42.208 -13.315 18.191 1.00118.55 C ATOM 2386 CG GLU U 244 -41.876 -13.409 16.707 1.00112.92 C ATOM 2387 CD GLU U 244 -43.057 -13.841 15.856 1.00105.09 C ATOM 2388 OE1 GLU U 244 -43.436 -15.031 15.924 1.00 96.22 O ATOM 2389 OE2 GLU U 244 -43.589 -12.991 15.109 1.00102.06 O ATOM 2390 H GLU U 244 -39.986 -12.076 17.743 1.00 0.00 H TER 2391 GLU U 244 HETATM 2392 O HOH 1 -43.852 -13.540 -10.847 1.00 68.55 O HETATM 2393 O HOH 2 -15.234 -23.751 2.614 1.00 61.94 O HETATM 2394 O HOH 3 -33.028 -34.716 -9.777 1.00 54.63 O HETATM 2395 O HOH 4 -27.644 -32.110 -12.870 1.00 49.97 O HETATM 2396 O HOH 5 -28.854 -29.739 -13.667 1.00 39.31 O HETATM 2397 O HOH 6 -17.572 -32.287 -7.401 1.00 47.72 O HETATM 2398 O HOH 7 -38.466 -35.837 -0.099 1.00 52.29 O HETATM 2399 O HOH 8 -23.689 -34.993 15.751 1.00 52.88 O HETATM 2400 O HOH 9 -39.528 -38.520 4.926 1.00 53.95 O HETATM 2401 O HOH 10 -26.576 -27.065 -7.695 1.00 30.53 O HETATM 2402 O HOH 11 -28.870 -28.088 7.325 1.00 33.33 O HETATM 2403 O HOH 12 -30.637 -29.594 4.387 1.00 30.60 O HETATM 2404 O HOH 13 -29.830 -22.751 -2.751 1.00 32.45 O HETATM 2405 O HOH 14 -31.326 -25.064 -3.780 1.00 33.40 O HETATM 2406 O HOH 15 -30.994 -17.960 2.628 1.00 40.56 O HETATM 2407 O HOH 16 -44.256 -19.038 -5.098 1.00 56.67 O HETATM 2408 O HOH 17 -45.852 -26.710 7.353 1.00 49.94 O HETATM 2409 O HOH 18 -33.628 -9.151 -5.475 1.00 53.50 O HETATM 2410 O HOH 19 -25.562 -8.269 3.554 1.00 48.38 O HETATM 2411 O HOH 20 -19.883 -5.150 -3.131 1.00 61.84 O HETATM 2412 O HOH 21 -23.322 -15.500 -8.538 1.00 41.36 O HETATM 2413 O HOH 22 -20.135 -15.713 -12.619 1.00 52.35 O HETATM 2414 O HOH 23 -37.155 -26.154 -15.878 1.00 64.94 O HETATM 2415 O HOH 24 -38.557 -31.986 -6.687 1.00 53.14 O HETATM 2416 O HOH 25 -37.747 -26.454 -13.224 1.00 59.67 O HETATM 2417 O HOH 26 -28.694 -34.147 12.845 1.00 42.24 O HETATM 2418 O HOH 27 -25.193 -23.930 15.228 1.00 44.43 O HETATM 2419 O HOH 28 -10.983 -12.883 -2.675 1.00 66.42 O HETATM 2420 O HOH 29 -42.210 -26.858 -6.456 1.00 55.24 O HETATM 2421 O HOH 30 -23.313 -21.028 1.091 1.00 56.01 O HETATM 2422 O HOH 31 -36.136 -22.341 -6.667 1.00 48.71 O HETATM 2423 O HOH 32 -32.545 -16.097 -14.739 1.00 30.00 O HETATM 2424 N CYS A 33 -43.778 -14.349 -13.773 1.00 0.24 N HETATM 2425 CA CYS A 33 -42.357 -14.581 -13.397 1.00 0.08 C HETATM 2426 C CYS A 33 -41.454 -13.545 -14.051 1.00 0.23 C HETATM 2427 O CYS A 33 -41.495 -13.393 -15.272 1.00 -0.39 O HETATM 2428 N CYS A 33 -40.629 -12.837 -13.247 1.00 -0.25 N HETATM 2429 CA CYS A 33 -39.586 -11.969 -13.810 1.00 0.13 C HETATM 2430 C CYS A 33 -38.666 -12.730 -14.745 1.00 0.20 C HETATM 2431 O CYS A 33 -38.401 -13.920 -14.522 1.00 -0.39 O HETATM 2432 N CYS A 33 -38.185 -12.045 -15.780 1.00 -0.26 N HETATM 2433 CA CYS A 33 -37.410 -12.689 -16.846 1.00 0.13 C HETATM 2434 C CYS A 33 -36.091 -13.290 -16.347 1.00 0.20 C HETATM 2435 O CYS A 33 -35.587 -14.255 -16.934 1.00 -0.39 O HETATM 2436 N CYS A 33 -35.592 -12.747 -15.260 1.00 -0.26 N HETATM 2437 CA CYS A 33 -34.346 -13.176 -14.690 1.00 0.14 C HETATM 2438 C CYS A 33 -34.477 -14.002 -13.395 1.00 0.21 C HETATM 2439 O CYS A 33 -33.506 -14.204 -12.707 1.00 -0.39 O HETATM 2440 N CYS A 33 -35.679 -14.447 -13.064 1.00 -0.26 N HETATM 2441 CA CYS A 33 -35.909 -15.247 -11.880 1.00 0.15 C HETATM 2442 C CYS A 33 -35.025 -16.473 -11.881 1.00 0.21 C HETATM 2443 O CYS A 33 -34.854 -17.086 -12.914 1.00 -0.39 O HETATM 2444 N CYS A 33 -34.473 -16.877 -10.803 1.00 -0.26 N HETATM 2445 CA CYS A 33 -33.907 -18.188 -10.640 1.00 0.13 C HETATM 2446 C CYS A 33 -34.824 -18.980 -10.001 1.00 0.20 C HETATM 2447 O CYS A 33 -34.328 -20.103 -9.879 1.00 -0.39 O HETATM 2448 N CYS A 33 -36.065 -19.061 -9.479 1.00 -0.26 N HETATM 2449 CA CYS A 33 -37.133 -19.864 -8.952 1.00 0.14 C HETATM 2450 C CYS A 33 -37.415 -21.007 -9.891 1.00 0.21 C HETATM 2451 O CYS A 33 -37.654 -20.828 -11.064 1.00 -0.39 O HETATM 2452 N CYS A 33 -37.419 -22.200 -9.343 1.00 -0.26 N HETATM 2453 CA CYS A 33 -37.527 -23.397 -10.143 1.00 0.13 C HETATM 2454 C CYS A 33 -38.823 -23.501 -10.923 1.00 0.20 C HETATM 2455 O CYS A 33 -38.848 -24.076 -11.984 1.00 -0.39 O HETATM 2456 N CYS A 33 -39.895 -22.970 -10.359 1.00 -0.26 N HETATM 2457 CA CYS A 33 -41.262 -23.061 -10.912 1.00 0.14 C HETATM 2458 C CYS A 33 -41.563 -22.083 -12.056 1.00 0.21 C HETATM 2459 O CYS A 33 -42.659 -22.117 -12.610 1.00 -0.39 O HETATM 2460 N CYS A 33 -40.614 -21.211 -12.391 1.00 -0.27 N HETATM 2461 CA CYS A 33 -40.802 -20.236 -13.460 1.00 0.10 C HETATM 2462 C CYS A 33 -40.440 -20.821 -14.813 1.00 0.06 C HETATM 2463 O CYS A 33 -39.403 -21.462 -14.947 1.00 -0.57 O HETATM 2464 OXT CYS A 33 -41.184 -20.653 -15.773 1.00 -0.57 O HETATM 2465 CB CYS A 33 -39.961 -18.990 -13.189 1.00 0.04 C HETATM 2466 SG CYS A 33 -40.648 -17.962 -11.870 1.00 -0.09 S HETATM 2467 SG CYS A 33 -42.411 -17.282 -12.659 1.00 -0.08 S HETATM 2468 CB CYS A 33 -41.918 -15.984 -13.823 1.00 0.06 C HETATM 2469 H5 CYS A 33 -40.822 -15.994 -13.911 1.00 0.05 H HETATM 2470 H6 CYS A 33 -42.367 -16.206 -14.803 1.00 0.05 H HETATM 2471 H64 CYS A 33 -39.909 -18.392 -14.111 1.00 0.04 H HETATM 2472 H65 CYS A 33 -38.948 -19.305 -12.899 1.00 0.04 H HETATM 2473 H63 CYS A 33 -41.863 -19.946 -13.481 1.00 0.07 H HETATM 2474 H62 CYS A 33 -39.746 -21.225 -11.895 1.00 0.19 H HETATM 2475 CB CYS A 33 -42.307 -22.844 -9.799 1.00 0.04 C HETATM 2476 CG CYS A 33 -43.068 -24.117 -9.431 1.00 0.04 C HETATM 2477 OD1 CYS A 33 -42.459 -25.219 -9.415 1.00 -0.57 O HETATM 2478 OD2 CYS A 33 -44.284 -24.003 -9.143 1.00 -0.57 O HETATM 2479 H60 CYS A 33 -43.031 -22.090 -10.142 1.00 0.05 H HETATM 2480 H61 CYS A 33 -41.790 -22.474 -8.901 1.00 0.05 H HETATM 2481 H59 CYS A 33 -41.383 -24.080 -11.308 1.00 0.08 H HETATM 2482 H58 CYS A 33 -39.772 -22.473 -9.500 1.00 0.19 H HETATM 2483 CB CYS A 33 -37.229 -24.644 -9.313 1.00 -0.01 C HETATM 2484 CG CYS A 33 -38.273 -25.557 -8.690 1.00 -0.04 C HETATM 2485 CD1 CYS A 33 -39.642 -24.928 -8.591 1.00 -0.06 C HETATM 2486 H52 CYS A 33 -40.342 -25.643 -8.133 1.00 0.02 H HETATM 2487 H53 CYS A 33 -39.997 -24.661 -9.598 1.00 0.02 H HETATM 2488 H54 CYS A 33 -39.585 -24.022 -7.970 1.00 0.02 H HETATM 2489 CD2 CYS A 33 -38.358 -26.837 -9.478 1.00 -0.06 C HETATM 2490 H55 CYS A 33 -37.359 -27.292 -9.548 1.00 0.02 H HETATM 2491 H56 CYS A 33 -38.734 -26.621 -10.489 1.00 0.02 H HETATM 2492 H57 CYS A 33 -39.043 -27.534 -8.973 1.00 0.02 H HETATM 2493 H51 CYS A 33 -37.941 -25.797 -7.669 1.00 0.03 H HETATM 2494 H49 CYS A 33 -36.610 -24.294 -8.474 1.00 0.03 H HETATM 2495 H50 CYS A 33 -36.628 -25.293 -9.967 1.00 0.03 H HETATM 2496 H48 CYS A 33 -36.730 -23.332 -10.898 1.00 0.08 H HETATM 2497 H47 CYS A 33 -37.346 -22.282 -8.349 1.00 0.19 H HETATM 2498 CB CYS A 33 -38.341 -19.058 -8.777 1.00 0.02 C HETATM 2499 CG CYS A 33 -39.444 -19.789 -8.055 1.00 -0.05 C HETATM 2500 CD1 CYS A 33 -39.179 -20.784 -7.158 1.00 -0.07 C HETATM 2501 CE1 CYS A 33 -40.196 -21.423 -6.490 1.00 -0.04 C HETATM 2502 CZ CYS A 33 -41.483 -21.071 -6.734 1.00 0.08 C HETATM 2503 CE2 CYS A 33 -41.759 -20.094 -7.627 1.00 -0.04 C HETATM 2504 CD2 CYS A 33 -40.749 -19.465 -8.280 1.00 -0.07 C HETATM 2505 H43 CYS A 33 -40.985 -18.687 -8.997 1.00 0.05 H HETATM 2506 H45 CYS A 33 -42.788 -19.813 -7.822 1.00 0.05 H HETATM 2507 OH CYS A 33 -42.515 -21.675 -6.093 1.00 -0.34 O HETATM 2508 H46 CYS A 33 -43.003 -21.026 -5.599 1.00 0.25 H HETATM 2509 H44 CYS A 33 -39.971 -22.204 -5.772 1.00 0.05 H HETATM 2510 H42 CYS A 33 -38.152 -21.074 -6.970 1.00 0.05 H HETATM 2511 H40 CYS A 33 -38.710 -18.761 -9.770 1.00 0.05 H HETATM 2512 H41 CYS A 33 -38.081 -18.159 -8.199 1.00 0.05 H HETATM 2513 H39 CYS A 33 -36.829 -20.267 -7.975 1.00 0.08 H HETATM 2514 H38 CYS A 33 -36.398 -18.119 -9.441 1.00 0.19 H HETATM 2515 CB CYS A 33 -32.628 -18.110 -9.824 1.00 -0.02 C HETATM 2516 H35 CYS A 33 -32.206 -19.119 -9.707 1.00 0.03 H HETATM 2517 H36 CYS A 33 -32.851 -17.688 -8.833 1.00 0.03 H HETATM 2518 H37 CYS A 33 -31.901 -17.466 -10.341 1.00 0.03 H HETATM 2519 H34 CYS A 33 -33.679 -18.614 -11.628 1.00 0.08 H HETATM 2520 H33 CYS A 33 -34.432 -16.246 -10.028 1.00 0.19 H HETATM 2521 CB CYS A 33 -37.362 -15.680 -11.806 1.00 0.08 C HETATM 2522 OG CYS A 33 -37.653 -16.316 -10.587 1.00 -0.39 O HETATM 2523 H32 CYS A 33 -37.482 -15.717 -9.870 1.00 0.21 H HETATM 2524 H30 CYS A 33 -37.569 -16.378 -12.631 1.00 0.06 H HETATM 2525 H31 CYS A 33 -38.004 -14.793 -11.907 1.00 0.06 H HETATM 2526 H29 CYS A 33 -35.673 -14.639 -10.994 1.00 0.08 H HETATM 2527 H28 CYS A 33 -36.456 -14.223 -13.653 1.00 0.19 H HETATM 2528 CB CYS A 33 -33.495 -11.959 -14.441 1.00 0.02 C HETATM 2529 CG CYS A 33 -33.077 -11.188 -15.662 1.00 -0.05 C HETATM 2530 CD1 CYS A 33 -33.055 -11.766 -16.912 1.00 -0.07 C HETATM 2531 CE1 CYS A 33 -32.643 -11.055 -18.012 1.00 -0.04 C HETATM 2532 CZ CYS A 33 -32.236 -9.754 -17.867 1.00 0.08 C HETATM 2533 CE2 CYS A 33 -32.234 -9.171 -16.634 1.00 -0.04 C HETATM 2534 CD2 CYS A 33 -32.658 -9.882 -15.545 1.00 -0.07 C HETATM 2535 H24 CYS A 33 -32.664 -9.408 -14.570 1.00 0.05 H HETATM 2536 H26 CYS A 33 -31.897 -8.147 -16.517 1.00 0.05 H HETATM 2537 OH CYS A 33 -31.820 -9.023 -18.941 1.00 -0.34 O HETATM 2538 H27 CYS A 33 -31.876 -9.556 -19.726 1.00 0.25 H HETATM 2539 H25 CYS A 33 -32.640 -11.521 -18.991 1.00 0.05 H HETATM 2540 H23 CYS A 33 -33.367 -12.797 -17.029 1.00 0.05 H HETATM 2541 H21 CYS A 33 -32.583 -12.287 -13.921 1.00 0.05 H HETATM 2542 H22 CYS A 33 -34.063 -11.278 -13.791 1.00 0.05 H HETATM 2543 H20 CYS A 33 -33.841 -13.811 -15.433 1.00 0.08 H HETATM 2544 H19 CYS A 33 -36.098 -12.009 -14.814 1.00 0.19 H HETATM 2545 CB CYS A 33 -37.145 -11.706 -17.988 1.00 -0.02 C HETATM 2546 H16 CYS A 33 -36.564 -12.207 -18.776 1.00 0.03 H HETATM 2547 H17 CYS A 33 -36.578 -10.844 -17.606 1.00 0.03 H HETATM 2548 H18 CYS A 33 -38.103 -11.360 -18.403 1.00 0.03 H HETATM 2549 H15 CYS A 33 -38.019 -13.514 -17.244 1.00 0.08 H HETATM 2550 H14 CYS A 33 -38.357 -11.061 -15.832 1.00 0.19 H HETATM 2551 CB CYS A 33 -38.811 -11.501 -12.579 1.00 -0.01 C HETATM 2552 CG CYS A 33 -39.808 -11.552 -11.482 1.00 -0.03 C HETATM 2553 CD CYS A 33 -40.679 -12.736 -11.777 1.00 0.04 C HETATM 2554 H12 CYS A 33 -40.279 -13.646 -11.306 1.00 0.05 H HETATM 2555 H13 CYS A 33 -41.708 -12.564 -11.429 1.00 0.05 H HETATM 2556 H10 CYS A 33 -40.407 -10.630 -11.466 1.00 0.03 H HETATM 2557 H11 CYS A 33 -39.304 -11.679 -10.512 1.00 0.03 H HETATM 2558 H8 CYS A 33 -38.437 -10.476 -12.719 1.00 0.03 H HETATM 2559 H9 CYS A 33 -37.966 -12.174 -12.370 1.00 0.03 H HETATM 2560 H7 CYS A 33 -40.032 -11.118 -14.346 1.00 0.08 H HETATM 2561 H4 CYS A 33 -42.263 -14.495 -12.304 1.00 0.11 H HETATM 2562 H1 CYS A 33 -44.360 -15.043 -13.331 1.00 0.20 H HETATM 2563 H2 CYS A 33 -43.876 -14.416 -14.774 1.00 0.20 H HETATM 2564 H3 CYS A 33 -44.061 -13.431 -13.468 1.00 0.20 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 307 306 439 CONECT 365 364 1082 CONECT 439 307 438 CONECT 1082 365 1081 CONECT 1313 1312 1964 CONECT 1630 1629 1787 CONECT 1787 1630 1786 CONECT 1889 1888 2131 CONECT 1964 1313 1963 CONECT 2131 1889 2130 CONECT 2424 2425 2562 2563 2564 CONECT 2425 2424 2426 2468 2561 CONECT 2426 2425 2427 2428 CONECT 2427 2426 CONECT 2428 2426 2429 2553 CONECT 2429 2428 2430 2551 2560 CONECT 2430 2429 2431 2432 CONECT 2431 2430 CONECT 2432 2430 2433 2550 CONECT 2433 2432 2434 2545 2549 CONECT 2434 2433 2435 2436 CONECT 2435 2434 CONECT 2436 2434 2437 2544 CONECT 2437 2436 2438 2528 2543 CONECT 2438 2437 2439 2440 CONECT 2439 2438 CONECT 2440 2438 2441 2527 CONECT 2441 2440 2442 2521 2526 CONECT 2442 2441 2443 2444 CONECT 2443 2442 CONECT 2444 2442 2445 2520 CONECT 2445 2444 2446 2515 2519 CONECT 2446 2445 2447 2448 CONECT 2447 2446 CONECT 2448 2446 2449 2514 CONECT 2449 2448 2450 2498 2513 CONECT 2450 2449 2451 2452 CONECT 2451 2450 CONECT 2452 2450 2453 2497 CONECT 2453 2452 2454 2483 2496 CONECT 2454 2453 2455 2456 CONECT 2455 2454 CONECT 2456 2454 2457 2482 CONECT 2457 2456 2458 2475 2481 CONECT 2458 2457 2459 2460 CONECT 2459 2458 CONECT 2460 2458 2461 2474 CONECT 2461 2460 2462 2465 2473 CONECT 2462 2461 2463 2464 CONECT 2463 2462 CONECT 2464 2462 CONECT 2465 2461 2466 2471 2472 CONECT 2466 2465 2467 CONECT 2467 2466 2468 CONECT 2468 2425 2467 2469 2470 CONECT 2469 2468 CONECT 2470 2468 CONECT 2471 2465 CONECT 2472 2465 CONECT 2473 2461 CONECT 2474 2460 CONECT 2475 2457 2476 2479 2480 CONECT 2476 2475 2477 2478 CONECT 2477 2476 CONECT 2478 2476 CONECT 2479 2475 CONECT 2480 2475 CONECT 2481 2457 CONECT 2482 2456 CONECT 2483 2453 2484 2494 2495 CONECT 2484 2483 2485 2489 2493 CONECT 2485 2484 2486 2487 2488 CONECT 2486 2485 CONECT 2487 2485 CONECT 2488 2485 CONECT 2489 2484 2490 2491 2492 CONECT 2490 2489 CONECT 2491 2489 CONECT 2492 2489 CONECT 2493 2484 CONECT 2494 2483 CONECT 2495 2483 CONECT 2496 2453 CONECT 2497 2452 CONECT 2498 2449 2499 2511 2512 CONECT 2499 2498 2500 2504 CONECT 2500 2499 2501 2510 CONECT 2501 2500 2502 2509 CONECT 2502 2501 2503 2507 CONECT 2503 2502 2504 2506 CONECT 2504 2499 2503 2505 CONECT 2505 2504 CONECT 2506 2503 CONECT 2507 2502 2508 CONECT 2508 2507 CONECT 2509 2501 CONECT 2510 2500 CONECT 2511 2498 CONECT 2512 2498 CONECT 2513 2449 CONECT 2514 2448 CONECT 2515 2445 2516 2517 2518 CONECT 2516 2515 CONECT 2517 2515 CONECT 2518 2515 CONECT 2519 2445 CONECT 2520 2444 CONECT 2521 2441 2522 2524 2525 CONECT 2522 2521 2523 CONECT 2523 2522 CONECT 2524 2521 CONECT 2525 2521 CONECT 2526 2441 CONECT 2527 2440 CONECT 2528 2437 2529 2541 2542 CONECT 2529 2528 2530 2534 CONECT 2530 2529 2531 2540 CONECT 2531 2530 2532 2539 CONECT 2532 2531 2533 2537 CONECT 2533 2532 2534 2536 CONECT 2534 2529 2533 2535 CONECT 2535 2534 CONECT 2536 2533 CONECT 2537 2532 2538 CONECT 2538 2537 CONECT 2539 2531 CONECT 2540 2530 CONECT 2541 2528 CONECT 2542 2528 CONECT 2543 2437 CONECT 2544 2436 CONECT 2545 2433 2546 2547 2548 CONECT 2546 2545 CONECT 2547 2545 CONECT 2548 2545 CONECT 2549 2433 CONECT 2550 2432 CONECT 2551 2429 2552 2558 2559 CONECT 2552 2551 2553 2556 2557 CONECT 2553 2428 2552 2554 2555 CONECT 2554 2553 CONECT 2555 2553 CONECT 2556 2552 CONECT 2557 2552 CONECT 2558 2551 CONECT 2559 2551 CONECT 2560 2429 CONECT 2561 2425 CONECT 2562 2424 CONECT 2563 2424 CONECT 2564 2424 MASTER 0 0 0 0 0 0 0 0 2563 1 155 19 END
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Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
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Related entries of code: 4x1r
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
1ejn
RCSB PDB
PDBbind
253aa, >1EJN_1|Chain... at 99%
1f5k
RCSB PDB
PDBbind
253aa, >1F5K_1|Chain... at 99%
1f5l
RCSB PDB
PDBbind
253aa, >1F5L_1|Chain... at 99%
1f92
RCSB PDB
PDBbind
253aa, >1F92_1|Chain... at 99%
1fv9
RCSB PDB
PDBbind
245aa, >1FV9_1|Chain... at 99%
1owd
RCSB PDB
PDBbind
245aa, >1OWD_1|Chain... at 99%
1owe
RCSB PDB
PDBbind
245aa, >1OWE_1|Chain... at 99%
1owh
RCSB PDB
PDBbind
245aa, >1OWH_1|Chain... at 99%
1owi
RCSB PDB
PDBbind
245aa, >1OWI_1|Chain... at 99%
1owj
RCSB PDB
PDBbind
245aa, >1OWJ_1|Chain... at 99%
1owk
RCSB PDB
PDBbind
245aa, >1OWK_1|Chain... at 99%
1sc8
RCSB PDB
PDBbind
262aa, >1SC8_1|Chain... at 99%
1sqa
RCSB PDB
PDBbind
245aa, >1SQA_1|Chain... at 99%
1sqo
RCSB PDB
PDBbind
245aa, >1SQO_1|Chain... at 99%
1sqt
RCSB PDB
PDBbind
245aa, >1SQT_1|Chain... at 99%
1u6q
RCSB PDB
PDBbind
245aa, >1U6Q_1|Chain... at 99%
1vj9
RCSB PDB
PDBbind
262aa, >1VJ9_1|Chain... at 99%
1vja
RCSB PDB
PDBbind
262aa, >1VJA_1|Chain... at 99%
1w0z
RCSB PDB
PDBbind
247aa, >1W0Z_1|Chain... at 99%
1w10
RCSB PDB
PDBbind
247aa, >1W10_1|Chain... at 99%
1w11
RCSB PDB
PDBbind
247aa, >1W11_1|Chain... at 99%
1w12
RCSB PDB
PDBbind
247aa, >1W12_1|Chain... at 99%
1w13
RCSB PDB
PDBbind
247aa, >1W13_1|Chain... at 99%
1w14
RCSB PDB
PDBbind
247aa, >1W14_1|Chain... at 99%
2r2w
RCSB PDB
PDBbind
253aa, >2R2W_1|Chain... at 99%
2vin
RCSB PDB
PDBbind
253aa, >2VIN_1|Chain... at 99%
2vio
RCSB PDB
PDBbind
253aa, >2VIO_1|Chain... at 99%
2vip
RCSB PDB
PDBbind
253aa, >2VIP_1|Chain... at 99%
2viq
RCSB PDB
PDBbind
253aa, >2VIQ_1|Chain... at 99%
2viv
RCSB PDB
PDBbind
253aa, >2VIV_1|Chain... at 99%
2viw
RCSB PDB
PDBbind
253aa, >2VIW_1|Chain... at 99%
2vnt
RCSB PDB
PDBbind
276aa, >2VNT_1|Chains... at 96%
3kgp
RCSB PDB
PDBbind
253aa, >3KGP_1|Chain... at 99%
3khv
RCSB PDB
PDBbind
253aa, >3KHV_1|Chain... at 99%
3kid
RCSB PDB
PDBbind
253aa, >3KID_1|Chain... at 99%
3mhw
RCSB PDB
PDBbind
247aa, >3MHW_1|Chain... at 99%
4h42
RCSB PDB
PDBbind
248aa, >4H42_1|Chain... at 99%
4mnv
RCSB PDB
PDBbind
245aa, >4MNV_1|Chain... at 99%
4x1n
RCSB PDB
PDBbind
247aa, >4X1N_2|Chain... at 98%
4x1p
RCSB PDB
PDBbind
247aa, >4X1P_1|Chain... at 98%
4x1q
RCSB PDB
PDBbind
247aa, >4X1Q_2|Chain... at 98%
4x1s
RCSB PDB
PDBbind
247aa, >4X1S_2|Chain... at 98%
4zhl
RCSB PDB
PDBbind
247aa, >4ZHL_1|Chain... at 98%
4zhm
RCSB PDB
PDBbind
247aa, >4ZHM_2|Chain... at 98%
5wxp
RCSB PDB
PDBbind
253aa, >5WXP_1|Chain... at 99%
5xg4
RCSB PDB
PDBbind
246aa, >5XG4_1|Chain... at 99%
5z1c
RCSB PDB
PDBbind
245aa, >5Z1C_1|Chain... at 99%
5za7
RCSB PDB
PDBbind
253aa, >5ZA7_1|Chain... at 99%
5za8
RCSB PDB
PDBbind
253aa, >5ZA8_1|Chain... at 99%
5za9
RCSB PDB
PDBbind
253aa, >5ZA9_1|Chain... at 99%
5zae
RCSB PDB
PDBbind
253aa, >5ZAE_1|Chain... at 99%
5zaf
RCSB PDB
PDBbind
253aa, >5ZAF_1|Chain... at 99%
5zag
RCSB PDB
PDBbind
253aa, >5ZAG_1|Chain... at 99%
5zah
RCSB PDB
PDBbind
253aa, >5ZAH_1|Chain... at 99%
5zaj
RCSB PDB
PDBbind
253aa, >5ZAJ_1|Chain... at 99%
5zc5
RCSB PDB
PDBbind
253aa, >5ZC5_1|Chain... at 99%
6nmb
RCSB PDB
PDBbind
281aa, >6NMB_1|Chains... *
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
1aqc
RCSB PDB
PDBbind
10-mer
1awi
RCSB PDB
PDBbind
10-mer
1aze
RCSB PDB
PDBbind
10-mer
1bjr
RCSB PDB
PDBbind
10-mer
1cka
RCSB PDB
PDBbind
10-mer
1ckb
RCSB PDB
PDBbind
10-mer
1eb1
RCSB PDB
PDBbind
10-mer
1gbq
RCSB PDB
PDBbind
10-mer
1gvu
RCSB PDB
PDBbind
10-mer
1him
RCSB PDB
PDBbind
10-mer
1jd5
RCSB PDB
PDBbind
10-mer
1jd6
RCSB PDB
PDBbind
10-mer
1jmq
RCSB PDB
PDBbind
10-mer
1pyw
RCSB PDB
PDBbind
10-mer
1vj6
RCSB PDB
PDBbind
10-mer
1vr1
RCSB PDB
PDBbind
10-mer
1y2a
RCSB PDB
PDBbind
10-mer
1ywi
RCSB PDB
PDBbind
10-mer
1yy6
RCSB PDB
PDBbind
10-mer
1zkk
RCSB PDB
PDBbind
10-mer
2a0t
RCSB PDB
PDBbind
10-mer
2aoh
RCSB PDB
PDBbind
10-mer
2aoj
RCSB PDB
PDBbind
10-mer
2axi
RCSB PDB
PDBbind
10-mer
2azm
RCSB PDB
PDBbind
10-mer
2b7f
RCSB PDB
PDBbind
10-mer
2c2l
RCSB PDB
PDBbind
10-mer
2gfa
RCSB PDB
PDBbind
10-mer
2h13
RCSB PDB
PDBbind
10-mer
2hrp
RCSB PDB
PDBbind
10-mer
2ig0
RCSB PDB
PDBbind
10-mer
2jmj
RCSB PDB
PDBbind
10-mer
2jqi
RCSB PDB
PDBbind
10-mer
2jql
RCSB PDB
PDBbind
10-mer
2k2r
RCSB PDB
PDBbind
10-mer
2ke1
RCSB PDB
PDBbind
10-mer
2mnz
RCSB PDB
PDBbind
10-mer
2nxd
RCSB PDB
PDBbind
10-mer
2nxl
RCSB PDB
PDBbind
10-mer
2nxm
RCSB PDB
PDBbind
10-mer
2o9v
RCSB PDB
PDBbind
10-mer
2peh
RCSB PDB
PDBbind
10-mer
2pr9
RCSB PDB
PDBbind
10-mer
2puy
RCSB PDB
PDBbind
10-mer
2qqs
RCSB PDB
PDBbind
10-mer
2r3y
RCSB PDB
PDBbind
10-mer
2r7g
RCSB PDB
PDBbind
10-mer
2rr4
RCSB PDB
PDBbind
10-mer
2v7d
RCSB PDB
PDBbind
10-mer
2vnf
RCSB PDB
PDBbind
10-mer
2w6t
RCSB PDB
PDBbind
10-mer
2w77
RCSB PDB
PDBbind
10-mer
2wa8
RCSB PDB
PDBbind
10-mer
2wp1
RCSB PDB
PDBbind
10-mer
2z5o
RCSB PDB
PDBbind
10-mer
3al3
RCSB PDB
PDBbind
10-mer
3bh8
RCSB PDB
PDBbind
10-mer
3bh9
RCSB PDB
PDBbind
10-mer
3bhb
RCSB PDB
PDBbind
10-mer
3c94
RCSB PDB
PDBbind
10-mer
3d1e
RCSB PDB
PDBbind
10-mer
3diw
RCSB PDB
PDBbind
10-mer
3dnj
RCSB PDB
PDBbind
10-mer
3dpc
RCSB PDB
PDBbind
10-mer
3dvp
RCSB PDB
PDBbind
10-mer
3ebb
RCSB PDB
PDBbind
10-mer
3er5
RCSB PDB
PDBbind
10-mer
3f9w
RCSB PDB
PDBbind
10-mer
3f9y
RCSB PDB
PDBbind
10-mer
3fe7
RCSB PDB
PDBbind
10-mer
3fea
RCSB PDB
PDBbind
10-mer
3gbq
RCSB PDB
PDBbind
10-mer
3gds
RCSB PDB
PDBbind
10-mer
3hg1
RCSB PDB
PDBbind
10-mer
3iqj
RCSB PDB
PDBbind
10-mer
3ivv
RCSB PDB
PDBbind
10-mer
3nkx
RCSB PDB
PDBbind
10-mer
3oq5
RCSB PDB
PDBbind
10-mer
3puj
RCSB PDB
PDBbind
10-mer
3puk
RCSB PDB
PDBbind
10-mer
3pxe
RCSB PDB
PDBbind
10-mer
3q8d
RCSB PDB
PDBbind
10-mer
3qzt
RCSB PDB
PDBbind
10-mer
3rwi
RCSB PDB
PDBbind
10-mer
3shv
RCSB PDB
PDBbind
10-mer
3szm
RCSB PDB
PDBbind
10-mer
3tkz
RCSB PDB
PDBbind
10-mer
3tl0
RCSB PDB
PDBbind
10-mer
3uii
RCSB PDB
PDBbind
10-mer
3uik
RCSB PDB
PDBbind
10-mer
3uvm
RCSB PDB
PDBbind
10-mer
3zmp
RCSB PDB
PDBbind
10-mer
3zmq
RCSB PDB
PDBbind
10-mer
4bg6
RCSB PDB
PDBbind
10-mer
4e34
RCSB PDB
PDBbind
10-mer
4e35
RCSB PDB
PDBbind
10-mer
4e3b
RCSB PDB
PDBbind
10-mer
4e81
RCSB PDB
PDBbind
10-mer
4e9d
RCSB PDB
PDBbind
10-mer
4er4
RCSB PDB
PDBbind
10-mer
4h39
RCSB PDB
PDBbind
10-mer
4h3b
RCSB PDB
PDBbind
10-mer
4hcz
RCSB PDB
PDBbind
10-mer
4i2w
RCSB PDB
PDBbind
10-mer
4i2z
RCSB PDB
PDBbind
10-mer
4jfd
RCSB PDB
PDBbind
10-mer
4jfe
RCSB PDB
PDBbind
10-mer
4jff
RCSB PDB
PDBbind
10-mer
4jjq
RCSB PDB
PDBbind
10-mer
4joe
RCSB PDB
PDBbind
10-mer
4jof
RCSB PDB
PDBbind
10-mer
4jog
RCSB PDB
PDBbind
10-mer
4joh
RCSB PDB
PDBbind
10-mer
4joj
RCSB PDB
PDBbind
10-mer
4jok
RCSB PDB
PDBbind
10-mer
4k6y
RCSB PDB
PDBbind
10-mer
4k72
RCSB PDB
PDBbind
10-mer
4k75
RCSB PDB
PDBbind
10-mer
4k76
RCSB PDB
PDBbind
10-mer
4k78
RCSB PDB
PDBbind
10-mer
4lnp
RCSB PDB
PDBbind
10-mer
4mdr
RCSB PDB
PDBbind
10-mer
4n84
RCSB PDB
PDBbind
10-mer
4nmo
RCSB PDB
PDBbind
10-mer
4nmp
RCSB PDB
PDBbind
10-mer
4nmq
RCSB PDB
PDBbind
10-mer
4nmr
RCSB PDB
PDBbind
10-mer
4nms
RCSB PDB
PDBbind
10-mer
4nmt
RCSB PDB
PDBbind
10-mer
4nmv
RCSB PDB
PDBbind
10-mer
4o2c
RCSB PDB
PDBbind
10-mer
4oz1
RCSB PDB
PDBbind
10-mer
4p0a
RCSB PDB
PDBbind
10-mer
4p0b
RCSB PDB
PDBbind
10-mer
4qok
RCSB PDB
PDBbind
10-mer
4rqz
RCSB PDB
PDBbind
10-mer
4u90
RCSB PDB
PDBbind
10-mer
4v11
RCSB PDB
PDBbind
10-mer
4wj5
RCSB PDB
PDBbind
10-mer
4x1n
RCSB PDB
PDBbind
10-mer
4x1p
RCSB PDB
PDBbind
10-mer
4x1q
RCSB PDB
PDBbind
10-mer
4x1s
RCSB PDB
PDBbind
10-mer
4x34
RCSB PDB
PDBbind
10-mer
4x3s
RCSB PDB
PDBbind
10-mer
4x8n
RCSB PDB
PDBbind
10-mer
4xhv
RCSB PDB
PDBbind
10-mer
4z0u
RCSB PDB
PDBbind
10-mer
4z7i
RCSB PDB
PDBbind
10-mer
4zhl
RCSB PDB
PDBbind
10-mer
4zhm
RCSB PDB
PDBbind
10-mer
5ab0
RCSB PDB
PDBbind
10-mer
5aei
RCSB PDB
PDBbind
10-mer
5azg
RCSB PDB
PDBbind
10-mer
5c0m
RCSB PDB
PDBbind
10-mer
5c11
RCSB PDB
PDBbind
10-mer
5c13
RCSB PDB
PDBbind
10-mer
5d6y
RCSB PDB
PDBbind
10-mer
5gp7
RCSB PDB
PDBbind
10-mer
5gs4
RCSB PDB
PDBbind
10-mer
5gtr
RCSB PDB
PDBbind
10-mer
5iaw
RCSB PDB
PDBbind
10-mer
5j31
RCSB PDB
PDBbind
10-mer
5jzi
RCSB PDB
PDBbind
10-mer
5myo
RCSB PDB
PDBbind
10-mer
5n1y
RCSB PDB
PDBbind
10-mer
5nx2
RCSB PDB
PDBbind
10-mer
5t6z
RCSB PDB
PDBbind
10-mer
5t70
RCSB PDB
PDBbind
10-mer
5t8r
RCSB PDB
PDBbind
10-mer
5vnb
RCSB PDB
PDBbind
10-mer
5w7i
RCSB PDB
PDBbind
10-mer
5w7j
RCSB PDB
PDBbind
10-mer
5wkf
RCSB PDB
PDBbind
10-mer
5wkh
RCSB PDB
PDBbind
10-mer
6ar2
RCSB PDB
PDBbind
10-mer
6buu
RCSB PDB
PDBbind
10-mer
6fkp
RCSB PDB
PDBbind
10-mer
6mim
RCSB PDB
PDBbind
10-mer
6qtx
RCSB PDB
PDBbind
10-mer
6pek
RCSB PDB
PDBbind
10-mer
6iiw
RCSB PDB
PDBbind
10-mer
6hzx
RCSB PDB
PDBbind
10-mer
6hoi
RCSB PDB
PDBbind
10-mer
6dkp
RCSB PDB
PDBbind
10-mer
6a8n
RCSB PDB
PDBbind
10-mer
5zys
RCSB PDB
PDBbind
10-mer
Entry Information
PDB ID
4x1r
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
murinised human uPA
Ligand Name
10-mer
EC.Number
E.C.3.4.21.73
Resolution
2.1(Å)
Affinity (Kd/Ki/IC50)
Kd=0.4uM
Release Year
2015
Protein/NA Sequence
Check fasta file
Primary Reference
(2014) Plos One Vol. 9: pp.1-27
Ligand Properties
Formula
C
4
8
H
6
7
N
1
0
O
1
6
S
2
Molecular Weight
1104.230
Exact Mass
1103.420
No. of atoms
143
No. of bonds
146
Polar Surface Area
466.64
LOGP Value
-0.50 (
Computed with XLOGP3
)
-1.04 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 12
No. of Hydrogen Bond Acceptors: 16
No. of Rotatable Bonds: 11
No. of Nitrogen and Oxygen Atoms: 26
No. of Rings: 4
Canonical SMILES
OC[C@@H]1NC(=O)[C@H](Cc2ccc(cc2)O)NC(=O)[C@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@@H]([NH3+])CSSC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)C)Cc1ccc(cc1)O)CC(C)C)CC(=O)O)C(=O)O
InChI String
InChI=1S/C48H66N10O16S2/c1-23(2)16-31-41(66)55-34(19-38(62)63)44(69)57-36(48(73)74)22-76-75-21-30(49)47(72)58-15-5-6-37(58)46(71)51-25(4)40(65)53-33(18-27-9-13-29(61)14-10-27)43(68)56-35(20-59)45(70)50-24(3)39(64)52-32(42(67)54-31)17-26-7-11-28(60)12-8-26/h7-14,23-25,30-37,59-61H,5-6,15-22,49H2,1-4H3,(H,50,70)(H,51,71)(H,52,64)(H,53,65)(H,54,67)(H,55,66)(H,56,68)(H,57,69)(H,62,63)(H,73,74)/p+1/t24-,25-,30-,31-,32-,33-,34-,35-,36-,37-/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P00749
Entrez Gene ID
NCBI Entrez Gene ID:
5328
ASD
Information of known allosteric effects of PDB entries
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