Browse entries in the PDBbind-CN Database
HEADER 4TUH_COMPLEX COMPND 4TUH_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 144 PRO LEU GLY SER MET SER GLN SER ASN ARG GLU LEU VAL SEQRES 2 A 144 VAL ASP PHE LEU SER TYR LYS LEU SER GLN LYS GLY TYR SEQRES 3 A 144 SER TRP SER GLN MET ALA ALA VAL LYS GLN ALA LEU ARG SEQRES 4 A 144 GLU ALA GLY ASP GLU PHE GLU LEU ARG TYR ARG ARG ALA SEQRES 5 A 144 PHE SER ASP LEU THR SER GLN LEU HIS ILE THR PRO GLY SEQRES 6 A 144 THR ALA TYR GLN SER PHE GLU GLN VAL VAL ASN GLU LEU SEQRES 7 A 144 PHE ARG ASP GLY VAL ASN TRP GLY ARG ILE VAL ALA PHE SEQRES 8 A 144 PHE SER PHE GLY GLY ALA LEU CYS VAL GLU SER VAL ASP SEQRES 9 A 144 LYS GLU MET GLN VAL LEU VAL SER ARG ILE ALA ALA TRP SEQRES 10 A 144 MET ALA THR TYR LEU ASN ASP HIS LEU GLU PRO TRP ILE SEQRES 11 A 144 GLN GLU ASN GLY GLY TRP ASP THR PHE VAL GLU LEU TYR SEQRES 12 A 144 GLY SEQRES 1 B 145 GLY PRO LEU GLY SER MET SER GLN SER ASN ARG GLU LEU SEQRES 2 B 145 VAL VAL ASP PHE LEU SER TYR LYS LEU SER GLN LYS GLY SEQRES 3 B 145 TYR SER TRP SER GLN MET ALA ALA VAL LYS GLN ALA LEU SEQRES 4 B 145 ARG GLU ALA GLY ASP GLU PHE GLU LEU ARG TYR ARG ARG SEQRES 5 B 145 ALA PHE SER ASP LEU THR SER GLN LEU HIS ILE THR PRO SEQRES 6 B 145 GLY THR ALA TYR GLN SER PHE GLU GLN VAL VAL ASN GLU SEQRES 7 B 145 LEU PHE ARG ASP GLY VAL ASN TRP GLY ARG ILE VAL ALA SEQRES 8 B 145 PHE PHE SER PHE GLY GLY ALA LEU CYS VAL GLU SER VAL SEQRES 9 B 145 ASP LYS GLU MET GLN VAL LEU VAL SER ARG ILE ALA ALA SEQRES 10 B 145 TRP MET ALA THR TYR LEU ASN ASP HIS LEU GLU PRO TRP SEQRES 11 B 145 ILE GLN GLU ASN GLY GLY TRP ASP THR PHE VAL GLU LEU SEQRES 12 B 145 TYR GLY HET UNN A 540 76 ATOM 1 N PRO A -3 -31.209 -12.455 38.182 1.00 86.69 N ATOM 2 CA PRO A -3 -30.914 -12.269 36.755 1.00 81.73 C ATOM 3 C PRO A -3 -29.951 -13.332 36.226 1.00 67.71 C ATOM 4 O PRO A -3 -29.011 -13.714 36.926 1.00 60.42 O ATOM 5 CB PRO A -3 -30.276 -10.874 36.700 1.00 82.79 C ATOM 6 CG PRO A -3 -30.663 -10.209 37.980 1.00 86.18 C ATOM 7 CD PRO A -3 -30.802 -11.297 38.993 1.00 86.91 C ATOM 8 HN2 PRO A -3 -30.701 -13.296 38.522 1.00 0.00 H ATOM 9 HN1 PRO A -3 -32.233 -12.600 38.296 1.00 0.00 H ATOM 10 N LEU A -2 -30.178 -13.781 34.993 1.00 60.06 N ATOM 11 CA LEU A -2 -29.360 -14.826 34.380 1.00 50.15 C ATOM 12 C LEU A -2 -27.864 -14.501 34.288 1.00 45.58 C ATOM 13 O LEU A -2 -27.029 -15.397 34.421 1.00 44.24 O ATOM 14 CB LEU A -2 -29.903 -15.148 32.987 1.00 47.34 C ATOM 15 CG LEU A -2 -31.219 -15.935 32.956 1.00 51.32 C ATOM 16 CD1 LEU A -2 -31.737 -16.062 31.541 1.00 50.62 C ATOM 17 CD2 LEU A -2 -31.001 -17.323 33.552 1.00 49.44 C ATOM 18 H LEU A -2 -30.964 -13.374 34.447 1.00 0.00 H ATOM 19 N GLY A -1 -27.499 -13.241 34.070 1.00 43.57 N ATOM 20 CA GLY A -1 -26.083 -12.961 33.948 1.00 40.93 C ATOM 21 C GLY A -1 -25.412 -12.391 35.184 1.00 46.62 C ATOM 22 O GLY A -1 -24.342 -11.796 35.096 1.00 40.33 O ATOM 23 H GLY A -1 -28.206 -12.483 33.990 1.00 0.00 H ATOM 24 N SER A 0 -25.964 -12.676 36.354 1.00 45.44 N ATOM 25 CA SER A 0 -25.464 -12.049 37.571 1.00 49.18 C ATOM 26 C SER A 0 -24.184 -12.743 38.054 1.00 44.37 C ATOM 27 O SER A 0 -23.255 -12.098 38.558 1.00 41.39 O ATOM 28 CB SER A 0 -26.543 -12.079 38.656 1.00 57.56 C ATOM 29 OG SER A 0 -26.104 -11.437 39.841 1.00 66.33 O ATOM 30 HG SER A 0 -26.823 -11.474 40.521 1.00 0.00 H ATOM 31 H SER A 0 -26.756 -13.348 36.404 1.00 0.00 H ATOM 32 N MET A 1 -24.103 -14.049 37.824 1.00 45.32 N ATOM 33 CA MET A 1 -22.931 -14.820 38.225 1.00 46.40 C ATOM 34 C MET A 1 -21.740 -14.505 37.317 1.00 44.17 C ATOM 35 O MET A 1 -20.599 -14.451 37.785 1.00 42.87 O ATOM 36 CB MET A 1 -23.257 -16.320 38.203 1.00 50.16 C ATOM 37 CG MET A 1 -22.217 -17.204 38.865 1.00 55.95 C ATOM 38 SD MET A 1 -22.689 -18.951 38.887 1.00105.16 S ATOM 39 CE MET A 1 -24.217 -18.895 39.831 1.00 93.29 C ATOM 40 H MET A 1 -24.892 -14.532 37.348 1.00 0.00 H ATOM 41 N SER A 2 -21.998 -14.319 36.023 1.00 42.39 N ATOM 42 CA SER A 2 -20.941 -13.909 35.106 1.00 36.98 C ATOM 43 C SER A 2 -20.287 -12.622 35.590 1.00 35.29 C ATOM 44 O SER A 2 -19.063 -12.507 35.614 1.00 39.69 O ATOM 45 CB SER A 2 -21.490 -13.719 33.682 1.00 34.14 C ATOM 46 OG SER A 2 -22.047 -14.931 33.229 1.00 42.17 O ATOM 47 HG SER A 2 -22.400 -14.808 32.312 1.00 0.00 H ATOM 48 H SER A 2 -22.963 -14.468 35.664 1.00 0.00 H ATOM 49 N GLN A 3 -21.111 -11.659 35.987 1.00 36.20 N ATOM 50 CA GLN A 3 -20.594 -10.370 36.402 1.00 42.01 C ATOM 51 C GLN A 3 -19.807 -10.447 37.708 1.00 39.78 C ATOM 52 O GLN A 3 -18.743 -9.838 37.812 1.00 39.13 O ATOM 53 CB GLN A 3 -21.738 -9.361 36.552 1.00 46.01 C ATOM 54 CG GLN A 3 -21.283 -7.984 36.998 1.00 63.97 C ATOM 55 CD GLN A 3 -22.451 -7.058 37.289 1.00 85.88 C ATOM 56 OE1 GLN A 3 -23.560 -7.258 36.787 1.00 92.89 O ATOM 57 NE2 GLN A 3 -22.208 -6.037 38.105 1.00 90.97 N ATOM 58 HE22 GLN A 3 -21.257 -5.907 38.506 1.00 0.00 H ATOM 59 HE21 GLN A 3 -22.969 -5.369 38.343 1.00 0.00 H ATOM 60 H GLN A 3 -22.137 -11.831 36.000 1.00 0.00 H ATOM 61 N SER A 4 -20.261 -11.253 38.664 1.00 44.87 N ATOM 62 CA SER A 4 -19.597 -11.245 39.966 1.00 38.30 C ATOM 63 C SER A 4 -18.359 -12.130 39.998 1.00 35.03 C ATOM 64 O SER A 4 -17.367 -11.786 40.652 1.00 35.98 O ATOM 65 CB SER A 4 -20.576 -11.695 41.052 1.00 40.26 C ATOM 66 OG SER A 4 -21.054 -13.003 40.779 1.00 40.76 O ATOM 67 HG SER A 4 -21.518 -13.008 39.905 1.00 0.00 H ATOM 68 H SER A 4 -21.074 -11.878 38.488 1.00 0.00 H ATOM 69 N ASN A 5 -18.367 -13.214 39.234 1.00 36.59 N ATOM 70 CA ASN A 5 -17.175 -14.056 39.150 1.00 39.70 C ATOM 71 C ASN A 5 -16.068 -13.338 38.401 1.00 39.09 C ATOM 72 O ASN A 5 -14.909 -13.381 38.797 1.00 35.90 O ATOM 73 CB ASN A 5 -17.501 -15.382 38.456 1.00 44.50 C ATOM 74 CG ASN A 5 -18.022 -16.432 39.420 1.00 49.92 C ATOM 75 OD1 ASN A 5 -17.845 -16.319 40.632 1.00 52.30 O ATOM 76 ND2 ASN A 5 -18.661 -17.466 38.882 1.00 54.95 N ATOM 77 HD22 ASN A 5 -18.788 -17.520 37.851 1.00 0.00 H ATOM 78 HD21 ASN A 5 -19.034 -18.221 39.492 1.00 0.00 H ATOM 79 H ASN A 5 -19.220 -13.465 38.695 1.00 0.00 H ATOM 80 N ARG A 6 -16.447 -12.628 37.342 1.00 35.83 N ATOM 81 CA ARG A 6 -15.493 -11.836 36.581 1.00 37.57 C ATOM 82 C ARG A 6 -14.873 -10.792 37.506 1.00 33.64 C ATOM 83 O ARG A 6 -13.656 -10.620 37.553 1.00 33.44 O ATOM 84 CB ARG A 6 -16.188 -11.153 35.391 1.00 37.84 C ATOM 85 CG ARG A 6 -15.305 -10.221 34.567 1.00 39.75 C ATOM 86 CD ARG A 6 -14.150 -10.943 33.881 1.00 38.61 C ATOM 87 NE ARG A 6 -13.426 -10.033 32.995 1.00 40.31 N ATOM 88 CZ ARG A 6 -12.361 -10.367 32.272 1.00 37.01 C ATOM 89 NH1 ARG A 6 -11.875 -11.605 32.312 1.00 36.73 N ATOM 90 NH2 ARG A 6 -11.787 -9.455 31.499 1.00 33.62 N ATOM 91 HE ARG A 6 -13.769 -9.054 32.925 1.00 0.00 H ATOM 92 HH12 ARG A 6 -11.042 -11.855 31.742 1.00 0.00 H ATOM 93 HH11 ARG A 6 -12.329 -12.323 32.913 1.00 0.00 H ATOM 94 HH22 ARG A 6 -10.954 -9.706 30.930 1.00 0.00 H ATOM 95 HH21 ARG A 6 -12.170 -8.489 31.462 1.00 0.00 H ATOM 96 H ARG A 6 -17.446 -12.639 37.052 1.00 0.00 H ATOM 97 N GLU A 7 -15.736 -10.117 38.257 1.00 33.60 N ATOM 98 CA GLU A 7 -15.306 -9.086 39.180 1.00 35.20 C ATOM 99 C GLU A 7 -14.305 -9.620 40.197 1.00 34.57 C ATOM 100 O GLU A 7 -13.265 -9.018 40.442 1.00 33.53 O ATOM 101 CB GLU A 7 -16.526 -8.536 39.911 1.00 42.95 C ATOM 102 CG GLU A 7 -16.248 -7.338 40.749 1.00 45.11 C ATOM 103 CD GLU A 7 -17.492 -6.819 41.427 1.00 46.96 C ATOM 104 OE1 GLU A 7 -18.607 -7.102 40.942 1.00 52.97 O ATOM 105 OE2 GLU A 7 -17.350 -6.191 42.494 1.00 44.52 O ATOM 106 H GLU A 7 -16.750 -10.335 38.180 1.00 0.00 H ATOM 107 N LEU A 8 -14.617 -10.783 40.746 1.00 30.90 N ATOM 108 CA LEU A 8 -13.777 -11.423 41.757 1.00 28.61 C ATOM 109 C LEU A 8 -12.404 -11.837 41.229 1.00 31.95 C ATOM 110 O LEU A 8 -11.360 -11.528 41.831 1.00 31.97 O ATOM 111 CB LEU A 8 -14.486 -12.656 42.306 1.00 31.65 C ATOM 112 CG LEU A 8 -13.880 -13.316 43.549 1.00 28.30 C ATOM 113 CD1 LEU A 8 -13.627 -12.315 44.677 1.00 31.93 C ATOM 114 CD2 LEU A 8 -14.762 -14.453 44.023 1.00 37.92 C ATOM 115 H LEU A 8 -15.492 -11.259 40.447 1.00 0.00 H ATOM 116 N VAL A 9 -12.417 -12.534 40.101 1.00 28.65 N ATOM 117 CA VAL A 9 -11.194 -13.014 39.471 1.00 32.29 C ATOM 118 C VAL A 9 -10.300 -11.849 39.094 1.00 34.53 C ATOM 119 O VAL A 9 -9.125 -11.818 39.442 1.00 31.59 O ATOM 120 CB VAL A 9 -11.518 -13.870 38.240 1.00 31.85 C ATOM 121 CG1 VAL A 9 -10.263 -14.145 37.405 1.00 30.10 C ATOM 122 CG2 VAL A 9 -12.160 -15.164 38.697 1.00 29.95 C ATOM 123 H VAL A 9 -13.331 -12.745 39.651 1.00 0.00 H ATOM 124 N VAL A 10 -10.877 -10.861 38.418 1.00 29.43 N ATOM 125 CA VAL A 10 -10.094 -9.728 37.958 1.00 30.25 C ATOM 126 C VAL A 10 -9.529 -8.964 39.152 1.00 28.39 C ATOM 127 O VAL A 10 -8.394 -8.484 39.113 1.00 31.69 O ATOM 128 CB VAL A 10 -10.939 -8.790 37.070 1.00 30.06 C ATOM 129 CG1 VAL A 10 -10.177 -7.520 36.760 1.00 31.88 C ATOM 130 CG2 VAL A 10 -11.334 -9.504 35.769 1.00 31.22 C ATOM 131 H VAL A 10 -11.897 -10.900 38.217 1.00 0.00 H ATOM 132 N ASP A 11 -10.321 -8.830 40.212 1.00 28.05 N ATOM 133 CA ASP A 11 -9.829 -8.119 41.387 1.00 28.42 C ATOM 134 C ASP A 11 -8.637 -8.851 41.995 1.00 26.66 C ATOM 135 O ASP A 11 -7.630 -8.228 42.361 1.00 32.07 O ATOM 136 CB ASP A 11 -10.910 -7.951 42.453 1.00 30.83 C ATOM 137 CG ASP A 11 -10.365 -7.300 43.721 1.00 35.15 C ATOM 138 OD1 ASP A 11 -10.285 -6.053 43.776 1.00 36.56 O ATOM 139 OD2 ASP A 11 -9.995 -8.046 44.658 1.00 36.79 O ATOM 140 H ASP A 11 -11.282 -9.228 40.203 1.00 0.00 H ATOM 141 N PHE A 12 -8.751 -10.167 42.114 1.00 28.87 N ATOM 142 CA PHE A 12 -7.674 -10.922 42.751 1.00 26.49 C ATOM 143 C PHE A 12 -6.408 -10.887 41.888 1.00 26.29 C ATOM 144 O PHE A 12 -5.307 -10.643 42.389 1.00 27.86 O ATOM 145 CB PHE A 12 -8.087 -12.373 43.016 1.00 28.61 C ATOM 146 CG PHE A 12 -7.082 -13.131 43.845 1.00 25.45 C ATOM 147 CD1 PHE A 12 -6.025 -13.792 43.242 1.00 23.73 C ATOM 148 CD2 PHE A 12 -7.173 -13.138 45.224 1.00 30.08 C ATOM 149 CE1 PHE A 12 -5.078 -14.470 44.012 1.00 25.68 C ATOM 150 CE2 PHE A 12 -6.240 -13.815 45.990 1.00 32.02 C ATOM 151 CZ PHE A 12 -5.194 -14.479 45.377 1.00 29.53 C ATOM 152 H PHE A 12 -9.597 -10.656 41.758 1.00 0.00 H ATOM 153 N LEU A 13 -6.571 -11.147 40.596 1.00 24.65 N ATOM 154 CA LEU A 13 -5.440 -11.140 39.674 1.00 26.06 C ATOM 155 C LEU A 13 -4.813 -9.757 39.554 1.00 26.75 C ATOM 156 O LEU A 13 -3.588 -9.639 39.550 1.00 26.46 O ATOM 157 CB LEU A 13 -5.877 -11.639 38.285 1.00 22.75 C ATOM 158 CG LEU A 13 -6.381 -13.084 38.225 1.00 23.28 C ATOM 159 CD1 LEU A 13 -6.729 -13.426 36.768 1.00 22.02 C ATOM 160 CD2 LEU A 13 -5.361 -14.102 38.801 1.00 22.19 C ATOM 161 H LEU A 13 -7.523 -11.360 40.234 1.00 0.00 H ATOM 162 N SER A 14 -5.639 -8.710 39.476 1.00 26.73 N ATOM 163 CA SER A 14 -5.117 -7.341 39.433 1.00 25.73 C ATOM 164 C SER A 14 -4.287 -7.040 40.682 1.00 30.15 C ATOM 165 O SER A 14 -3.219 -6.423 40.607 1.00 29.48 O ATOM 166 CB SER A 14 -6.253 -6.308 39.312 1.00 26.80 C ATOM 167 OG SER A 14 -6.981 -6.491 38.104 1.00 32.74 O ATOM 168 HG SER A 14 -7.704 -5.817 38.050 1.00 0.00 H ATOM 169 H SER A 14 -6.666 -8.868 39.445 1.00 0.00 H ATOM 170 N TYR A 15 -4.781 -7.486 41.832 1.00 30.30 N ATOM 171 CA TYR A 15 -4.081 -7.290 43.103 1.00 29.92 C ATOM 172 C TYR A 15 -2.731 -8.017 43.090 1.00 33.56 C ATOM 173 O TYR A 15 -1.697 -7.427 43.402 1.00 29.15 O ATOM 174 CB TYR A 15 -4.959 -7.778 44.253 1.00 29.25 C ATOM 175 CG TYR A 15 -4.346 -7.717 45.637 1.00 31.26 C ATOM 176 CD1 TYR A 15 -3.948 -6.506 46.195 1.00 34.51 C ATOM 177 CD2 TYR A 15 -4.176 -8.877 46.386 1.00 33.94 C ATOM 178 CE1 TYR A 15 -3.411 -6.451 47.463 1.00 32.05 C ATOM 179 CE2 TYR A 15 -3.633 -8.833 47.663 1.00 36.91 C ATOM 180 CZ TYR A 15 -3.250 -7.614 48.190 1.00 33.98 C ATOM 181 OH TYR A 15 -2.705 -7.557 49.456 1.00 34.22 O ATOM 182 HH TYR A 15 -1.880 -8.103 49.484 1.00 0.00 H ATOM 183 H TYR A 15 -5.691 -7.989 41.829 1.00 0.00 H ATOM 184 N LYS A 16 -2.728 -9.284 42.693 1.00 29.66 N ATOM 185 CA LYS A 16 -1.480 -10.053 42.662 1.00 30.63 C ATOM 186 C LYS A 16 -0.487 -9.478 41.672 1.00 35.49 C ATOM 187 O LYS A 16 0.714 -9.457 41.945 1.00 33.52 O ATOM 188 CB LYS A 16 -1.744 -11.522 42.322 1.00 31.33 C ATOM 189 CG LYS A 16 -2.437 -12.259 43.414 1.00 41.70 C ATOM 190 CD LYS A 16 -1.564 -12.220 44.612 1.00 37.66 C ATOM 191 CE LYS A 16 -2.323 -12.339 45.904 1.00 45.71 C ATOM 192 NZ LYS A 16 -1.322 -12.163 46.984 1.00 30.48 N ATOM 193 HZ1 LYS A 16 -0.595 -12.903 46.905 1.00 0.00 H ATOM 194 HZ2 LYS A 16 -0.877 -11.227 46.894 1.00 0.00 H ATOM 195 HZ3 LYS A 16 -1.794 -12.236 47.908 1.00 0.00 H ATOM 196 H LYS A 16 -3.619 -9.735 42.401 1.00 0.00 H ATOM 197 N LEU A 17 -0.978 -9.011 40.524 1.00 24.98 N ATOM 198 CA LEU A 17 -0.080 -8.385 39.562 1.00 29.86 C ATOM 199 C LEU A 17 0.549 -7.120 40.150 1.00 30.81 C ATOM 200 O LEU A 17 1.754 -6.881 40.006 1.00 32.98 O ATOM 201 CB LEU A 17 -0.810 -8.059 38.253 1.00 28.16 C ATOM 202 CG LEU A 17 -1.084 -9.269 37.344 1.00 24.86 C ATOM 203 CD1 LEU A 17 -2.104 -8.915 36.242 1.00 24.95 C ATOM 204 CD2 LEU A 17 0.225 -9.788 36.737 1.00 27.89 C ATOM 205 H LEU A 17 -1.994 -9.093 40.317 1.00 0.00 H ATOM 206 N SER A 18 -0.264 -6.318 40.823 1.00 32.02 N ATOM 207 CA SER A 18 0.217 -5.034 41.334 1.00 35.81 C ATOM 208 C SER A 18 1.277 -5.227 42.407 1.00 35.58 C ATOM 209 O SER A 18 2.189 -4.408 42.543 1.00 34.70 O ATOM 210 CB SER A 18 -0.950 -4.192 41.865 1.00 43.52 C ATOM 211 OG SER A 18 -1.436 -4.716 43.087 1.00 50.09 O ATOM 212 HG SER A 18 -1.751 -5.644 42.945 1.00 0.00 H ATOM 213 H SER A 18 -1.250 -6.603 40.989 1.00 0.00 H ATOM 214 N GLN A 19 1.165 -6.315 43.163 1.00 32.43 N ATOM 215 CA GLN A 19 2.126 -6.617 44.216 1.00 35.93 C ATOM 216 C GLN A 19 3.514 -6.861 43.650 1.00 37.67 C ATOM 217 O GLN A 19 4.510 -6.681 44.342 1.00 42.46 O ATOM 218 CB GLN A 19 1.658 -7.821 45.036 1.00 34.26 C ATOM 219 CG GLN A 19 0.556 -7.468 46.014 1.00 35.70 C ATOM 220 CD GLN A 19 0.041 -8.662 46.779 1.00 37.49 C ATOM 221 OE1 GLN A 19 -0.129 -9.753 46.218 1.00 37.08 O ATOM 222 NE2 GLN A 19 -0.191 -8.472 48.080 1.00 32.31 N ATOM 223 HE22 GLN A 19 -0.033 -7.536 48.505 1.00 0.00 H ATOM 224 HE21 GLN A 19 -0.530 -9.260 48.668 1.00 0.00 H ATOM 225 H GLN A 19 0.372 -6.967 42.999 1.00 0.00 H ATOM 226 N LYS A 20 3.582 -7.274 42.392 1.00 29.61 N ATOM 227 CA LYS A 20 4.869 -7.493 41.742 1.00 33.65 C ATOM 228 C LYS A 20 5.229 -6.313 40.844 1.00 36.29 C ATOM 229 O LYS A 20 6.150 -6.394 40.032 1.00 43.13 O ATOM 230 CB LYS A 20 4.854 -8.793 40.932 1.00 31.22 C ATOM 231 CG LYS A 20 4.570 -10.025 41.767 1.00 34.76 C ATOM 232 CD LYS A 20 5.704 -10.259 42.740 1.00 41.15 C ATOM 233 CE LYS A 20 5.493 -11.505 43.567 1.00 48.28 C ATOM 234 NZ LYS A 20 6.662 -11.693 44.469 1.00 56.55 N ATOM 235 HZ1 LYS A 20 7.526 -11.793 43.899 1.00 0.00 H ATOM 236 HZ2 LYS A 20 6.752 -10.867 45.095 1.00 0.00 H ATOM 237 HZ3 LYS A 20 6.522 -12.550 45.041 1.00 0.00 H ATOM 238 H LYS A 20 2.704 -7.444 41.861 1.00 0.00 H ATOM 239 N GLY A 21 4.485 -5.223 40.975 1.00 36.97 N ATOM 240 CA GLY A 21 4.767 -4.038 40.190 1.00 41.09 C ATOM 241 C GLY A 21 4.230 -4.116 38.771 1.00 42.03 C ATOM 242 O GLY A 21 4.635 -3.339 37.910 1.00 43.33 O ATOM 243 H GLY A 21 3.692 -5.219 41.647 1.00 0.00 H ATOM 244 N TYR A 22 3.340 -5.072 38.521 1.00 39.08 N ATOM 245 CA TYR A 22 2.700 -5.234 37.218 1.00 35.70 C ATOM 246 C TYR A 22 1.271 -4.706 37.282 1.00 32.55 C ATOM 247 O TYR A 22 0.793 -4.317 38.343 1.00 33.50 O ATOM 248 CB TYR A 22 2.701 -6.705 36.769 1.00 32.69 C ATOM 249 CG TYR A 22 4.068 -7.338 36.546 1.00 37.35 C ATOM 250 CD1 TYR A 22 5.137 -6.603 36.040 1.00 40.12 C ATOM 251 CD2 TYR A 22 4.265 -8.688 36.796 1.00 34.61 C ATOM 252 CE1 TYR A 22 6.376 -7.196 35.816 1.00 42.85 C ATOM 253 CE2 TYR A 22 5.493 -9.293 36.570 1.00 38.39 C ATOM 254 CZ TYR A 22 6.546 -8.542 36.084 1.00 44.31 C ATOM 255 OH TYR A 22 7.757 -9.151 35.865 1.00 46.60 O ATOM 256 HH TYR A 22 7.645 -9.878 35.202 1.00 0.00 H ATOM 257 H TYR A 22 3.089 -5.732 39.285 1.00 0.00 H ATOM 258 N SER A 23 0.612 -4.627 36.133 1.00 35.58 N ATOM 259 CA SER A 23 -0.761 -4.145 36.052 1.00 32.58 C ATOM 260 C SER A 23 -1.609 -5.043 35.164 1.00 36.03 C ATOM 261 O SER A 23 -1.142 -5.512 34.130 1.00 31.05 O ATOM 262 CB SER A 23 -0.821 -2.696 35.543 1.00 32.24 C ATOM 263 OG SER A 23 -0.265 -1.815 36.504 1.00 47.42 O ATOM 264 HG SER A 23 -0.777 -1.884 37.348 1.00 0.00 H ATOM 265 H SER A 23 1.093 -4.920 35.258 1.00 0.00 H ATOM 266 N TRP A 24 -2.827 -5.326 35.614 1.00 27.55 N ATOM 267 CA TRP A 24 -3.827 -6.007 34.804 1.00 28.91 C ATOM 268 C TRP A 24 -4.043 -5.290 33.477 1.00 33.39 C ATOM 269 O TRP A 24 -4.136 -5.921 32.414 1.00 31.96 O ATOM 270 CB TRP A 24 -5.143 -6.082 35.590 1.00 30.31 C ATOM 271 CG TRP A 24 -6.349 -6.487 34.790 1.00 32.37 C ATOM 272 CD1 TRP A 24 -7.250 -5.651 34.183 1.00 30.03 C ATOM 273 CD2 TRP A 24 -6.795 -7.818 34.527 1.00 29.98 C ATOM 274 NE1 TRP A 24 -8.231 -6.393 33.549 1.00 35.54 N ATOM 275 CE2 TRP A 24 -7.972 -7.723 33.748 1.00 33.99 C ATOM 276 CE3 TRP A 24 -6.316 -9.090 34.875 1.00 30.66 C ATOM 277 CZ2 TRP A 24 -8.668 -8.854 33.307 1.00 29.10 C ATOM 278 CZ3 TRP A 24 -7.004 -10.199 34.435 1.00 34.34 C ATOM 279 CH2 TRP A 24 -8.168 -10.078 33.659 1.00 38.86 C ATOM 280 HE1 TRP A 24 -9.032 -6.005 33.011 1.00 0.00 H ATOM 281 H TRP A 24 -3.076 -5.050 36.585 1.00 0.00 H ATOM 282 N SER A 25 -4.194 -3.975 33.557 1.00 27.36 N ATOM 283 CA SER A 25 -4.401 -3.143 32.375 1.00 32.72 C ATOM 284 C SER A 25 -3.807 -1.756 32.607 1.00 29.56 C ATOM 285 O SER A 25 -3.478 -1.410 33.739 1.00 27.43 O ATOM 286 CB SER A 25 -5.873 -3.015 32.061 1.00 28.90 C ATOM 287 OG SER A 25 -6.520 -2.238 33.048 1.00 27.20 O ATOM 288 HG SER A 25 -7.483 -2.163 32.829 1.00 0.00 H ATOM 289 H SER A 25 -4.164 -3.521 34.492 1.00 0.00 H ATOM 290 N GLN A 26 -3.713 -0.932 31.571 1.00 26.47 N ATOM 291 CA GLN A 26 -3.236 0.414 31.830 1.00 26.42 C ATOM 292 C GLN A 26 -4.271 1.168 32.682 1.00 29.99 C ATOM 293 O GLN A 26 -3.896 1.984 33.522 1.00 27.33 O ATOM 294 CB GLN A 26 -2.919 1.153 30.527 1.00 34.90 C ATOM 295 CG GLN A 26 -2.443 2.588 30.752 1.00 46.21 C ATOM 296 CD GLN A 26 -1.202 2.670 31.653 1.00 61.83 C ATOM 297 OE1 GLN A 26 -0.273 1.866 31.532 1.00 64.88 O ATOM 298 NE2 GLN A 26 -1.167 3.679 32.525 1.00 54.06 N ATOM 299 HE22 GLN A 26 -1.972 4.334 32.595 1.00 0.00 H ATOM 300 HE21 GLN A 26 -0.335 3.811 33.135 1.00 0.00 H ATOM 301 H GLN A 26 -3.971 -1.239 30.611 1.00 0.00 H ATOM 302 N MET A 83 -5.564 0.866 32.521 1.00 28.11 N ATOM 303 CA MET A 83 -6.555 1.522 33.370 1.00 27.78 C ATOM 304 C MET A 83 -6.449 1.032 34.822 1.00 27.09 C ATOM 305 O MET A 83 -6.690 1.799 35.754 1.00 22.94 O ATOM 306 CB MET A 83 -7.983 1.294 32.848 1.00 26.80 C ATOM 307 CG MET A 83 -8.415 2.214 31.683 1.00 27.65 C ATOM 308 SD MET A 83 -8.451 3.942 32.272 1.00 33.89 S ATOM 309 CE MET A 83 -9.681 3.820 33.569 1.00 37.43 C ATOM 310 H MET A 83 -5.859 0.175 31.802 1.00 0.00 H ATOM 311 N ALA A 84 -6.034 -0.217 35.014 1.00 22.14 N ATOM 312 CA ALA A 84 -5.861 -0.749 36.363 1.00 25.25 C ATOM 313 C ALA A 84 -4.722 0.016 37.040 1.00 23.89 C ATOM 314 O ALA A 84 -4.768 0.306 38.235 1.00 26.21 O ATOM 315 CB ALA A 84 -5.578 -2.248 36.336 1.00 25.37 C ATOM 316 H ALA A 84 -5.830 -0.822 34.193 1.00 0.00 H ATOM 317 N ALA A 85 -3.694 0.332 36.254 1.00 22.43 N ATOM 318 CA ALA A 85 -2.546 1.091 36.746 1.00 29.06 C ATOM 319 C ALA A 85 -2.953 2.506 37.168 1.00 24.98 C ATOM 320 O ALA A 85 -2.480 3.014 38.179 1.00 22.62 O ATOM 321 CB ALA A 85 -1.464 1.143 35.692 1.00 29.45 C ATOM 322 H ALA A 85 -3.709 0.029 35.259 1.00 0.00 H ATOM 323 N VAL A 86 -3.816 3.156 36.385 1.00 19.61 N ATOM 324 CA VAL A 86 -4.283 4.481 36.772 1.00 19.76 C ATOM 325 C VAL A 86 -5.128 4.422 38.046 1.00 19.30 C ATOM 326 O VAL A 86 -4.952 5.233 38.956 1.00 21.39 O ATOM 327 CB VAL A 86 -5.111 5.130 35.654 1.00 18.67 C ATOM 328 CG1 VAL A 86 -5.542 6.555 36.078 1.00 19.86 C ATOM 329 CG2 VAL A 86 -4.292 5.180 34.386 1.00 20.01 C ATOM 330 H VAL A 86 -4.153 2.719 35.503 1.00 0.00 H ATOM 331 N LYS A 87 -6.062 3.470 38.084 1.00 20.22 N ATOM 332 CA LYS A 87 -6.918 3.278 39.247 1.00 22.37 C ATOM 333 C LYS A 87 -6.071 3.089 40.485 1.00 25.21 C ATOM 334 O LYS A 87 -6.326 3.714 41.515 1.00 22.47 O ATOM 335 CB LYS A 87 -7.837 2.072 39.061 1.00 20.96 C ATOM 336 CG LYS A 87 -8.943 2.296 38.026 1.00 20.68 C ATOM 337 CD LYS A 87 -9.746 1.013 37.782 1.00 21.42 C ATOM 338 CE LYS A 87 -10.855 1.211 36.766 1.00 30.12 C ATOM 339 NZ LYS A 87 -11.551 -0.103 36.503 1.00 32.72 N ATOM 340 HZ1 LYS A 87 -10.864 -0.790 36.132 1.00 0.00 H ATOM 341 HZ2 LYS A 87 -11.958 -0.462 37.390 1.00 0.00 H ATOM 342 HZ3 LYS A 87 -12.309 0.041 35.806 1.00 0.00 H ATOM 343 H LYS A 87 -6.182 2.847 37.260 1.00 0.00 H ATOM 344 N GLN A 88 -5.055 2.238 40.382 1.00 21.79 N ATOM 345 CA GLN A 88 -4.219 1.956 41.553 1.00 21.78 C ATOM 346 C GLN A 88 -3.453 3.211 41.973 1.00 23.65 C ATOM 347 O GLN A 88 -3.390 3.536 43.164 1.00 25.72 O ATOM 348 CB GLN A 88 -3.242 0.810 41.271 1.00 23.81 C ATOM 349 CG GLN A 88 -2.405 0.391 42.501 1.00 29.91 C ATOM 350 CD GLN A 88 -3.270 -0.102 43.651 1.00 47.71 C ATOM 351 OE1 GLN A 88 -4.363 -0.635 43.440 1.00 48.97 O ATOM 352 NE2 GLN A 88 -2.768 0.036 44.874 1.00 58.36 N ATOM 353 HE22 GLN A 88 -1.843 0.491 45.008 1.00 0.00 H ATOM 354 HE21 GLN A 88 -3.301 -0.311 45.697 1.00 0.00 H ATOM 355 H GLN A 88 -4.854 1.774 39.473 1.00 0.00 H ATOM 356 N ALA A 89 -2.889 3.933 41.009 1.00 20.77 N ATOM 357 CA ALA A 89 -2.118 5.143 41.343 1.00 23.00 C ATOM 358 C ALA A 89 -3.015 6.188 42.013 1.00 25.00 C ATOM 359 O ALA A 89 -2.613 6.855 42.971 1.00 21.06 O ATOM 360 CB ALA A 89 -1.458 5.738 40.095 1.00 19.57 C ATOM 361 H ALA A 89 -2.993 3.642 40.016 1.00 0.00 H ATOM 362 N LEU A 90 -4.236 6.317 41.505 1.00 23.15 N ATOM 363 CA LEU A 90 -5.188 7.290 42.030 1.00 22.35 C ATOM 364 C LEU A 90 -5.663 6.897 43.427 1.00 22.42 C ATOM 365 O LEU A 90 -5.797 7.771 44.282 1.00 21.00 O ATOM 366 CB LEU A 90 -6.394 7.436 41.076 1.00 17.88 C ATOM 367 CG LEU A 90 -7.404 8.540 41.387 1.00 22.04 C ATOM 368 CD1 LEU A 90 -6.755 9.930 41.473 1.00 23.62 C ATOM 369 CD2 LEU A 90 -8.550 8.523 40.366 1.00 20.14 C ATOM 370 H LEU A 90 -4.521 5.708 40.712 1.00 0.00 H ATOM 371 N ARG A 91 -5.935 5.599 43.645 1.00 20.82 N ATOM 372 CA ARG A 91 -6.272 5.099 44.978 1.00 21.15 C ATOM 373 C ARG A 91 -5.178 5.464 45.972 1.00 23.67 C ATOM 374 O ARG A 91 -5.451 5.988 47.052 1.00 25.80 O ATOM 375 CB ARG A 91 -6.428 3.564 44.992 1.00 25.15 C ATOM 376 CG ARG A 91 -7.688 3.029 44.302 1.00 24.85 C ATOM 377 CD ARG A 91 -7.755 1.499 44.436 1.00 23.16 C ATOM 378 NE ARG A 91 -9.025 0.988 43.906 1.00 32.94 N ATOM 379 CZ ARG A 91 -9.543 -0.212 44.175 1.00 37.06 C ATOM 380 NH1 ARG A 91 -8.895 -1.078 44.958 1.00 33.49 N ATOM 381 NH2 ARG A 91 -10.710 -0.561 43.639 1.00 34.87 N ATOM 382 HE ARG A 91 -9.564 1.611 43.271 1.00 0.00 H ATOM 383 HH12 ARG A 91 -9.311 -2.010 45.159 1.00 0.00 H ATOM 384 HH11 ARG A 91 -7.974 -0.821 45.367 1.00 0.00 H ATOM 385 HH22 ARG A 91 -11.118 -1.495 43.845 1.00 0.00 H ATOM 386 HH21 ARG A 91 -11.214 0.100 43.014 1.00 0.00 H ATOM 387 H ARG A 91 -5.905 4.934 42.846 1.00 0.00 H ATOM 388 N GLU A 92 -3.934 5.157 45.610 1.00 25.08 N ATOM 389 CA GLU A 92 -2.813 5.399 46.514 1.00 24.08 C ATOM 390 C GLU A 92 -2.596 6.892 46.736 1.00 25.23 C ATOM 391 O GLU A 92 -2.267 7.305 47.856 1.00 25.99 O ATOM 392 CB GLU A 92 -1.530 4.745 45.984 1.00 26.70 C ATOM 393 CG GLU A 92 -1.573 3.221 45.978 1.00 34.92 C ATOM 394 CD GLU A 92 -0.462 2.601 45.143 1.00 39.80 C ATOM 395 OE1 GLU A 92 0.243 3.338 44.415 1.00 49.92 O ATOM 396 OE2 GLU A 92 -0.307 1.372 45.205 1.00 37.10 O ATOM 397 H GLU A 92 -3.759 4.740 44.673 1.00 0.00 H ATOM 398 N ALA A 93 -2.780 7.693 45.687 1.00 20.91 N ATOM 399 CA ALA A 93 -2.615 9.145 45.814 1.00 26.15 C ATOM 400 C ALA A 93 -3.699 9.729 46.714 1.00 21.77 C ATOM 401 O ALA A 93 -3.429 10.637 47.494 1.00 22.83 O ATOM 402 CB ALA A 93 -2.620 9.834 44.445 1.00 19.83 C ATOM 403 H ALA A 93 -3.044 7.284 44.768 1.00 0.00 H ATOM 404 N GLY A 94 -4.926 9.234 46.578 1.00 22.59 N ATOM 405 CA GLY A 94 -6.005 9.623 47.475 1.00 20.04 C ATOM 406 C GLY A 94 -5.674 9.301 48.928 1.00 27.28 C ATOM 407 O GLY A 94 -5.868 10.128 49.821 1.00 24.59 O ATOM 408 H GLY A 94 -5.119 8.555 45.815 1.00 0.00 H ATOM 409 N ASP A 95 -5.178 8.093 49.173 1.00 24.46 N ATOM 410 CA ASP A 95 -4.743 7.713 50.514 1.00 22.78 C ATOM 411 C ASP A 95 -3.661 8.647 51.059 1.00 27.05 C ATOM 412 O ASP A 95 -3.721 9.075 52.204 1.00 27.49 O ATOM 413 CB ASP A 95 -4.200 6.281 50.527 1.00 24.80 C ATOM 414 CG ASP A 95 -5.286 5.239 50.401 1.00 34.26 C ATOM 415 OD1 ASP A 95 -6.462 5.559 50.676 1.00 29.57 O ATOM 416 OD2 ASP A 95 -4.955 4.095 50.027 1.00 36.16 O ATOM 417 H ASP A 95 -5.098 7.406 48.396 1.00 0.00 H ATOM 418 N GLU A 96 -2.666 8.939 50.230 1.00 27.16 N ATOM 419 CA GLU A 96 -1.554 9.789 50.646 1.00 27.51 C ATOM 420 C GLU A 96 -2.044 11.209 50.888 1.00 28.96 C ATOM 421 O GLU A 96 -1.629 11.859 51.857 1.00 27.53 O ATOM 422 CB GLU A 96 -0.443 9.772 49.588 1.00 32.14 C ATOM 423 CG GLU A 96 0.783 10.646 49.897 1.00 32.00 C ATOM 424 CD GLU A 96 1.712 10.058 50.955 1.00 44.79 C ATOM 425 OE1 GLU A 96 1.451 8.952 51.493 1.00 40.76 O ATOM 426 OE2 GLU A 96 2.746 10.700 51.221 1.00 51.62 O ATOM 427 H GLU A 96 -2.679 8.554 49.264 1.00 0.00 H ATOM 428 N PHE A 97 -2.937 11.686 50.012 1.00 24.99 N ATOM 429 CA PHE A 97 -3.508 13.024 50.179 1.00 22.64 C ATOM 430 C PHE A 97 -4.249 13.129 51.511 1.00 26.08 C ATOM 431 O PHE A 97 -4.058 14.078 52.261 1.00 27.65 O ATOM 432 CB PHE A 97 -4.470 13.382 49.036 1.00 23.21 C ATOM 433 CG PHE A 97 -5.128 14.725 49.224 1.00 24.58 C ATOM 434 CD1 PHE A 97 -6.436 14.822 49.677 1.00 22.80 C ATOM 435 CD2 PHE A 97 -4.402 15.886 49.014 1.00 21.51 C ATOM 436 CE1 PHE A 97 -7.045 16.067 49.882 1.00 20.40 C ATOM 437 CE2 PHE A 97 -4.993 17.148 49.209 1.00 22.28 C ATOM 438 CZ PHE A 97 -6.314 17.237 49.648 1.00 22.05 C ATOM 439 H PHE A 97 -3.228 11.100 49.204 1.00 0.00 H ATOM 440 N GLU A 98 -5.086 12.134 51.794 1.00 27.52 N ATOM 441 CA GLU A 98 -5.875 12.117 53.025 1.00 25.66 C ATOM 442 C GLU A 98 -4.989 11.966 54.265 1.00 29.68 C ATOM 443 O GLU A 98 -5.242 12.580 55.299 1.00 31.59 O ATOM 444 CB GLU A 98 -6.924 10.994 52.954 1.00 28.14 C ATOM 445 CG GLU A 98 -8.007 11.326 51.916 1.00 25.94 C ATOM 446 CD GLU A 98 -8.747 10.109 51.362 1.00 31.94 C ATOM 447 OE1 GLU A 98 -8.711 9.016 51.973 1.00 28.60 O ATOM 448 OE2 GLU A 98 -9.377 10.249 50.291 1.00 29.67 O ATOM 449 H GLU A 98 -5.182 11.347 51.121 1.00 0.00 H ATOM 450 N LEU A 99 -3.932 11.182 54.146 1.00 26.94 N ATOM 451 CA LEU A 99 -3.065 10.929 55.296 1.00 28.30 C ATOM 452 C LEU A 99 -2.195 12.118 55.662 1.00 32.86 C ATOM 453 O LEU A 99 -1.948 12.375 56.845 1.00 34.60 O ATOM 454 CB LEU A 99 -2.168 9.725 55.005 1.00 37.30 C ATOM 455 CG LEU A 99 -1.164 9.339 56.087 1.00 39.67 C ATOM 456 CD1 LEU A 99 -1.890 8.704 57.261 1.00 41.00 C ATOM 457 CD2 LEU A 99 -0.067 8.432 55.537 1.00 40.92 C ATOM 458 H LEU A 99 -3.715 10.742 53.229 1.00 0.00 H ATOM 459 N ARG A 100 -1.759 12.878 54.664 1.00 30.83 N ATOM 460 CA ARG A 100 -0.756 13.907 54.919 1.00 35.10 C ATOM 461 C ARG A 100 -1.102 15.318 54.531 1.00 31.61 C ATOM 462 O ARG A 100 -0.522 16.256 55.099 1.00 32.73 O ATOM 463 CB ARG A 100 0.546 13.608 54.171 1.00 33.25 C ATOM 464 CG ARG A 100 1.202 12.258 54.379 1.00 48.29 C ATOM 465 CD ARG A 100 2.574 12.331 53.716 1.00 57.90 C ATOM 466 NE ARG A 100 3.389 11.136 53.897 1.00 69.75 N ATOM 467 CZ ARG A 100 4.197 10.953 54.935 1.00 76.48 C ATOM 468 NH1 ARG A 100 4.290 11.896 55.860 1.00 76.23 N ATOM 469 NH2 ARG A 100 4.916 9.845 55.042 1.00 82.67 N ATOM 470 HE ARG A 100 3.335 10.388 53.176 1.00 0.00 H ATOM 471 HH12 ARG A 100 4.920 11.763 56.677 1.00 0.00 H ATOM 472 HH11 ARG A 100 3.733 12.770 55.770 1.00 0.00 H ATOM 473 HH22 ARG A 100 5.546 9.711 55.859 1.00 0.00 H ATOM 474 HH21 ARG A 100 4.850 9.110 54.309 1.00 0.00 H ATOM 475 H ARG A 100 -2.132 12.740 53.703 1.00 0.00 H ATOM 476 N TYR A 101 -2.047 15.501 53.618 1.00 30.33 N ATOM 477 CA TYR A 101 -2.184 16.833 53.055 1.00 32.80 C ATOM 478 C TYR A 101 -3.560 17.465 53.217 1.00 30.26 C ATOM 479 O TYR A 101 -3.645 18.686 53.229 1.00 30.16 O ATOM 480 CB TYR A 101 -1.780 16.836 51.564 1.00 31.16 C ATOM 481 CG TYR A 101 -0.355 16.369 51.328 1.00 34.89 C ATOM 482 CD1 TYR A 101 0.731 17.164 51.678 1.00 39.62 C ATOM 483 CD2 TYR A 101 -0.096 15.158 50.711 1.00 26.43 C ATOM 484 CE1 TYR A 101 2.031 16.738 51.462 1.00 43.35 C ATOM 485 CE2 TYR A 101 1.204 14.725 50.489 1.00 30.90 C ATOM 486 CZ TYR A 101 2.260 15.522 50.867 1.00 43.26 C ATOM 487 OH TYR A 101 3.550 15.105 50.640 1.00 46.15 O ATOM 488 HH TYR A 101 4.181 15.793 50.971 1.00 0.00 H ATOM 489 H TYR A 101 -2.666 14.721 53.317 1.00 0.00 H ATOM 490 N ARG A 102 -4.633 16.674 53.289 1.00 30.24 N ATOM 491 CA ARG A 102 -5.973 17.249 53.426 1.00 26.72 C ATOM 492 C ARG A 102 -6.030 18.285 54.562 1.00 29.49 C ATOM 493 O ARG A 102 -6.649 19.339 54.425 1.00 31.24 O ATOM 494 CB ARG A 102 -7.015 16.153 53.675 1.00 25.96 C ATOM 495 CG ARG A 102 -8.434 16.555 53.288 1.00 26.44 C ATOM 496 CD ARG A 102 -9.485 15.861 54.155 1.00 35.53 C ATOM 497 NE ARG A 102 -9.295 14.414 54.227 1.00 39.90 N ATOM 498 CZ ARG A 102 -10.245 13.544 54.565 1.00 42.45 C ATOM 499 NH1 ARG A 102 -11.471 13.963 54.856 1.00 42.33 N ATOM 500 NH2 ARG A 102 -9.968 12.250 54.607 1.00 37.68 N ATOM 501 HE ARG A 102 -8.353 14.037 53.999 1.00 0.00 H ATOM 502 HH12 ARG A 102 -12.206 13.276 55.119 1.00 0.00 H ATOM 503 HH11 ARG A 102 -11.696 14.978 54.821 1.00 0.00 H ATOM 504 HH22 ARG A 102 -10.708 11.568 54.871 1.00 0.00 H ATOM 505 HH21 ARG A 102 -9.011 11.915 54.376 1.00 0.00 H ATOM 506 H ARG A 102 -4.516 15.641 53.247 1.00 0.00 H ATOM 507 N ARG A 103 -5.358 17.982 55.667 1.00 28.59 N ATOM 508 CA ARG A 103 -5.351 18.837 56.853 1.00 27.16 C ATOM 509 C ARG A 103 -4.939 20.302 56.608 1.00 29.06 C ATOM 510 O ARG A 103 -5.258 21.202 57.397 1.00 29.92 O ATOM 511 CB ARG A 103 -4.423 18.187 57.873 1.00 30.20 C ATOM 512 CG ARG A 103 -2.998 18.123 57.367 1.00 31.85 C ATOM 513 CD ARG A 103 -2.142 17.326 58.293 1.00 41.07 C ATOM 514 NE ARG A 103 -2.063 17.890 59.632 1.00 48.17 N ATOM 515 CZ ARG A 103 -1.829 17.158 60.712 1.00 54.28 C ATOM 516 NH1 ARG A 103 -1.692 15.845 60.588 1.00 52.04 N ATOM 517 NH2 ARG A 103 -1.754 17.726 61.909 1.00 57.01 N ATOM 518 HE ARG A 103 -2.196 18.915 59.747 1.00 0.00 H ATOM 519 HH12 ARG A 103 -1.508 15.260 61.428 1.00 0.00 H ATOM 520 HH11 ARG A 103 -1.768 15.400 59.651 1.00 0.00 H ATOM 521 HH22 ARG A 103 -1.570 17.143 62.751 1.00 0.00 H ATOM 522 HH21 ARG A 103 -1.879 18.754 62.006 1.00 0.00 H ATOM 523 H ARG A 103 -4.812 17.097 55.690 1.00 0.00 H ATOM 524 N ALA A 104 -4.210 20.539 55.528 1.00 26.97 N ATOM 525 CA ALA A 104 -3.690 21.875 55.247 1.00 27.87 C ATOM 526 C ALA A 104 -4.739 22.807 54.641 1.00 24.80 C ATOM 527 O ALA A 104 -4.564 24.031 54.624 1.00 25.24 O ATOM 528 CB ALA A 104 -2.508 21.774 54.318 1.00 29.03 C ATOM 529 H ALA A 104 -4.004 19.761 54.869 1.00 0.00 H ATOM 530 N PHE A 105 -5.830 22.237 54.143 1.00 24.10 N ATOM 531 CA PHE A 105 -6.736 23.012 53.309 1.00 21.03 C ATOM 532 C PHE A 105 -8.095 23.290 53.908 1.00 25.99 C ATOM 533 O PHE A 105 -8.513 22.631 54.847 1.00 25.73 O ATOM 534 CB PHE A 105 -6.887 22.287 51.963 1.00 20.98 C ATOM 535 CG PHE A 105 -5.583 22.123 51.260 1.00 23.21 C ATOM 536 CD1 PHE A 105 -4.916 20.911 51.282 1.00 22.42 C ATOM 537 CD2 PHE A 105 -4.990 23.204 50.637 1.00 23.19 C ATOM 538 CE1 PHE A 105 -3.703 20.775 50.657 1.00 24.60 C ATOM 539 CE2 PHE A 105 -3.771 23.080 50.020 1.00 22.86 C ATOM 540 CZ PHE A 105 -3.120 21.863 50.033 1.00 26.91 C ATOM 541 H PHE A 105 -6.036 21.239 54.349 1.00 0.00 H ATOM 542 N SER A 106 -8.771 24.303 53.370 1.00 24.55 N ATOM 543 CA SER A 106 -10.147 24.573 53.746 1.00 27.40 C ATOM 544 C SER A 106 -10.994 23.328 53.484 1.00 24.24 C ATOM 545 O SER A 106 -10.902 22.738 52.413 1.00 24.46 O ATOM 546 CB SER A 106 -10.694 25.768 52.962 1.00 32.76 C ATOM 547 OG SER A 106 -11.995 26.092 53.391 1.00 36.71 O ATOM 548 HG SER A 106 -11.976 26.322 54.354 1.00 0.00 H ATOM 549 H SER A 106 -8.305 24.912 52.668 1.00 0.00 H ATOM 550 N ASP A 107 -11.825 22.945 54.446 1.00 28.33 N ATOM 551 CA ASP A 107 -12.635 21.738 54.319 1.00 28.09 C ATOM 552 C ASP A 107 -13.776 21.925 53.311 1.00 28.27 C ATOM 553 O ASP A 107 -14.749 22.617 53.591 1.00 28.03 O ATOM 554 CB ASP A 107 -13.185 21.337 55.689 1.00 31.12 C ATOM 555 CG ASP A 107 -13.830 19.967 55.685 1.00 33.98 C ATOM 556 OD1 ASP A 107 -14.273 19.485 54.619 1.00 32.20 O ATOM 557 OD2 ASP A 107 -13.889 19.351 56.763 1.00 34.42 O ATOM 558 H ASP A 107 -11.900 23.519 55.310 1.00 0.00 H ATOM 559 N LEU A 108 -13.662 21.294 52.144 1.00 26.74 N ATOM 560 CA LEU A 108 -14.675 21.465 51.101 1.00 26.28 C ATOM 561 C LEU A 108 -16.029 20.873 51.499 1.00 29.75 C ATOM 562 O LEU A 108 -17.069 21.295 50.978 1.00 24.75 O ATOM 563 CB LEU A 108 -14.210 20.818 49.787 1.00 24.12 C ATOM 564 CG LEU A 108 -13.007 21.458 49.093 1.00 28.46 C ATOM 565 CD1 LEU A 108 -12.494 20.588 47.957 1.00 27.57 C ATOM 566 CD2 LEU A 108 -13.317 22.876 48.634 1.00 29.87 C ATOM 567 H LEU A 108 -12.845 20.674 51.972 1.00 0.00 H ATOM 568 N THR A 109 -16.031 19.895 52.406 1.00 28.06 N ATOM 569 CA THR A 109 -17.301 19.332 52.842 1.00 26.19 C ATOM 570 C THR A 109 -18.044 20.348 53.704 1.00 31.88 C ATOM 571 O THR A 109 -19.268 20.380 53.711 1.00 31.57 O ATOM 572 CB THR A 109 -17.128 18.002 53.623 1.00 30.43 C ATOM 573 OG1 THR A 109 -16.429 18.237 54.848 1.00 34.16 O ATOM 574 CG2 THR A 109 -16.363 16.986 52.786 1.00 29.65 C ATOM 575 HG1 THR A 109 -16.325 17.382 55.336 1.00 0.00 H ATOM 576 H THR A 109 -15.136 19.539 52.797 1.00 0.00 H ATOM 577 N SER A 110 -17.306 21.203 54.405 1.00 32.90 N ATOM 578 CA SER A 110 -17.949 22.271 55.159 1.00 32.66 C ATOM 579 C SER A 110 -18.518 23.326 54.207 1.00 29.75 C ATOM 580 O SER A 110 -19.564 23.900 54.475 1.00 36.78 O ATOM 581 CB SER A 110 -16.967 22.929 56.141 1.00 35.08 C ATOM 582 OG SER A 110 -16.486 21.972 57.056 1.00 47.79 O ATOM 583 HG SER A 110 -15.855 22.405 57.684 1.00 0.00 H ATOM 584 H SER A 110 -16.270 21.110 54.415 1.00 0.00 H ATOM 585 N GLN A 111 -17.868 23.543 53.070 1.00 29.82 N ATOM 586 CA GLN A 111 -18.344 24.570 52.148 1.00 31.31 C ATOM 587 C GLN A 111 -19.606 24.100 51.394 1.00 32.99 C ATOM 588 O GLN A 111 -20.443 24.921 51.003 1.00 31.12 O ATOM 589 CB GLN A 111 -17.258 24.950 51.127 1.00 30.35 C ATOM 590 CG GLN A 111 -15.962 25.581 51.707 1.00 27.38 C ATOM 591 CD GLN A 111 -15.020 26.052 50.592 1.00 35.37 C ATOM 592 OE1 GLN A 111 -15.438 26.219 49.444 1.00 38.25 O ATOM 593 NE2 GLN A 111 -13.741 26.193 50.908 1.00 32.64 N ATOM 594 HE22 GLN A 111 -13.428 26.043 51.888 1.00 0.00 H ATOM 595 HE21 GLN A 111 -13.050 26.453 50.176 1.00 0.00 H ATOM 596 H GLN A 111 -17.023 22.983 52.837 1.00 0.00 H ATOM 597 N LEU A 112 -19.813 22.791 51.298 1.00 30.37 N ATOM 598 CA LEU A 112 -20.914 22.284 50.483 1.00 28.68 C ATOM 599 C LEU A 112 -22.089 21.968 51.390 1.00 37.08 C ATOM 600 O LEU A 112 -23.241 22.187 51.010 1.00 33.60 O ATOM 601 CB LEU A 112 -20.506 21.020 49.703 1.00 26.28 C ATOM 602 CG LEU A 112 -21.569 20.415 48.769 1.00 24.93 C ATOM 603 CD1 LEU A 112 -21.953 21.412 47.673 1.00 22.73 C ATOM 604 CD2 LEU A 112 -21.099 19.097 48.150 1.00 25.51 C ATOM 605 H LEU A 112 -19.191 22.128 51.803 1.00 0.00 H ATOM 606 N HIS A 113 -21.781 21.540 52.614 1.00 30.01 N ATOM 607 CA HIS A 113 -22.776 21.066 53.586 1.00 29.78 C ATOM 608 C HIS A 113 -23.922 20.368 52.855 1.00 30.76 C ATOM 609 O HIS A 113 -25.051 20.866 52.781 1.00 36.55 O ATOM 610 CB HIS A 113 -23.289 22.219 54.466 1.00 34.40 C ATOM 611 CG HIS A 113 -23.775 23.414 53.704 1.00 54.75 C ATOM 612 ND1 HIS A 113 -25.053 23.504 53.189 1.00 61.61 N ATOM 613 CD2 HIS A 113 -23.156 24.573 53.369 1.00 57.02 C ATOM 614 CE1 HIS A 113 -25.199 24.664 52.575 1.00 57.12 C ATOM 615 NE2 HIS A 113 -24.062 25.332 52.668 1.00 56.20 N ATOM 616 H HIS A 113 -20.780 21.542 52.897 1.00 0.00 H ATOM 617 N ILE A 114 -23.608 19.184 52.346 1.00 31.16 N ATOM 618 CA ILE A 114 -24.478 18.463 51.431 1.00 30.01 C ATOM 619 C ILE A 114 -25.760 18.013 52.145 1.00 35.69 C ATOM 620 O ILE A 114 -25.724 17.613 53.301 1.00 32.53 O ATOM 621 CB ILE A 114 -23.713 17.255 50.825 1.00 30.94 C ATOM 622 CG1 ILE A 114 -24.474 16.623 49.664 1.00 26.98 C ATOM 623 CG2 ILE A 114 -23.414 16.190 51.892 1.00 27.87 C ATOM 624 CD1 ILE A 114 -23.649 15.577 48.926 1.00 23.01 C ATOM 625 H ILE A 114 -22.700 18.753 52.613 1.00 0.00 H ATOM 626 N THR A 115 -26.899 18.159 51.469 1.00 35.19 N ATOM 627 CA THR A 115 -28.197 17.713 51.975 1.00 30.93 C ATOM 628 C THR A 115 -28.940 17.040 50.813 1.00 31.32 C ATOM 629 O THR A 115 -28.448 17.057 49.682 1.00 31.00 O ATOM 630 CB THR A 115 -29.052 18.881 52.534 1.00 40.52 C ATOM 631 OG1 THR A 115 -29.514 19.707 51.454 1.00 40.27 O ATOM 632 CG2 THR A 115 -28.276 19.719 53.557 1.00 39.76 C ATOM 633 HG1 THR A 115 -28.736 20.075 50.965 1.00 0.00 H ATOM 634 H THR A 115 -26.863 18.613 50.534 1.00 0.00 H ATOM 635 N PRO A 116 -30.108 16.432 51.079 1.00 33.30 N ATOM 636 CA PRO A 116 -30.871 15.884 49.951 1.00 33.72 C ATOM 637 C PRO A 116 -31.272 16.944 48.908 1.00 37.43 C ATOM 638 O PRO A 116 -31.629 16.592 47.785 1.00 41.04 O ATOM 639 CB PRO A 116 -32.119 15.303 50.628 1.00 39.42 C ATOM 640 CG PRO A 116 -31.655 14.937 51.991 1.00 45.88 C ATOM 641 CD PRO A 116 -30.680 16.011 52.374 1.00 41.97 C ATOM 642 N GLY A 117 -31.199 18.222 49.271 1.00 34.21 N ATOM 643 CA GLY A 117 -31.551 19.285 48.347 1.00 37.13 C ATOM 644 C GLY A 117 -30.401 19.779 47.479 1.00 40.17 C ATOM 645 O GLY A 117 -30.610 20.607 46.596 1.00 37.12 O ATOM 646 H GLY A 117 -30.885 18.463 50.232 1.00 0.00 H ATOM 647 N THR A 118 -29.183 19.296 47.730 1.00 31.72 N ATOM 648 CA THR A 118 -28.019 19.754 46.977 1.00 27.48 C ATOM 649 C THR A 118 -28.025 19.271 45.519 1.00 34.91 C ATOM 650 O THR A 118 -28.234 18.086 45.247 1.00 29.02 O ATOM 651 CB THR A 118 -26.716 19.296 47.656 1.00 26.76 C ATOM 652 OG1 THR A 118 -26.752 19.660 49.043 1.00 31.83 O ATOM 653 CG2 THR A 118 -25.511 19.933 46.980 1.00 28.55 C ATOM 654 HG1 THR A 118 -26.841 20.643 49.123 1.00 0.00 H ATOM 655 H THR A 118 -29.061 18.581 48.475 1.00 0.00 H ATOM 656 N ALA A 119 -27.809 20.200 44.588 1.00 30.83 N ATOM 657 CA ALA A 119 -27.753 19.885 43.163 1.00 26.41 C ATOM 658 C ALA A 119 -26.349 20.148 42.639 1.00 29.13 C ATOM 659 O ALA A 119 -25.506 20.721 43.353 1.00 24.70 O ATOM 660 CB ALA A 119 -28.799 20.703 42.370 1.00 25.44 C ATOM 661 H ALA A 119 -27.675 21.187 44.888 1.00 0.00 H ATOM 662 N TYR A 120 -26.095 19.710 41.411 1.00 23.55 N ATOM 663 CA TYR A 120 -24.781 19.839 40.797 1.00 23.46 C ATOM 664 C TYR A 120 -24.218 21.259 40.886 1.00 22.06 C ATOM 665 O TYR A 120 -23.025 21.428 41.105 1.00 22.82 O ATOM 666 CB TYR A 120 -24.835 19.425 39.332 1.00 23.37 C ATOM 667 CG TYR A 120 -23.529 19.619 38.598 1.00 20.92 C ATOM 668 CD1 TYR A 120 -22.443 18.773 38.849 1.00 17.98 C ATOM 669 CD2 TYR A 120 -23.375 20.640 37.662 1.00 23.05 C ATOM 670 CE1 TYR A 120 -21.252 18.923 38.182 1.00 22.77 C ATOM 671 CE2 TYR A 120 -22.188 20.800 36.978 1.00 20.96 C ATOM 672 CZ TYR A 120 -21.126 19.922 37.244 1.00 20.72 C ATOM 673 OH TYR A 120 -19.938 20.059 36.588 1.00 20.84 O ATOM 674 HH TYR A 120 -20.087 19.962 35.614 1.00 0.00 H ATOM 675 H TYR A 120 -26.860 19.260 40.870 1.00 0.00 H ATOM 676 N GLN A 121 -25.080 22.258 40.695 1.00 24.14 N ATOM 677 CA GLN A 121 -24.648 23.651 40.716 1.00 27.79 C ATOM 678 C GLN A 121 -23.831 23.965 41.968 1.00 26.46 C ATOM 679 O GLN A 121 -22.790 24.623 41.891 1.00 28.14 O ATOM 680 CB GLN A 121 -25.865 24.586 40.704 1.00 31.11 C ATOM 681 CG GLN A 121 -25.496 26.055 40.825 1.00 50.63 C ATOM 682 CD GLN A 121 -26.658 26.994 40.547 1.00 71.04 C ATOM 683 OE1 GLN A 121 -27.776 26.776 41.021 1.00 74.36 O ATOM 684 NE2 GLN A 121 -26.393 28.058 39.800 1.00 79.10 N ATOM 685 HE22 GLN A 121 -25.435 28.202 39.421 1.00 0.00 H ATOM 686 HE21 GLN A 121 -27.143 28.748 39.594 1.00 0.00 H ATOM 687 H GLN A 121 -26.083 22.039 40.527 1.00 0.00 H ATOM 688 N SER A 122 -24.295 23.469 43.108 1.00 27.40 N ATOM 689 CA SER A 122 -23.617 23.724 44.387 1.00 28.83 C ATOM 690 C SER A 122 -22.290 22.972 44.476 1.00 25.87 C ATOM 691 O SER A 122 -21.278 23.522 44.904 1.00 24.57 O ATOM 692 CB SER A 122 -24.529 23.355 45.553 1.00 27.65 C ATOM 693 OG SER A 122 -25.668 24.191 45.581 1.00 32.76 O ATOM 694 HG SER A 122 -26.172 24.088 44.735 1.00 0.00 H ATOM 695 H SER A 122 -25.157 22.887 43.096 1.00 0.00 H ATOM 696 N PHE A 123 -22.298 21.711 44.064 1.00 22.65 N ATOM 697 CA PHE A 123 -21.076 20.926 44.015 1.00 22.84 C ATOM 698 C PHE A 123 -20.043 21.606 43.122 1.00 22.10 C ATOM 699 O PHE A 123 -18.875 21.746 43.493 1.00 21.60 O ATOM 700 CB PHE A 123 -21.387 19.519 43.509 1.00 23.05 C ATOM 701 CG PHE A 123 -20.168 18.669 43.249 1.00 20.70 C ATOM 702 CD1 PHE A 123 -19.530 18.014 44.294 1.00 23.12 C ATOM 703 CD2 PHE A 123 -19.687 18.500 41.962 1.00 20.54 C ATOM 704 CE1 PHE A 123 -18.436 17.209 44.053 1.00 20.51 C ATOM 705 CE2 PHE A 123 -18.614 17.692 41.700 1.00 17.78 C ATOM 706 CZ PHE A 123 -17.965 17.047 42.758 1.00 23.64 C ATOM 707 H PHE A 123 -23.196 21.276 43.770 1.00 0.00 H ATOM 708 N GLU A 124 -20.490 22.029 41.946 1.00 22.52 N ATOM 709 CA GLU A 124 -19.619 22.672 40.967 1.00 20.48 C ATOM 710 C GLU A 124 -18.978 23.956 41.532 1.00 23.83 C ATOM 711 O GLU A 124 -17.786 24.206 41.340 1.00 24.35 O ATOM 712 CB GLU A 124 -20.434 22.978 39.704 1.00 19.72 C ATOM 713 CG GLU A 124 -19.627 23.488 38.521 1.00 23.56 C ATOM 714 CD GLU A 124 -20.517 24.009 37.405 1.00 26.98 C ATOM 715 OE1 GLU A 124 -21.619 24.502 37.701 1.00 26.18 O ATOM 716 OE2 GLU A 124 -20.142 23.854 36.227 1.00 28.77 O ATOM 717 H GLU A 124 -21.495 21.898 41.714 1.00 0.00 H ATOM 718 N GLN A 125 -19.766 24.765 42.229 1.00 22.87 N ATOM 719 CA GLN A 125 -19.243 26.030 42.777 1.00 22.09 C ATOM 720 C GLN A 125 -18.160 25.741 43.819 1.00 24.49 C ATOM 721 O GLN A 125 -17.140 26.433 43.879 1.00 24.81 O ATOM 722 CB GLN A 125 -20.350 26.875 43.394 1.00 28.97 C ATOM 723 CG GLN A 125 -21.295 27.500 42.364 1.00 43.22 C ATOM 724 CD GLN A 125 -22.559 28.067 42.987 1.00 64.90 C ATOM 725 OE1 GLN A 125 -22.688 28.121 44.212 1.00 71.11 O ATOM 726 NE2 GLN A 125 -23.497 28.500 42.144 1.00 69.34 N ATOM 727 HE22 GLN A 125 -23.344 28.434 41.117 1.00 0.00 H ATOM 728 HE21 GLN A 125 -24.382 28.904 42.513 1.00 0.00 H ATOM 729 H GLN A 125 -20.760 24.505 42.390 1.00 0.00 H ATOM 730 N VAL A 126 -18.385 24.717 44.627 1.00 21.06 N ATOM 731 CA VAL A 126 -17.422 24.367 45.685 1.00 22.10 C ATOM 732 C VAL A 126 -16.155 23.790 45.066 1.00 26.28 C ATOM 733 O VAL A 126 -15.037 24.104 45.491 1.00 24.11 O ATOM 734 CB VAL A 126 -18.038 23.389 46.718 1.00 25.08 C ATOM 735 CG1 VAL A 126 -16.950 22.773 47.624 1.00 24.05 C ATOM 736 CG2 VAL A 126 -19.114 24.112 47.552 1.00 23.81 C ATOM 737 H VAL A 126 -19.252 24.153 44.513 1.00 0.00 H ATOM 738 N VAL A 127 -16.322 22.935 44.066 1.00 21.74 N ATOM 739 CA VAL A 127 -15.162 22.363 43.392 1.00 23.49 C ATOM 740 C VAL A 127 -14.420 23.426 42.582 1.00 21.37 C ATOM 741 O VAL A 127 -13.200 23.359 42.442 1.00 23.59 O ATOM 742 CB VAL A 127 -15.553 21.185 42.483 1.00 20.97 C ATOM 743 CG1 VAL A 127 -14.338 20.690 41.745 1.00 19.41 C ATOM 744 CG2 VAL A 127 -16.114 20.040 43.333 1.00 20.75 C ATOM 745 H VAL A 127 -17.281 22.672 43.762 1.00 0.00 H ATOM 746 N ASN A 128 -15.149 24.405 42.038 1.00 18.87 N ATOM 747 CA ASN A 128 -14.494 25.514 41.344 1.00 19.16 C ATOM 748 C ASN A 128 -13.544 26.249 42.275 1.00 23.21 C ATOM 749 O ASN A 128 -12.529 26.797 41.837 1.00 22.36 O ATOM 750 CB ASN A 128 -15.511 26.518 40.805 1.00 23.72 C ATOM 751 CG ASN A 128 -16.168 26.063 39.519 1.00 23.09 C ATOM 752 OD1 ASN A 128 -15.755 25.076 38.904 1.00 22.95 O ATOM 753 ND2 ASN A 128 -17.175 26.829 39.069 1.00 21.97 N ATOM 754 HD22 ASN A 128 -17.490 27.652 39.622 1.00 0.00 H ATOM 755 HD21 ASN A 128 -17.640 26.599 38.168 1.00 0.00 H ATOM 756 H ASN A 128 -16.186 24.378 42.108 1.00 0.00 H ATOM 757 N GLU A 129 -13.895 26.266 43.559 1.00 20.47 N ATOM 758 CA GLU A 129 -13.048 26.883 44.591 1.00 23.20 C ATOM 759 C GLU A 129 -11.733 26.128 44.752 1.00 22.26 C ATOM 760 O GLU A 129 -10.669 26.737 44.860 1.00 23.71 O ATOM 761 CB GLU A 129 -13.810 26.947 45.919 1.00 30.89 C ATOM 762 CG GLU A 129 -13.070 27.549 47.115 1.00 35.46 C ATOM 763 CD GLU A 129 -12.639 28.991 46.934 1.00 40.26 C ATOM 764 OE1 GLU A 129 -11.635 29.377 47.591 1.00 37.38 O ATOM 765 OE2 GLU A 129 -13.316 29.749 46.184 1.00 35.18 O ATOM 766 H GLU A 129 -14.796 25.830 43.841 1.00 0.00 H ATOM 767 N LEU A 130 -11.809 24.803 44.703 1.00 22.73 N ATOM 768 CA LEU A 130 -10.619 23.944 44.728 1.00 19.61 C ATOM 769 C LEU A 130 -9.665 24.314 43.591 1.00 24.98 C ATOM 770 O LEU A 130 -8.447 24.384 43.774 1.00 23.01 O ATOM 771 CB LEU A 130 -11.036 22.479 44.598 1.00 22.12 C ATOM 772 CG LEU A 130 -10.014 21.372 44.331 1.00 21.70 C ATOM 773 CD1 LEU A 130 -8.881 21.393 45.327 1.00 21.72 C ATOM 774 CD2 LEU A 130 -10.695 20.002 44.279 1.00 18.16 C ATOM 775 H LEU A 130 -12.747 24.357 44.645 1.00 0.00 H ATOM 776 N PHE A 131 -10.229 24.592 42.416 1.00 19.25 N ATOM 777 CA PHE A 131 -9.407 24.829 41.236 1.00 16.18 C ATOM 778 C PHE A 131 -9.315 26.303 40.896 1.00 27.23 C ATOM 779 O PHE A 131 -8.887 26.653 39.798 1.00 24.72 O ATOM 780 CB PHE A 131 -9.966 24.065 40.026 1.00 18.56 C ATOM 781 CG PHE A 131 -9.941 22.583 40.189 1.00 19.55 C ATOM 782 CD1 PHE A 131 -8.726 21.909 40.235 1.00 16.20 C ATOM 783 CD2 PHE A 131 -11.118 21.850 40.273 1.00 22.73 C ATOM 784 CE1 PHE A 131 -8.675 20.535 40.369 1.00 16.83 C ATOM 785 CE2 PHE A 131 -11.084 20.457 40.402 1.00 22.61 C ATOM 786 CZ PHE A 131 -9.864 19.794 40.444 1.00 21.16 C ATOM 787 H PHE A 131 -11.265 24.640 42.340 1.00 0.00 H ATOM 788 N ARG A 132 -9.674 27.157 41.851 1.00 26.07 N ATOM 789 CA ARG A 132 -9.669 28.606 41.651 1.00 26.11 C ATOM 790 C ARG A 132 -8.335 29.130 41.111 1.00 34.34 C ATOM 791 O ARG A 132 -8.309 30.003 40.237 1.00 30.26 O ATOM 792 CB ARG A 132 -10.010 29.325 42.963 1.00 24.86 C ATOM 793 CG ARG A 132 -10.052 30.831 42.871 1.00 36.26 C ATOM 794 CD ARG A 132 -10.428 31.425 44.216 1.00 35.53 C ATOM 795 NE ARG A 132 -10.655 32.866 44.155 1.00 55.38 N ATOM 796 CZ ARG A 132 -11.811 33.427 43.825 1.00 62.75 C ATOM 797 NH1 ARG A 132 -11.926 34.747 43.799 1.00 74.87 N ATOM 798 NH2 ARG A 132 -12.855 32.663 43.541 1.00 65.44 N ATOM 799 HE ARG A 132 -9.858 33.494 44.385 1.00 0.00 H ATOM 800 HH12 ARG A 132 -12.833 35.185 43.540 1.00 0.00 H ATOM 801 HH11 ARG A 132 -11.109 35.345 44.038 1.00 0.00 H ATOM 802 HH22 ARG A 132 -13.763 33.099 43.282 1.00 0.00 H ATOM 803 HH21 ARG A 132 -12.767 31.627 43.577 1.00 0.00 H ATOM 804 H ARG A 132 -9.969 26.780 42.774 1.00 0.00 H ATOM 805 N ASP A 133 -7.224 28.591 41.613 1.00 24.94 N ATOM 806 CA ASP A 133 -5.928 29.083 41.180 1.00 27.53 C ATOM 807 C ASP A 133 -5.289 28.179 40.128 1.00 28.02 C ATOM 808 O ASP A 133 -4.096 28.252 39.860 1.00 33.07 O ATOM 809 CB ASP A 133 -4.994 29.248 42.369 1.00 31.13 C ATOM 810 CG ASP A 133 -4.037 30.372 42.159 1.00 43.96 C ATOM 811 OD1 ASP A 133 -4.496 31.529 42.244 1.00 56.39 O ATOM 812 OD2 ASP A 133 -2.851 30.104 41.872 1.00 49.65 O ATOM 813 H ASP A 133 -7.285 27.822 42.311 1.00 0.00 H ATOM 814 N GLY A 134 -6.103 27.331 39.527 1.00 24.01 N ATOM 815 CA GLY A 134 -5.641 26.473 38.459 1.00 22.65 C ATOM 816 C GLY A 134 -5.711 25.002 38.809 1.00 24.46 C ATOM 817 O GLY A 134 -5.838 24.628 39.980 1.00 22.17 O ATOM 818 H GLY A 134 -7.097 27.279 39.828 1.00 0.00 H ATOM 819 N VAL A 135 -5.606 24.171 37.782 1.00 23.51 N ATOM 820 CA VAL A 135 -5.632 22.719 37.940 1.00 20.83 C ATOM 821 C VAL A 135 -4.200 22.217 38.042 1.00 22.53 C ATOM 822 O VAL A 135 -3.304 22.734 37.380 1.00 23.51 O ATOM 823 CB VAL A 135 -6.346 22.021 36.748 1.00 20.99 C ATOM 824 CG1 VAL A 135 -6.362 20.486 36.957 1.00 16.83 C ATOM 825 CG2 VAL A 135 -7.764 22.567 36.566 1.00 24.54 C ATOM 826 H VAL A 135 -5.501 24.568 36.827 1.00 0.00 H ATOM 827 N ASN A 136 -3.973 21.248 38.922 1.00 23.53 N ATOM 828 CA ASN A 136 -2.761 20.433 38.884 1.00 18.45 C ATOM 829 C ASN A 136 -3.132 19.043 39.382 1.00 19.63 C ATOM 830 O ASN A 136 -4.248 18.835 39.835 1.00 20.60 O ATOM 831 CB ASN A 136 -1.603 21.054 39.704 1.00 20.64 C ATOM 832 CG ASN A 136 -1.924 21.236 41.185 1.00 25.40 C ATOM 833 OD1 ASN A 136 -2.586 20.411 41.805 1.00 25.32 O ATOM 834 ND2 ASN A 136 -1.389 22.323 41.775 1.00 24.22 N ATOM 835 HD22 ASN A 136 -0.834 22.999 41.213 1.00 0.00 H ATOM 836 HD21 ASN A 136 -1.532 22.486 42.792 1.00 0.00 H ATOM 837 H ASN A 136 -4.681 21.064 39.662 1.00 0.00 H ATOM 838 N TRP A 137 -2.211 18.088 39.300 1.00 19.75 N ATOM 839 CA TRP A 137 -2.580 16.698 39.616 1.00 18.81 C ATOM 840 C TRP A 137 -2.995 16.545 41.069 1.00 18.44 C ATOM 841 O TRP A 137 -3.934 15.810 41.384 1.00 20.51 O ATOM 842 CB TRP A 137 -1.416 15.744 39.317 1.00 21.51 C ATOM 843 CG TRP A 137 -1.150 15.519 37.847 1.00 18.53 C ATOM 844 CD1 TRP A 137 -0.018 15.846 37.160 1.00 19.93 C ATOM 845 CD2 TRP A 137 -2.041 14.908 36.888 1.00 18.75 C ATOM 846 NE1 TRP A 137 -0.139 15.461 35.838 1.00 22.74 N ATOM 847 CE2 TRP A 137 -1.371 14.891 35.649 1.00 21.58 C ATOM 848 CE3 TRP A 137 -3.336 14.374 36.965 1.00 18.21 C ATOM 849 CZ2 TRP A 137 -1.955 14.366 34.484 1.00 21.53 C ATOM 850 CZ3 TRP A 137 -3.920 13.856 35.804 1.00 18.54 C ATOM 851 CH2 TRP A 137 -3.218 13.845 34.584 1.00 20.09 C ATOM 852 HE1 TRP A 137 0.588 15.584 35.105 1.00 0.00 H ATOM 853 H TRP A 137 -1.238 18.321 39.015 1.00 0.00 H ATOM 854 N GLY A 138 -2.283 17.245 41.957 1.00 21.14 N ATOM 855 CA GLY A 138 -2.599 17.205 43.373 1.00 22.29 C ATOM 856 C GLY A 138 -4.033 17.661 43.640 1.00 27.35 C ATOM 857 O GLY A 138 -4.728 17.089 44.478 1.00 19.41 O ATOM 858 H GLY A 138 -1.488 17.829 41.628 1.00 0.00 H ATOM 859 N ARG A 139 -4.484 18.696 42.933 1.00 19.95 N ATOM 860 CA ARG A 139 -5.845 19.197 43.152 1.00 20.71 C ATOM 861 C ARG A 139 -6.855 18.235 42.554 1.00 15.94 C ATOM 862 O ARG A 139 -7.959 18.100 43.058 1.00 18.24 O ATOM 863 CB ARG A 139 -6.007 20.624 42.583 1.00 14.87 C ATOM 864 CG ARG A 139 -5.232 21.620 43.446 1.00 18.18 C ATOM 865 CD ARG A 139 -4.971 22.945 42.738 1.00 18.89 C ATOM 866 NE ARG A 139 -3.973 23.681 43.492 1.00 22.49 N ATOM 867 CZ ARG A 139 -3.444 24.840 43.127 1.00 26.08 C ATOM 868 NH1 ARG A 139 -3.819 25.418 41.993 1.00 26.38 N ATOM 869 NH2 ARG A 139 -2.497 25.388 43.883 1.00 27.45 N ATOM 870 HE ARG A 139 -3.648 23.267 44.389 1.00 0.00 H ATOM 871 HH12 ARG A 139 -3.402 26.328 41.710 1.00 0.00 H ATOM 872 HH11 ARG A 139 -4.530 24.961 41.387 1.00 0.00 H ATOM 873 HH22 ARG A 139 -2.073 26.297 43.608 1.00 0.00 H ATOM 874 HH21 ARG A 139 -2.180 24.907 44.749 1.00 0.00 H ATOM 875 H ARG A 139 -3.871 19.149 42.226 1.00 0.00 H ATOM 876 N ILE A 140 -6.464 17.537 41.497 1.00 15.07 N ATOM 877 CA ILE A 140 -7.331 16.504 40.956 1.00 16.74 C ATOM 878 C ILE A 140 -7.477 15.351 41.957 1.00 18.25 C ATOM 879 O ILE A 140 -8.579 14.837 42.162 1.00 18.70 O ATOM 880 CB ILE A 140 -6.818 16.003 39.599 1.00 17.58 C ATOM 881 CG1 ILE A 140 -7.050 17.114 38.550 1.00 18.83 C ATOM 882 CG2 ILE A 140 -7.581 14.739 39.196 1.00 18.10 C ATOM 883 CD1 ILE A 140 -6.572 16.759 37.146 1.00 19.14 C ATOM 884 H ILE A 140 -5.541 17.728 41.057 1.00 0.00 H ATOM 885 N VAL A 141 -6.381 14.991 42.616 1.00 15.65 N ATOM 886 CA VAL A 141 -6.446 13.995 43.681 1.00 17.22 C ATOM 887 C VAL A 141 -7.380 14.492 44.790 1.00 20.86 C ATOM 888 O VAL A 141 -8.243 13.746 45.247 1.00 18.74 O ATOM 889 CB VAL A 141 -5.043 13.669 44.227 1.00 20.03 C ATOM 890 CG1 VAL A 141 -5.132 12.751 45.444 1.00 19.10 C ATOM 891 CG2 VAL A 141 -4.197 13.014 43.119 1.00 19.24 C ATOM 892 H VAL A 141 -5.467 15.423 42.371 1.00 0.00 H ATOM 893 N ALA A 142 -7.248 15.760 45.190 1.00 18.65 N ATOM 894 CA ALA A 142 -8.115 16.327 46.225 1.00 19.10 C ATOM 895 C ALA A 142 -9.607 16.260 45.840 1.00 17.70 C ATOM 896 O ALA A 142 -10.469 16.023 46.691 1.00 21.15 O ATOM 897 CB ALA A 142 -7.711 17.791 46.523 1.00 19.74 C ATOM 898 H ALA A 142 -6.514 16.357 44.757 1.00 0.00 H ATOM 899 N PHE A 143 -9.889 16.516 44.566 1.00 16.94 N ATOM 900 CA PHE A 143 -11.230 16.417 44.018 1.00 15.21 C ATOM 901 C PHE A 143 -11.806 15.011 44.202 1.00 16.83 C ATOM 902 O PHE A 143 -12.925 14.872 44.677 1.00 19.84 O ATOM 903 CB PHE A 143 -11.202 16.825 42.553 1.00 16.17 C ATOM 904 CG PHE A 143 -12.403 16.348 41.725 1.00 16.60 C ATOM 905 CD1 PHE A 143 -13.581 17.073 41.682 1.00 19.90 C ATOM 906 CD2 PHE A 143 -12.300 15.184 40.967 1.00 19.11 C ATOM 907 CE1 PHE A 143 -14.663 16.645 40.866 1.00 20.17 C ATOM 908 CE2 PHE A 143 -13.356 14.744 40.158 1.00 17.27 C ATOM 909 CZ PHE A 143 -14.552 15.487 40.123 1.00 21.38 C ATOM 910 H PHE A 143 -9.114 16.800 43.933 1.00 0.00 H ATOM 911 N PHE A 144 -11.038 13.976 43.861 1.00 18.04 N ATOM 912 CA PHE A 144 -11.513 12.607 44.064 1.00 20.86 C ATOM 913 C PHE A 144 -11.721 12.325 45.542 1.00 20.88 C ATOM 914 O PHE A 144 -12.750 11.745 45.940 1.00 20.21 O ATOM 915 CB PHE A 144 -10.544 11.595 43.447 1.00 18.55 C ATOM 916 CG PHE A 144 -10.780 11.374 41.954 1.00 17.97 C ATOM 917 CD1 PHE A 144 -11.690 10.417 41.508 1.00 19.15 C ATOM 918 CD2 PHE A 144 -10.080 12.119 41.020 1.00 18.05 C ATOM 919 CE1 PHE A 144 -11.896 10.232 40.134 1.00 19.67 C ATOM 920 CE2 PHE A 144 -10.261 11.932 39.670 1.00 21.92 C ATOM 921 CZ PHE A 144 -11.177 10.987 39.224 1.00 18.25 C ATOM 922 H PHE A 144 -10.098 14.142 43.449 1.00 0.00 H ATOM 923 N SER A 145 -10.757 12.732 46.367 1.00 18.16 N ATOM 924 CA SER A 145 -10.877 12.546 47.807 1.00 20.18 C ATOM 925 C SER A 145 -12.129 13.227 48.351 1.00 20.82 C ATOM 926 O SER A 145 -12.816 12.687 49.215 1.00 22.02 O ATOM 927 CB SER A 145 -9.640 13.084 48.532 1.00 19.57 C ATOM 928 OG SER A 145 -8.534 12.226 48.350 1.00 21.36 O ATOM 929 HG SER A 145 -8.750 11.330 48.711 1.00 0.00 H ATOM 930 H SER A 145 -9.908 13.189 45.978 1.00 0.00 H ATOM 931 N PHE A 146 -12.415 14.417 47.839 1.00 19.50 N ATOM 932 CA PHE A 146 -13.600 15.164 48.255 1.00 26.72 C ATOM 933 C PHE A 146 -14.891 14.397 47.929 1.00 20.38 C ATOM 934 O PHE A 146 -15.775 14.254 48.793 1.00 22.94 O ATOM 935 CB PHE A 146 -13.591 16.535 47.570 1.00 23.83 C ATOM 936 CG PHE A 146 -14.822 17.371 47.819 1.00 27.03 C ATOM 937 CD1 PHE A 146 -15.345 17.532 49.095 1.00 24.78 C ATOM 938 CD2 PHE A 146 -15.430 18.033 46.757 1.00 24.49 C ATOM 939 CE1 PHE A 146 -16.482 18.318 49.310 1.00 23.71 C ATOM 940 CE2 PHE A 146 -16.554 18.831 46.961 1.00 20.82 C ATOM 941 CZ PHE A 146 -17.084 18.972 48.220 1.00 20.06 C ATOM 942 H PHE A 146 -11.781 14.828 47.125 1.00 0.00 H ATOM 943 N GLY A 147 -14.981 13.904 46.699 1.00 21.50 N ATOM 944 CA GLY A 147 -16.117 13.091 46.286 1.00 23.06 C ATOM 945 C GLY A 147 -16.257 11.860 47.175 1.00 25.00 C ATOM 946 O GLY A 147 -17.359 11.502 47.609 1.00 21.32 O ATOM 947 H GLY A 147 -14.223 14.103 46.015 1.00 0.00 H ATOM 948 N GLY A 148 -15.129 11.210 47.454 1.00 19.84 N ATOM 949 CA GLY A 148 -15.120 10.077 48.361 1.00 23.53 C ATOM 950 C GLY A 148 -15.657 10.452 49.727 1.00 25.33 C ATOM 951 O GLY A 148 -16.489 9.751 50.300 1.00 24.80 O ATOM 952 H GLY A 148 -14.239 11.520 47.014 1.00 0.00 H ATOM 953 N ALA A 149 -15.190 11.578 50.256 1.00 22.57 N ATOM 954 CA ALA A 149 -15.631 12.015 51.567 1.00 28.43 C ATOM 955 C ALA A 149 -17.122 12.324 51.592 1.00 24.46 C ATOM 956 O ALA A 149 -17.798 12.051 52.589 1.00 26.26 O ATOM 957 CB ALA A 149 -14.835 13.231 52.011 1.00 28.61 C ATOM 958 H ALA A 149 -14.503 12.151 49.726 1.00 0.00 H ATOM 959 N LEU A 150 -17.623 12.917 50.509 1.00 26.10 N ATOM 960 CA LEU A 150 -19.048 13.219 50.414 1.00 29.83 C ATOM 961 C LEU A 150 -19.880 11.949 50.450 1.00 24.53 C ATOM 962 O LEU A 150 -20.916 11.903 51.100 1.00 27.82 O ATOM 963 CB LEU A 150 -19.355 13.993 49.134 1.00 23.68 C ATOM 964 CG LEU A 150 -18.878 15.438 49.099 1.00 24.89 C ATOM 965 CD1 LEU A 150 -19.214 16.051 47.728 1.00 23.74 C ATOM 966 CD2 LEU A 150 -19.535 16.219 50.222 1.00 24.75 C ATOM 967 H LEU A 150 -16.991 13.168 49.722 1.00 0.00 H ATOM 968 N CYS A 151 -19.409 10.916 49.762 1.00 24.83 N ATOM 969 CA CYS A 151 -20.129 9.642 49.755 1.00 30.27 C ATOM 970 C CYS A 151 -20.161 9.000 51.132 1.00 30.59 C ATOM 971 O CYS A 151 -21.196 8.510 51.581 1.00 27.85 O ATOM 972 CB CYS A 151 -19.508 8.672 48.742 1.00 23.16 C ATOM 973 SG CYS A 151 -19.834 9.119 47.044 1.00 26.42 S ATOM 974 H CYS A 151 -18.524 11.013 49.225 1.00 0.00 H ATOM 975 N VAL A 152 -19.018 8.991 51.805 1.00 29.30 N ATOM 976 CA VAL A 152 -18.951 8.424 53.138 1.00 28.88 C ATOM 977 C VAL A 152 -19.869 9.188 54.076 1.00 32.28 C ATOM 978 O VAL A 152 -20.630 8.589 54.826 1.00 34.63 O ATOM 979 CB VAL A 152 -17.501 8.423 53.675 1.00 26.43 C ATOM 980 CG1 VAL A 152 -17.462 8.022 55.148 1.00 34.11 C ATOM 981 CG2 VAL A 152 -16.651 7.472 52.834 1.00 27.85 C ATOM 982 H VAL A 152 -18.162 9.394 51.373 1.00 0.00 H ATOM 983 N GLU A 153 -19.805 10.517 54.009 1.00 34.53 N ATOM 984 CA GLU A 153 -20.635 11.373 54.859 1.00 34.82 C ATOM 985 C GLU A 153 -22.119 11.093 54.635 1.00 34.29 C ATOM 986 O GLU A 153 -22.909 11.029 55.582 1.00 34.99 O ATOM 987 CB GLU A 153 -20.368 12.852 54.556 1.00 37.96 C ATOM 988 CG GLU A 153 -21.111 13.810 55.476 1.00 45.63 C ATOM 989 CD GLU A 153 -21.050 15.265 55.021 1.00 47.13 C ATOM 990 OE1 GLU A 153 -20.167 15.622 54.209 1.00 46.58 O ATOM 991 OE2 GLU A 153 -21.852 16.071 55.536 1.00 46.42 O ATOM 992 H GLU A 153 -19.148 10.958 53.335 1.00 0.00 H ATOM 993 N SER A 154 -22.489 10.945 53.367 1.00 33.37 N ATOM 994 CA SER A 154 -23.871 10.680 53.006 1.00 31.75 C ATOM 995 C SER A 154 -24.370 9.366 53.590 1.00 34.93 C ATOM 996 O SER A 154 -25.461 9.311 54.159 1.00 38.41 O ATOM 997 CB SER A 154 -24.030 10.671 51.478 1.00 30.73 C ATOM 998 OG SER A 154 -23.817 11.971 50.938 1.00 34.91 O ATOM 999 HG SER A 154 -22.901 12.274 51.162 1.00 0.00 H ATOM 1000 H SER A 154 -21.773 11.021 52.616 1.00 0.00 H ATOM 1001 N VAL A 155 -23.565 8.313 53.468 1.00 34.22 N ATOM 1002 CA VAL A 155 -23.975 7.018 53.990 1.00 33.71 C ATOM 1003 C VAL A 155 -24.023 7.077 55.508 1.00 35.95 C ATOM 1004 O VAL A 155 -24.972 6.579 56.120 1.00 40.85 O ATOM 1005 CB VAL A 155 -23.034 5.893 53.530 1.00 34.95 C ATOM 1006 CG1 VAL A 155 -23.468 4.558 54.130 1.00 35.31 C ATOM 1007 CG2 VAL A 155 -22.995 5.827 51.999 1.00 33.77 C ATOM 1008 H VAL A 155 -22.642 8.416 52.999 1.00 0.00 H ATOM 1009 N ASP A 156 -23.017 7.715 56.112 1.00 36.20 N ATOM 1010 CA ASP A 156 -23.019 7.939 57.557 1.00 37.05 C ATOM 1011 C ASP A 156 -24.323 8.581 58.026 1.00 41.31 C ATOM 1012 O ASP A 156 -24.865 8.210 59.064 1.00 45.99 O ATOM 1013 CB ASP A 156 -21.850 8.837 57.988 1.00 43.88 C ATOM 1014 CG ASP A 156 -20.503 8.117 57.979 1.00 47.08 C ATOM 1015 OD1 ASP A 156 -20.470 6.869 57.881 1.00 42.82 O ATOM 1016 OD2 ASP A 156 -19.472 8.812 58.114 1.00 46.02 O ATOM 1017 H ASP A 156 -22.217 8.059 55.544 1.00 0.00 H ATOM 1018 N LYS A 157 -24.819 9.549 57.256 1.00 41.72 N ATOM 1019 CA LYS A 157 -26.000 10.315 57.655 1.00 44.90 C ATOM 1020 C LYS A 157 -27.282 9.727 57.077 1.00 45.96 C ATOM 1021 O LYS A 157 -28.320 10.390 57.031 1.00 49.57 O ATOM 1022 CB LYS A 157 -25.847 11.777 57.227 1.00 47.78 C ATOM 1023 CG LYS A 157 -24.720 12.497 57.951 1.00 55.70 C ATOM 1024 CD LYS A 157 -24.520 13.914 57.438 1.00 60.28 C ATOM 1025 CE LYS A 157 -23.518 14.660 58.314 1.00 62.36 C ATOM 1026 NZ LYS A 157 -23.306 16.071 57.890 1.00 61.24 N ATOM 1027 HZ1 LYS A 157 -22.946 16.088 56.915 1.00 0.00 H ATOM 1028 HZ2 LYS A 157 -24.209 16.585 57.936 1.00 0.00 H ATOM 1029 HZ3 LYS A 157 -22.616 16.522 58.524 1.00 0.00 H ATOM 1030 H LYS A 157 -24.356 9.765 56.350 1.00 0.00 H ATOM 1031 N GLU A 158 -27.193 8.467 56.663 1.00 41.00 N ATOM 1032 CA GLU A 158 -28.321 7.710 56.138 1.00 44.79 C ATOM 1033 C GLU A 158 -28.996 8.427 54.954 1.00 45.63 C ATOM 1034 O GLU A 158 -30.223 8.442 54.817 1.00 41.72 O ATOM 1035 CB GLU A 158 -29.322 7.422 57.265 1.00 49.00 C ATOM 1036 CG GLU A 158 -28.777 6.445 58.319 1.00 63.96 C ATOM 1037 CD GLU A 158 -28.375 5.086 57.750 1.00 74.88 C ATOM 1038 OE1 GLU A 158 -29.043 4.599 56.816 1.00 78.69 O ATOM 1039 OE2 GLU A 158 -27.368 4.512 58.225 1.00 76.75 O ATOM 1040 H GLU A 158 -26.267 7.996 56.717 1.00 0.00 H ATOM 1041 N MET A 159 -28.167 9.015 54.100 1.00 39.07 N ATOM 1042 CA MET A 159 -28.640 9.620 52.863 1.00 41.00 C ATOM 1043 C MET A 159 -27.974 8.892 51.700 1.00 36.45 C ATOM 1044 O MET A 159 -27.317 9.508 50.862 1.00 35.38 O ATOM 1045 CB MET A 159 -28.307 11.114 52.810 1.00 40.09 C ATOM 1046 CG MET A 159 -28.798 11.954 53.985 1.00 44.69 C ATOM 1047 SD MET A 159 -28.255 13.677 53.778 1.00 51.36 S ATOM 1048 CE MET A 159 -26.478 13.489 53.744 1.00 48.36 C ATOM 1049 H MET A 159 -27.151 9.044 54.321 1.00 0.00 H ATOM 1050 N GLN A 160 -28.144 7.571 51.655 1.00 38.55 N ATOM 1051 CA GLN A 160 -27.427 6.739 50.691 1.00 34.82 C ATOM 1052 C GLN A 160 -27.750 7.072 49.243 1.00 30.15 C ATOM 1053 O GLN A 160 -26.933 6.828 48.348 1.00 33.72 O ATOM 1054 CB GLN A 160 -27.725 5.250 50.917 1.00 41.63 C ATOM 1055 CG GLN A 160 -27.353 4.684 52.271 1.00 51.70 C ATOM 1056 CD GLN A 160 -28.326 5.043 53.372 1.00 60.40 C ATOM 1057 OE1 GLN A 160 -29.321 5.737 53.149 1.00 64.29 O ATOM 1058 NE2 GLN A 160 -28.055 4.543 54.572 1.00 66.54 N ATOM 1059 HE22 GLN A 160 -27.204 3.963 54.713 1.00 0.00 H ATOM 1060 HE21 GLN A 160 -28.694 4.732 55.370 1.00 0.00 H ATOM 1061 H GLN A 160 -28.803 7.121 52.322 1.00 0.00 H ATOM 1062 N VAL A 161 -28.927 7.642 49.002 1.00 37.58 N ATOM 1063 CA VAL A 161 -29.314 7.972 47.635 1.00 34.81 C ATOM 1064 C VAL A 161 -28.345 8.998 47.034 1.00 37.79 C ATOM 1065 O VAL A 161 -28.167 9.052 45.819 1.00 36.28 O ATOM 1066 CB VAL A 161 -30.767 8.512 47.574 1.00 51.66 C ATOM 1067 CG1 VAL A 161 -30.887 9.842 48.301 1.00 51.89 C ATOM 1068 CG2 VAL A 161 -31.235 8.640 46.135 1.00 44.96 C ATOM 1069 H VAL A 161 -29.573 7.853 49.790 1.00 0.00 H ATOM 1070 N LEU A 162 -27.669 9.768 47.886 1.00 31.60 N ATOM 1071 CA LEU A 162 -26.766 10.803 47.389 1.00 27.60 C ATOM 1072 C LEU A 162 -25.504 10.244 46.751 1.00 24.93 C ATOM 1073 O LEU A 162 -24.865 10.936 45.971 1.00 24.35 O ATOM 1074 CB LEU A 162 -26.360 11.754 48.519 1.00 29.03 C ATOM 1075 CG LEU A 162 -27.478 12.619 49.102 1.00 37.42 C ATOM 1076 CD1 LEU A 162 -26.922 13.596 50.110 1.00 41.10 C ATOM 1077 CD2 LEU A 162 -28.172 13.364 47.969 1.00 42.50 C ATOM 1078 H LEU A 162 -27.785 9.631 48.910 1.00 0.00 H ATOM 1079 N VAL A 163 -25.147 9.000 47.073 1.00 24.78 N ATOM 1080 CA VAL A 163 -23.940 8.408 46.507 1.00 23.98 C ATOM 1081 C VAL A 163 -24.037 8.376 44.973 1.00 25.02 C ATOM 1082 O VAL A 163 -23.098 8.731 44.268 1.00 22.11 O ATOM 1083 CB VAL A 163 -23.709 6.982 47.028 1.00 25.51 C ATOM 1084 CG1 VAL A 163 -22.564 6.316 46.265 1.00 27.70 C ATOM 1085 CG2 VAL A 163 -23.425 6.997 48.528 1.00 27.13 C ATOM 1086 H VAL A 163 -25.733 8.448 47.732 1.00 0.00 H ATOM 1087 N SER A 164 -25.186 7.960 44.460 1.00 24.55 N ATOM 1088 CA SER A 164 -25.374 7.946 43.014 1.00 23.98 C ATOM 1089 C SER A 164 -25.343 9.379 42.439 1.00 22.93 C ATOM 1090 O SER A 164 -24.774 9.634 41.378 1.00 22.58 O ATOM 1091 CB SER A 164 -26.694 7.241 42.666 1.00 27.09 C ATOM 1092 OG SER A 164 -26.976 7.377 41.278 1.00 33.88 O ATOM 1093 HG SER A 164 -27.828 6.918 41.069 1.00 0.00 H ATOM 1094 H SER A 164 -25.953 7.644 45.088 1.00 0.00 H ATOM 1095 N ARG A 165 -25.894 10.329 43.181 1.00 23.86 N ATOM 1096 CA ARG A 165 -25.903 11.721 42.734 1.00 21.82 C ATOM 1097 C ARG A 165 -24.482 12.288 42.670 1.00 25.06 C ATOM 1098 O ARG A 165 -24.094 12.965 41.717 1.00 22.15 O ATOM 1099 CB ARG A 165 -26.750 12.571 43.685 1.00 27.23 C ATOM 1100 CG ARG A 165 -26.984 13.991 43.196 1.00 25.68 C ATOM 1101 CD ARG A 165 -27.878 14.770 44.158 1.00 26.15 C ATOM 1102 NE ARG A 165 -29.205 14.193 44.306 1.00 27.18 N ATOM 1103 CZ ARG A 165 -30.146 14.677 45.114 1.00 31.20 C ATOM 1104 NH1 ARG A 165 -29.924 15.785 45.814 1.00 30.09 N ATOM 1105 NH2 ARG A 165 -31.323 14.070 45.203 1.00 34.64 N ATOM 1106 HE ARG A 165 -29.433 13.348 43.744 1.00 0.00 H ATOM 1107 HH12 ARG A 165 -30.662 16.159 46.444 1.00 0.00 H ATOM 1108 HH11 ARG A 165 -29.012 16.278 45.732 1.00 0.00 H ATOM 1109 HH22 ARG A 165 -32.057 14.449 45.835 1.00 0.00 H ATOM 1110 HH21 ARG A 165 -31.511 13.215 44.641 1.00 0.00 H ATOM 1111 H ARG A 165 -26.326 10.081 44.094 1.00 0.00 H ATOM 1112 N ILE A 166 -23.708 12.016 43.719 1.00 22.06 N ATOM 1113 CA ILE A 166 -22.320 12.480 43.775 1.00 16.61 C ATOM 1114 C ILE A 166 -21.468 11.879 42.665 1.00 17.10 C ATOM 1115 O ILE A 166 -20.645 12.574 42.063 1.00 20.31 O ATOM 1116 CB ILE A 166 -21.699 12.159 45.162 1.00 23.12 C ATOM 1117 CG1 ILE A 166 -22.426 12.956 46.260 1.00 21.30 C ATOM 1118 CG2 ILE A 166 -20.190 12.421 45.158 1.00 21.44 C ATOM 1119 CD1 ILE A 166 -22.249 12.357 47.679 1.00 22.62 C ATOM 1120 H ILE A 166 -24.096 11.465 44.511 1.00 0.00 H ATOM 1121 N ALA A 167 -21.643 10.588 42.390 1.00 19.07 N ATOM 1122 CA ALA A 167 -20.866 9.947 41.325 1.00 21.06 C ATOM 1123 C ALA A 167 -21.158 10.637 39.983 1.00 23.12 C ATOM 1124 O ALA A 167 -20.262 10.898 39.171 1.00 18.20 O ATOM 1125 CB ALA A 167 -21.175 8.452 41.245 1.00 20.15 C ATOM 1126 H ALA A 167 -22.334 10.032 42.933 1.00 0.00 H ATOM 1127 N ALA A 168 -22.427 10.924 39.760 1.00 19.08 N ATOM 1128 CA ALA A 168 -22.837 11.595 38.517 1.00 18.58 C ATOM 1129 C ALA A 168 -22.258 13.009 38.457 1.00 19.83 C ATOM 1130 O ALA A 168 -21.806 13.459 37.394 1.00 17.42 O ATOM 1131 CB ALA A 168 -24.376 11.603 38.388 1.00 19.61 C ATOM 1132 H ALA A 168 -23.144 10.673 40.470 1.00 0.00 H ATOM 1133 N TRP A 169 -22.248 13.708 39.592 1.00 21.15 N ATOM 1134 CA TRP A 169 -21.597 15.022 39.651 1.00 21.16 C ATOM 1135 C TRP A 169 -20.125 14.943 39.267 1.00 18.24 C ATOM 1136 O TRP A 169 -19.623 15.782 38.516 1.00 17.68 O ATOM 1137 CB TRP A 169 -21.664 15.624 41.056 1.00 21.51 C ATOM 1138 CG TRP A 169 -22.989 16.046 41.577 1.00 19.41 C ATOM 1139 CD1 TRP A 169 -24.167 16.257 40.871 1.00 17.67 C ATOM 1140 CD2 TRP A 169 -23.292 16.284 42.948 1.00 21.99 C ATOM 1141 NE1 TRP A 169 -25.166 16.625 41.745 1.00 20.26 N ATOM 1142 CE2 TRP A 169 -24.652 16.641 43.023 1.00 20.38 C ATOM 1143 CE3 TRP A 169 -22.530 16.223 44.137 1.00 18.85 C ATOM 1144 CZ2 TRP A 169 -25.269 16.949 44.232 1.00 23.11 C ATOM 1145 CZ3 TRP A 169 -23.146 16.529 45.322 1.00 22.10 C ATOM 1146 CH2 TRP A 169 -24.496 16.892 45.371 1.00 25.52 C ATOM 1147 HE1 TRP A 169 -26.146 16.853 41.483 1.00 0.00 H ATOM 1148 H TRP A 169 -22.705 13.319 40.442 1.00 0.00 H ATOM 1149 N MET A 170 -19.416 13.948 39.813 1.00 16.45 N ATOM 1150 CA MET A 170 -17.993 13.866 39.562 1.00 16.79 C ATOM 1151 C MET A 170 -17.668 13.635 38.107 1.00 16.46 C ATOM 1152 O MET A 170 -16.784 14.292 37.569 1.00 17.83 O ATOM 1153 CB MET A 170 -17.364 12.759 40.433 1.00 16.29 C ATOM 1154 CG MET A 170 -17.380 13.158 41.906 1.00 18.23 C ATOM 1155 SD MET A 170 -16.801 11.790 42.949 1.00 21.01 S ATOM 1156 CE MET A 170 -15.066 11.807 42.507 1.00 23.35 C ATOM 1157 H MET A 170 -19.884 13.239 40.413 1.00 0.00 H ATOM 1158 N ALA A 171 -18.418 12.734 37.464 1.00 16.63 N ATOM 1159 CA ALA A 171 -18.205 12.434 36.064 1.00 14.86 C ATOM 1160 C ALA A 171 -18.457 13.669 35.201 1.00 16.66 C ATOM 1161 O ALA A 171 -17.686 13.978 34.299 1.00 16.96 O ATOM 1162 CB ALA A 171 -19.114 11.274 35.623 1.00 17.61 C ATOM 1163 H ALA A 171 -19.171 12.238 37.981 1.00 0.00 H ATOM 1164 N THR A 172 -19.545 14.373 35.490 1.00 16.86 N ATOM 1165 CA THR A 172 -19.872 15.589 34.741 1.00 16.47 C ATOM 1166 C THR A 172 -18.805 16.661 34.961 1.00 18.05 C ATOM 1167 O THR A 172 -18.342 17.310 34.002 1.00 16.81 O ATOM 1168 CB THR A 172 -21.285 16.101 35.098 1.00 17.87 C ATOM 1169 OG1 THR A 172 -22.251 15.206 34.515 1.00 18.60 O ATOM 1170 CG2 THR A 172 -21.546 17.485 34.477 1.00 18.88 C ATOM 1171 HG1 THR A 172 -23.164 15.520 34.734 1.00 0.00 H ATOM 1172 H THR A 172 -20.172 14.058 36.257 1.00 0.00 H ATOM 1173 N TYR A 173 -18.361 16.823 36.203 1.00 18.02 N ATOM 1174 CA TYR A 173 -17.322 17.819 36.445 1.00 17.70 C ATOM 1175 C TYR A 173 -16.010 17.448 35.720 1.00 17.83 C ATOM 1176 O TYR A 173 -15.362 18.310 35.118 1.00 16.87 O ATOM 1177 CB TYR A 173 -17.072 18.003 37.956 1.00 18.12 C ATOM 1178 CG TYR A 173 -16.298 19.281 38.226 1.00 15.22 C ATOM 1179 CD1 TYR A 173 -14.894 19.304 38.147 1.00 17.82 C ATOM 1180 CD2 TYR A 173 -16.957 20.458 38.514 1.00 18.29 C ATOM 1181 CE1 TYR A 173 -14.187 20.494 38.366 1.00 18.59 C ATOM 1182 CE2 TYR A 173 -16.257 21.654 38.735 1.00 18.36 C ATOM 1183 CZ TYR A 173 -14.881 21.653 38.659 1.00 17.06 C ATOM 1184 OH TYR A 173 -14.218 22.839 38.887 1.00 18.26 O ATOM 1185 HH TYR A 173 -14.512 23.513 38.224 1.00 0.00 H ATOM 1186 H TYR A 173 -18.745 16.254 36.984 1.00 0.00 H ATOM 1187 N LEU A 174 -15.621 16.175 35.783 1.00 14.30 N ATOM 1188 CA LEU A 174 -14.445 15.701 35.049 1.00 15.20 C ATOM 1189 C LEU A 174 -14.597 16.034 33.568 1.00 17.53 C ATOM 1190 O LEU A 174 -13.690 16.600 32.950 1.00 16.85 O ATOM 1191 CB LEU A 174 -14.253 14.200 35.237 1.00 15.29 C ATOM 1192 CG LEU A 174 -13.538 13.895 36.557 1.00 16.74 C ATOM 1193 CD1 LEU A 174 -13.895 12.471 36.948 1.00 14.25 C ATOM 1194 CD2 LEU A 174 -12.033 14.023 36.359 1.00 17.60 C ATOM 1195 H LEU A 174 -16.163 15.505 36.365 1.00 0.00 H ATOM 1196 N ASN A 175 -15.754 15.676 32.999 1.00 15.37 N ATOM 1197 CA ASN A 175 -15.953 15.872 31.584 1.00 17.45 C ATOM 1198 C ASN A 175 -15.864 17.325 31.181 1.00 21.17 C ATOM 1199 O ASN A 175 -15.173 17.682 30.214 1.00 20.95 O ATOM 1200 CB ASN A 175 -17.360 15.386 31.160 1.00 16.40 C ATOM 1201 CG ASN A 175 -17.518 13.871 31.234 1.00 23.36 C ATOM 1202 OD1 ASN A 175 -16.550 13.133 31.479 1.00 18.56 O ATOM 1203 ND2 ASN A 175 -18.746 13.392 30.971 1.00 17.99 N ATOM 1204 HD22 ASN A 175 -19.528 14.048 30.771 1.00 0.00 H ATOM 1205 HD21 ASN A 175 -18.914 12.366 30.967 1.00 0.00 H ATOM 1206 H ASN A 175 -16.510 15.256 33.577 1.00 0.00 H ATOM 1207 N ASP A 176 -16.554 18.158 31.956 1.00 16.89 N ATOM 1208 CA ASP A 176 -16.808 19.543 31.538 1.00 17.69 C ATOM 1209 C ASP A 176 -15.640 20.455 31.890 1.00 23.53 C ATOM 1210 O ASP A 176 -15.374 21.422 31.183 1.00 24.75 O ATOM 1211 CB ASP A 176 -18.106 20.075 32.160 1.00 18.76 C ATOM 1212 CG ASP A 176 -19.367 19.423 31.547 1.00 21.40 C ATOM 1213 OD1 ASP A 176 -19.222 18.563 30.659 1.00 21.70 O ATOM 1214 OD2 ASP A 176 -20.482 19.759 31.981 1.00 22.45 O ATOM 1215 H ASP A 176 -16.919 17.824 32.871 1.00 0.00 H ATOM 1216 N HIS A 177 -14.976 20.151 33.001 1.00 17.49 N ATOM 1217 CA HIS A 177 -14.026 21.089 33.605 1.00 18.62 C ATOM 1218 C HIS A 177 -12.580 20.591 33.635 1.00 20.06 C ATOM 1219 O HIS A 177 -11.646 21.403 33.696 1.00 22.70 O ATOM 1220 CB HIS A 177 -14.436 21.389 35.042 1.00 20.34 C ATOM 1221 CG HIS A 177 -15.722 22.143 35.183 1.00 27.15 C ATOM 1222 ND1 HIS A 177 -15.780 23.513 35.033 1.00 44.89 N ATOM 1223 CD2 HIS A 177 -16.975 21.728 35.431 1.00 25.23 C ATOM 1224 CE1 HIS A 177 -17.028 23.908 35.217 1.00 49.71 C ATOM 1225 NE2 HIS A 177 -17.778 22.854 35.450 1.00 35.66 N ATOM 1226 H HIS A 177 -15.134 19.227 33.451 1.00 0.00 H ATOM 1227 N LEU A 178 -12.381 19.279 33.645 1.00 18.72 N ATOM 1228 CA LEU A 178 -11.035 18.755 33.880 1.00 20.25 C ATOM 1229 C LEU A 178 -10.430 18.031 32.696 1.00 23.43 C ATOM 1230 O LEU A 178 -9.214 17.996 32.569 1.00 15.61 O ATOM 1231 CB LEU A 178 -11.006 17.839 35.116 1.00 17.54 C ATOM 1232 CG LEU A 178 -11.381 18.574 36.403 1.00 20.29 C ATOM 1233 CD1 LEU A 178 -11.479 17.591 37.605 1.00 20.72 C ATOM 1234 CD2 LEU A 178 -10.347 19.731 36.744 1.00 19.61 C ATOM 1235 H LEU A 178 -13.176 18.628 33.487 1.00 0.00 H ATOM 1236 N GLU A 179 -11.254 17.453 31.823 1.00 16.66 N ATOM 1237 CA GLU A 179 -10.683 16.691 30.729 1.00 17.00 C ATOM 1238 C GLU A 179 -9.746 17.536 29.848 1.00 15.95 C ATOM 1239 O GLU A 179 -8.702 17.035 29.454 1.00 17.91 O ATOM 1240 CB GLU A 179 -11.794 16.051 29.852 1.00 16.55 C ATOM 1241 CG GLU A 179 -11.234 15.353 28.606 1.00 14.89 C ATOM 1242 CD GLU A 179 -12.301 14.595 27.788 1.00 15.06 C ATOM 1243 OE1 GLU A 179 -13.370 14.266 28.346 1.00 19.14 O ATOM 1244 OE2 GLU A 179 -12.033 14.296 26.611 1.00 18.45 O ATOM 1245 H GLU A 179 -12.285 17.546 31.924 1.00 0.00 H ATOM 1246 N PRO A 180 -10.080 18.819 29.558 1.00 15.09 N ATOM 1247 CA PRO A 180 -9.101 19.549 28.743 1.00 14.25 C ATOM 1248 C PRO A 180 -7.725 19.623 29.400 1.00 15.67 C ATOM 1249 O PRO A 180 -6.717 19.457 28.708 1.00 15.53 O ATOM 1250 CB PRO A 180 -9.710 20.954 28.626 1.00 17.07 C ATOM 1251 CG PRO A 180 -11.208 20.719 28.741 1.00 17.81 C ATOM 1252 CD PRO A 180 -11.306 19.610 29.783 1.00 16.57 C ATOM 1253 N TRP A 181 -7.693 19.880 30.703 1.00 15.61 N ATOM 1254 CA TRP A 181 -6.416 19.967 31.411 1.00 18.42 C ATOM 1255 C TRP A 181 -5.699 18.621 31.409 1.00 17.87 C ATOM 1256 O TRP A 181 -4.492 18.550 31.157 1.00 16.35 O ATOM 1257 CB TRP A 181 -6.613 20.456 32.858 1.00 17.01 C ATOM 1258 CG TRP A 181 -5.300 20.728 33.549 1.00 15.06 C ATOM 1259 CD1 TRP A 181 -4.640 21.936 33.632 1.00 18.71 C ATOM 1260 CD2 TRP A 181 -4.468 19.770 34.204 1.00 16.39 C ATOM 1261 NE1 TRP A 181 -3.455 21.771 34.302 1.00 17.42 N ATOM 1262 CE2 TRP A 181 -3.332 20.462 34.686 1.00 19.45 C ATOM 1263 CE3 TRP A 181 -4.588 18.398 34.459 1.00 17.20 C ATOM 1264 CZ2 TRP A 181 -2.301 19.819 35.383 1.00 20.91 C ATOM 1265 CZ3 TRP A 181 -3.549 17.754 35.160 1.00 19.39 C ATOM 1266 CH2 TRP A 181 -2.431 18.471 35.615 1.00 16.47 C ATOM 1267 HE1 TRP A 181 -2.760 22.521 34.489 1.00 0.00 H ATOM 1268 H TRP A 181 -8.582 20.020 31.223 1.00 0.00 H ATOM 1269 N ILE A 182 -6.443 17.548 31.679 1.00 15.44 N ATOM 1270 CA ILE A 182 -5.826 16.230 31.787 1.00 15.76 C ATOM 1271 C ILE A 182 -5.177 15.884 30.456 1.00 18.40 C ATOM 1272 O ILE A 182 -4.023 15.451 30.412 1.00 18.43 O ATOM 1273 CB ILE A 182 -6.845 15.163 32.202 1.00 18.34 C ATOM 1274 CG1 ILE A 182 -7.356 15.472 33.612 1.00 18.54 C ATOM 1275 CG2 ILE A 182 -6.242 13.754 32.061 1.00 18.18 C ATOM 1276 CD1 ILE A 182 -8.599 14.673 34.029 1.00 18.70 C ATOM 1277 H ILE A 182 -7.469 17.651 31.813 1.00 0.00 H ATOM 1278 N GLN A 183 -5.887 16.154 29.357 1.00 14.42 N ATOM 1279 CA GLN A 183 -5.332 15.852 28.069 1.00 16.15 C ATOM 1280 C GLN A 183 -4.140 16.739 27.718 1.00 17.62 C ATOM 1281 O GLN A 183 -3.142 16.260 27.162 1.00 17.56 O ATOM 1282 CB GLN A 183 -6.425 15.999 26.981 1.00 16.95 C ATOM 1283 CG GLN A 183 -5.879 15.977 25.549 1.00 19.49 C ATOM 1284 CD GLN A 183 -5.219 14.640 25.192 1.00 28.04 C ATOM 1285 OE1 GLN A 183 -5.674 13.578 25.603 1.00 27.81 O ATOM 1286 NE2 GLN A 183 -4.185 14.697 24.350 1.00 30.18 N ATOM 1287 HE22 GLN A 183 -3.829 15.619 24.025 1.00 0.00 H ATOM 1288 HE21 GLN A 183 -3.735 13.820 24.019 1.00 0.00 H ATOM 1289 H GLN A 183 -6.833 16.579 29.434 1.00 0.00 H ATOM 1290 N GLU A 184 -4.199 18.002 28.112 1.00 15.38 N ATOM 1291 CA GLU A 184 -3.128 18.937 27.782 1.00 16.10 C ATOM 1292 C GLU A 184 -1.882 18.643 28.583 1.00 19.16 C ATOM 1293 O GLU A 184 -0.771 18.884 28.128 1.00 20.75 O ATOM 1294 CB GLU A 184 -3.572 20.354 28.105 1.00 17.77 C ATOM 1295 CG GLU A 184 -2.531 21.467 27.907 1.00 18.64 C ATOM 1296 CD GLU A 184 -2.157 21.761 26.484 1.00 18.98 C ATOM 1297 OE1 GLU A 184 -2.883 21.360 25.547 1.00 18.16 O ATOM 1298 OE2 GLU A 184 -1.102 22.400 26.299 1.00 20.21 O ATOM 1299 H GLU A 184 -5.018 18.331 28.663 1.00 0.00 H ATOM 1300 N ASN A 185 -2.073 18.009 29.719 1.00 17.09 N ATOM 1301 CA ASN A 185 -0.944 17.820 30.615 1.00 20.52 C ATOM 1302 C ASN A 185 -0.484 16.390 30.681 1.00 22.49 C ATOM 1303 O ASN A 185 0.088 15.957 31.681 1.00 24.97 O ATOM 1304 CB ASN A 185 -1.309 18.348 31.989 1.00 19.99 C ATOM 1305 CG ASN A 185 -1.377 19.855 32.004 1.00 23.79 C ATOM 1306 OD1 ASN A 185 -2.397 20.445 31.663 1.00 21.96 O ATOM 1307 ND2 ASN A 185 -0.279 20.482 32.322 1.00 19.62 N ATOM 1308 HD22 ASN A 185 0.564 19.943 32.606 1.00 0.00 H ATOM 1309 HD21 ASN A 185 -0.246 21.521 32.292 1.00 0.00 H ATOM 1310 H ASN A 185 -3.015 17.649 29.972 1.00 0.00 H ATOM 1311 N GLY A 186 -0.711 15.665 29.593 1.00 19.33 N ATOM 1312 CA GLY A 186 -0.084 14.370 29.415 1.00 22.56 C ATOM 1313 C GLY A 186 -0.937 13.154 29.688 1.00 23.76 C ATOM 1314 O GLY A 186 -0.456 12.039 29.541 1.00 23.92 O ATOM 1315 H GLY A 186 -1.348 16.031 28.857 1.00 0.00 H ATOM 1316 N GLY A 187 -2.195 13.375 30.061 1.00 21.98 N ATOM 1317 CA GLY A 187 -3.150 12.304 30.288 1.00 19.96 C ATOM 1318 C GLY A 187 -2.884 11.525 31.561 1.00 22.81 C ATOM 1319 O GLY A 187 -1.911 11.784 32.276 1.00 19.74 O ATOM 1320 H GLY A 187 -2.508 14.357 30.196 1.00 0.00 H ATOM 1321 N TRP A 188 -3.744 10.554 31.845 1.00 21.89 N ATOM 1322 CA TRP A 188 -3.595 9.767 33.072 1.00 23.01 C ATOM 1323 C TRP A 188 -2.318 8.944 33.088 1.00 21.82 C ATOM 1324 O TRP A 188 -1.805 8.589 34.168 1.00 23.93 O ATOM 1325 CB TRP A 188 -4.821 8.858 33.270 1.00 16.84 C ATOM 1326 CG TRP A 188 -5.976 9.646 33.775 1.00 17.60 C ATOM 1327 CD1 TRP A 188 -7.113 10.022 33.063 1.00 17.55 C ATOM 1328 CD2 TRP A 188 -6.124 10.202 35.090 1.00 20.33 C ATOM 1329 NE1 TRP A 188 -7.942 10.758 33.876 1.00 16.94 N ATOM 1330 CE2 TRP A 188 -7.360 10.885 35.119 1.00 19.64 C ATOM 1331 CE3 TRP A 188 -5.329 10.175 36.258 1.00 16.66 C ATOM 1332 CZ2 TRP A 188 -7.825 11.547 36.265 1.00 20.84 C ATOM 1333 CZ3 TRP A 188 -5.801 10.843 37.401 1.00 17.27 C ATOM 1334 CH2 TRP A 188 -7.039 11.507 37.391 1.00 19.34 C ATOM 1335 HE1 TRP A 188 -8.862 11.156 33.598 1.00 0.00 H ATOM 1336 H TRP A 188 -4.528 10.351 31.193 1.00 0.00 H ATOM 1337 N ASP A 189 -1.785 8.623 31.909 1.00 20.61 N ATOM 1338 CA ASP A 189 -0.518 7.887 31.866 1.00 26.17 C ATOM 1339 C ASP A 189 0.594 8.703 32.520 1.00 24.44 C ATOM 1340 O ASP A 189 1.490 8.146 33.155 1.00 26.29 O ATOM 1341 CB ASP A 189 -0.141 7.524 30.435 1.00 34.99 C ATOM 1342 CG ASP A 189 -1.040 6.439 29.856 1.00 43.36 C ATOM 1343 OD1 ASP A 189 -1.768 5.778 30.634 1.00 34.97 O ATOM 1344 OD2 ASP A 189 -1.029 6.265 28.623 1.00 44.66 O ATOM 1345 H ASP A 189 -2.264 8.893 31.026 1.00 0.00 H ATOM 1346 N THR A 190 0.535 10.021 32.346 1.00 20.96 N ATOM 1347 CA THR A 190 1.529 10.906 32.955 1.00 25.13 C ATOM 1348 C THR A 190 1.297 11.004 34.461 1.00 21.08 C ATOM 1349 O THR A 190 2.250 11.010 35.243 1.00 26.78 O ATOM 1350 CB THR A 190 1.496 12.310 32.309 1.00 26.78 C ATOM 1351 OG1 THR A 190 1.892 12.186 30.939 1.00 28.37 O ATOM 1352 CG2 THR A 190 2.471 13.259 33.018 1.00 24.80 C ATOM 1353 HG1 THR A 190 1.265 11.581 30.469 1.00 0.00 H ATOM 1354 H THR A 190 -0.228 10.428 31.769 1.00 0.00 H ATOM 1355 N PHE A 191 0.035 11.027 34.878 1.00 21.74 N ATOM 1356 CA PHE A 191 -0.255 10.953 36.311 1.00 22.27 C ATOM 1357 C PHE A 191 0.369 9.701 36.936 1.00 25.24 C ATOM 1358 O PHE A 191 0.962 9.753 38.025 1.00 22.87 O ATOM 1359 CB PHE A 191 -1.758 10.970 36.553 1.00 18.60 C ATOM 1360 CG PHE A 191 -2.146 10.722 37.980 1.00 20.52 C ATOM 1361 CD1 PHE A 191 -2.082 11.747 38.926 1.00 22.13 C ATOM 1362 CD2 PHE A 191 -2.527 9.441 38.390 1.00 19.87 C ATOM 1363 CE1 PHE A 191 -2.434 11.508 40.257 1.00 20.90 C ATOM 1364 CE2 PHE A 191 -2.883 9.189 39.720 1.00 22.12 C ATOM 1365 CZ PHE A 191 -2.840 10.229 40.649 1.00 23.91 C ATOM 1366 H PHE A 191 -0.742 11.097 34.190 1.00 0.00 H ATOM 1367 N VAL A 192 0.235 8.562 36.260 1.00 23.75 N ATOM 1368 CA VAL A 192 0.815 7.323 36.788 1.00 26.03 C ATOM 1369 C VAL A 192 2.334 7.435 36.895 1.00 30.67 C ATOM 1370 O VAL A 192 2.945 6.941 37.855 1.00 28.60 O ATOM 1371 CB VAL A 192 0.438 6.100 35.926 1.00 25.10 C ATOM 1372 CG1 VAL A 192 1.206 4.851 36.371 1.00 30.60 C ATOM 1373 CG2 VAL A 192 -1.058 5.851 36.034 1.00 24.81 C ATOM 1374 H VAL A 192 -0.281 8.551 35.357 1.00 0.00 H ATOM 1375 N GLU A 193 2.958 8.072 35.911 1.00 26.54 N ATOM 1376 CA GLU A 193 4.413 8.214 35.941 1.00 35.24 C ATOM 1377 C GLU A 193 4.839 9.071 37.115 1.00 32.41 C ATOM 1378 O GLU A 193 5.872 8.819 37.723 1.00 34.75 O ATOM 1379 CB GLU A 193 4.927 8.859 34.651 1.00 39.37 C ATOM 1380 CG GLU A 193 4.793 8.019 33.396 1.00 50.65 C ATOM 1381 CD GLU A 193 5.163 8.792 32.135 1.00 64.00 C ATOM 1382 OE1 GLU A 193 5.356 10.028 32.218 1.00 62.47 O ATOM 1383 OE2 GLU A 193 5.254 8.163 31.059 1.00 69.57 O ATOM 1384 H GLU A 193 2.412 8.469 35.120 1.00 0.00 H ATOM 1385 N LEU A 194 4.015 10.052 37.465 1.00 29.12 N ATOM 1386 CA LEU A 194 4.350 10.990 38.534 1.00 31.08 C ATOM 1387 C LEU A 194 3.922 10.538 39.932 1.00 30.61 C ATOM 1388 O LEU A 194 4.587 10.860 40.909 1.00 31.43 O ATOM 1389 CB LEU A 194 3.739 12.356 38.231 1.00 28.62 C ATOM 1390 CG LEU A 194 4.310 13.097 37.016 1.00 29.61 C ATOM 1391 CD1 LEU A 194 3.466 14.344 36.703 1.00 27.25 C ATOM 1392 CD2 LEU A 194 5.794 13.472 37.237 1.00 32.21 C ATOM 1393 H LEU A 194 3.109 10.155 36.966 1.00 0.00 H ATOM 1394 N TYR A 195 2.803 9.821 40.028 1.00 26.14 N ATOM 1395 CA TYR A 195 2.195 9.499 41.324 1.00 28.62 C ATOM 1396 C TYR A 195 2.165 8.008 41.643 1.00 31.40 C ATOM 1397 O TYR A 195 1.751 7.608 42.734 1.00 32.68 O ATOM 1398 CB TYR A 195 0.773 10.061 41.393 1.00 26.64 C ATOM 1399 CG TYR A 195 0.764 11.556 41.536 1.00 24.63 C ATOM 1400 CD1 TYR A 195 0.975 12.379 40.424 1.00 25.99 C ATOM 1401 CD2 TYR A 195 0.589 12.157 42.783 1.00 30.80 C ATOM 1402 CE1 TYR A 195 0.995 13.761 40.551 1.00 26.74 C ATOM 1403 CE2 TYR A 195 0.608 13.538 42.918 1.00 30.80 C ATOM 1404 CZ TYR A 195 0.813 14.328 41.805 1.00 31.82 C ATOM 1405 OH TYR A 195 0.836 15.694 41.936 1.00 30.65 O ATOM 1406 HH TYR A 195 1.564 15.953 42.555 1.00 0.00 H ATOM 1407 H TYR A 195 2.347 9.479 39.158 1.00 0.00 H ATOM 1408 N GLY A 196 2.557 7.195 40.671 1.00 27.93 N ATOM 1409 CA GLY A 196 2.585 5.759 40.835 1.00 26.95 C ATOM 1410 C GLY A 196 3.831 5.310 41.572 1.00 37.16 C ATOM 1411 O GLY A 196 3.708 4.585 42.551 1.00 53.93 O ATOM 1412 H GLY A 196 2.854 7.604 39.762 1.00 0.00 H TER 1413 GLY A 196 ATOM 1414 N GLY B -4 -7.025 13.640 22.342 1.00 33.28 N ATOM 1415 CA GLY B -4 -8.132 13.293 21.471 1.00 38.59 C ATOM 1416 C GLY B -4 -9.220 14.319 21.662 1.00 34.92 C ATOM 1417 O GLY B -4 -9.156 15.102 22.608 1.00 33.36 O ATOM 1418 HN3 GLY B -4 -7.349 13.639 23.330 1.00 0.00 H ATOM 1419 HN2 GLY B -4 -6.673 14.586 22.093 1.00 0.00 H ATOM 1420 HN1 GLY B -4 -6.262 12.943 22.225 1.00 0.00 H ATOM 1421 N PRO B -3 -10.232 14.316 20.780 1.00 29.03 N ATOM 1422 CA PRO B -3 -11.270 15.339 20.896 1.00 27.08 C ATOM 1423 C PRO B -3 -11.925 15.259 22.263 1.00 28.31 C ATOM 1424 O PRO B -3 -12.007 14.159 22.842 1.00 22.83 O ATOM 1425 CB PRO B -3 -12.267 14.993 19.762 1.00 24.66 C ATOM 1426 CG PRO B -3 -11.510 14.079 18.845 1.00 39.24 C ATOM 1427 CD PRO B -3 -10.513 13.348 19.708 1.00 30.15 C ATOM 1428 N LEU B -2 -12.325 16.410 22.795 1.00 22.25 N ATOM 1429 CA LEU B -2 -12.995 16.442 24.069 1.00 23.62 C ATOM 1430 C LEU B -2 -14.201 15.559 23.994 1.00 23.06 C ATOM 1431 O LEU B -2 -15.010 15.668 23.077 1.00 19.48 O ATOM 1432 CB LEU B -2 -13.448 17.845 24.461 1.00 23.80 C ATOM 1433 CG LEU B -2 -12.426 18.846 24.908 1.00 25.94 C ATOM 1434 CD1 LEU B -2 -13.195 20.129 25.142 1.00 19.29 C ATOM 1435 CD2 LEU B -2 -11.752 18.339 26.201 1.00 24.86 C ATOM 1436 H LEU B -2 -12.152 17.299 22.284 1.00 0.00 H ATOM 1437 N GLY B -1 -14.319 14.693 24.985 1.00 20.52 N ATOM 1438 CA GLY B -1 -15.393 13.733 25.018 1.00 22.56 C ATOM 1439 C GLY B -1 -14.774 12.347 24.992 1.00 21.80 C ATOM 1440 O GLY B -1 -15.397 11.380 25.433 1.00 21.92 O ATOM 1441 H GLY B -1 -13.622 14.705 25.757 1.00 0.00 H ATOM 1442 N SER B 0 -13.516 12.276 24.567 1.00 19.01 N ATOM 1443 CA SER B 0 -12.873 10.998 24.303 1.00 21.39 C ATOM 1444 C SER B 0 -12.579 10.328 25.627 1.00 17.70 C ATOM 1445 O SER B 0 -12.609 9.100 25.743 1.00 18.77 O ATOM 1446 CB SER B 0 -11.538 11.188 23.553 1.00 20.40 C ATOM 1447 OG SER B 0 -11.692 11.668 22.229 1.00 19.23 O ATOM 1448 HG SER B 0 -12.147 12.547 22.249 1.00 0.00 H ATOM 1449 H SER B 0 -12.979 13.155 24.420 1.00 0.00 H ATOM 1450 N MET B 1 -12.273 11.158 26.620 1.00 15.42 N ATOM 1451 CA MET B 1 -11.878 10.666 27.943 1.00 17.16 C ATOM 1452 C MET B 1 -13.038 10.332 28.895 1.00 17.57 C ATOM 1453 O MET B 1 -12.799 9.864 30.020 1.00 17.71 O ATOM 1454 CB MET B 1 -10.949 11.704 28.603 1.00 14.35 C ATOM 1455 CG MET B 1 -10.039 11.095 29.695 1.00 21.95 C ATOM 1456 SD MET B 1 -8.959 12.359 30.372 1.00 21.87 S ATOM 1457 CE MET B 1 -8.030 12.917 28.924 1.00 19.59 C ATOM 1458 H MET B 1 -12.315 12.184 26.453 1.00 0.00 H ATOM 1459 N SER B 2 -14.280 10.577 28.473 1.00 18.40 N ATOM 1460 CA SER B 2 -15.412 10.386 29.373 1.00 19.81 C ATOM 1461 C SER B 2 -15.510 8.998 30.006 1.00 20.61 C ATOM 1462 O SER B 2 -15.712 8.875 31.211 1.00 20.29 O ATOM 1463 CB SER B 2 -16.731 10.629 28.633 1.00 21.41 C ATOM 1464 OG SER B 2 -16.784 11.913 28.018 1.00 21.94 O ATOM 1465 HG SER B 2 -16.689 12.614 28.711 1.00 0.00 H ATOM 1466 H SER B 2 -14.441 10.905 27.499 1.00 0.00 H ATOM 1467 N GLN B 3 -15.389 7.965 29.180 1.00 17.99 N ATOM 1468 CA GLN B 3 -15.603 6.623 29.697 1.00 19.94 C ATOM 1469 C GLN B 3 -14.530 6.254 30.705 1.00 21.28 C ATOM 1470 O GLN B 3 -14.850 5.727 31.771 1.00 21.46 O ATOM 1471 CB GLN B 3 -15.640 5.627 28.536 1.00 24.77 C ATOM 1472 CG GLN B 3 -15.909 4.203 28.959 1.00 29.92 C ATOM 1473 CD GLN B 3 -15.903 3.265 27.769 1.00 55.37 C ATOM 1474 OE1 GLN B 3 -16.918 3.106 27.089 1.00 61.34 O ATOM 1475 NE2 GLN B 3 -14.753 2.662 27.494 1.00 57.98 N ATOM 1476 HE22 GLN B 3 -13.922 2.827 28.097 1.00 0.00 H ATOM 1477 HE21 GLN B 3 -14.683 2.024 26.675 1.00 0.00 H ATOM 1478 H GLN B 3 -15.145 8.114 28.180 1.00 0.00 H ATOM 1479 N SER B 4 -13.285 6.629 30.435 1.00 21.09 N ATOM 1480 CA SER B 4 -12.171 6.354 31.350 1.00 21.67 C ATOM 1481 C SER B 4 -12.341 7.110 32.653 1.00 23.50 C ATOM 1482 O SER B 4 -12.153 6.579 33.743 1.00 19.21 O ATOM 1483 CB SER B 4 -10.835 6.743 30.720 1.00 19.12 C ATOM 1484 OG SER B 4 -10.564 5.952 29.594 1.00 23.18 O ATOM 1485 HG SER B 4 -11.281 6.078 28.923 1.00 0.00 H ATOM 1486 H SER B 4 -13.093 7.134 29.546 1.00 0.00 H ATOM 1487 N ASN B 5 -12.712 8.378 32.544 1.00 17.70 N ATOM 1488 CA ASN B 5 -12.875 9.177 33.750 1.00 18.72 C ATOM 1489 C ASN B 5 -14.016 8.670 34.628 1.00 16.82 C ATOM 1490 O ASN B 5 -13.942 8.740 35.850 1.00 19.63 O ATOM 1491 CB ASN B 5 -13.090 10.646 33.387 1.00 18.19 C ATOM 1492 CG ASN B 5 -11.772 11.397 33.240 1.00 21.57 C ATOM 1493 OD1 ASN B 5 -10.755 10.965 33.768 1.00 23.54 O ATOM 1494 ND2 ASN B 5 -11.771 12.476 32.460 1.00 18.30 N ATOM 1495 HD22 ASN B 5 -12.658 12.809 32.031 1.00 0.00 H ATOM 1496 HD21 ASN B 5 -10.883 12.986 32.279 1.00 0.00 H ATOM 1497 H ASN B 5 -12.885 8.797 31.608 1.00 0.00 H ATOM 1498 N ARG B 6 -15.069 8.175 34.000 1.00 17.67 N ATOM 1499 CA ARG B 6 -16.185 7.594 34.723 1.00 20.02 C ATOM 1500 C ARG B 6 -15.744 6.345 35.495 1.00 20.77 C ATOM 1501 O ARG B 6 -16.187 6.109 36.611 1.00 22.59 O ATOM 1502 CB ARG B 6 -17.327 7.270 33.768 1.00 24.80 C ATOM 1503 CG ARG B 6 -18.496 6.683 34.496 1.00 24.92 C ATOM 1504 CD ARG B 6 -19.692 6.329 33.594 1.00 24.73 C ATOM 1505 NE ARG B 6 -20.665 5.719 34.478 1.00 31.33 N ATOM 1506 CZ ARG B 6 -20.599 4.465 34.906 1.00 35.30 C ATOM 1507 NH1 ARG B 6 -19.644 3.658 34.459 1.00 40.04 N ATOM 1508 NH2 ARG B 6 -21.512 4.011 35.750 1.00 43.55 N ATOM 1509 HE ARG B 6 -21.466 6.301 34.797 1.00 0.00 H ATOM 1510 HH12 ARG B 6 -19.594 2.675 34.796 1.00 0.00 H ATOM 1511 HH11 ARG B 6 -18.946 4.009 33.772 1.00 0.00 H ATOM 1512 HH22 ARG B 6 -21.465 3.029 36.088 1.00 0.00 H ATOM 1513 HH21 ARG B 6 -22.277 4.637 36.075 1.00 0.00 H ATOM 1514 H ARG B 6 -15.098 8.203 32.961 1.00 0.00 H ATOM 1515 N GLU B 7 -14.937 5.514 34.848 1.00 18.46 N ATOM 1516 CA GLU B 7 -14.391 4.319 35.502 1.00 21.11 C ATOM 1517 C GLU B 7 -13.581 4.719 36.740 1.00 22.31 C ATOM 1518 O GLU B 7 -13.618 4.017 37.752 1.00 20.61 O ATOM 1519 CB GLU B 7 -13.498 3.521 34.547 1.00 27.15 C ATOM 1520 CG GLU B 7 -14.225 2.910 33.372 1.00 36.07 C ATOM 1521 CD GLU B 7 -13.339 1.968 32.574 1.00 59.62 C ATOM 1522 OE1 GLU B 7 -13.644 1.740 31.384 1.00 67.26 O ATOM 1523 OE2 GLU B 7 -12.343 1.452 33.135 1.00 65.67 O ATOM 1524 H GLU B 7 -14.687 5.713 33.858 1.00 0.00 H ATOM 1525 N LEU B 8 -12.829 5.817 36.635 1.00 17.43 N ATOM 1526 CA LEU B 8 -11.996 6.288 37.736 1.00 19.33 C ATOM 1527 C LEU B 8 -12.905 6.692 38.893 1.00 24.10 C ATOM 1528 O LEU B 8 -12.609 6.417 40.045 1.00 19.51 O ATOM 1529 CB LEU B 8 -11.104 7.457 37.314 1.00 20.67 C ATOM 1530 CG LEU B 8 -9.921 7.006 36.453 1.00 19.94 C ATOM 1531 CD1 LEU B 8 -9.115 8.197 35.932 1.00 20.99 C ATOM 1532 CD2 LEU B 8 -9.043 5.910 37.094 1.00 18.27 C ATOM 1533 H LEU B 8 -12.837 6.352 35.743 1.00 0.00 H ATOM 1534 N VAL B 9 -13.987 7.401 38.583 1.00 19.36 N ATOM 1535 CA VAL B 9 -14.919 7.803 39.617 1.00 19.27 C ATOM 1536 C VAL B 9 -15.477 6.589 40.341 1.00 22.97 C ATOM 1537 O VAL B 9 -15.429 6.518 41.563 1.00 20.55 O ATOM 1538 CB VAL B 9 -16.086 8.610 39.041 1.00 17.98 C ATOM 1539 CG1 VAL B 9 -17.190 8.800 40.089 1.00 19.90 C ATOM 1540 CG2 VAL B 9 -15.592 9.970 38.545 1.00 18.16 C ATOM 1541 H VAL B 9 -14.165 7.668 37.594 1.00 0.00 H ATOM 1542 N VAL B 10 -15.973 5.615 39.584 1.00 16.68 N ATOM 1543 CA VAL B 10 -16.607 4.455 40.211 1.00 18.33 C ATOM 1544 C VAL B 10 -15.584 3.671 41.014 1.00 22.49 C ATOM 1545 O VAL B 10 -15.861 3.236 42.131 1.00 21.89 O ATOM 1546 CB VAL B 10 -17.277 3.550 39.164 1.00 22.23 C ATOM 1547 CG1 VAL B 10 -17.711 2.202 39.779 1.00 24.78 C ATOM 1548 CG2 VAL B 10 -18.473 4.279 38.551 1.00 23.91 C ATOM 1549 H VAL B 10 -15.910 5.678 38.548 1.00 0.00 H ATOM 1550 N ASP B 11 -14.388 3.514 40.469 1.00 17.86 N ATOM 1551 CA ASP B 11 -13.366 2.759 41.205 1.00 19.46 C ATOM 1552 C ASP B 11 -12.965 3.460 42.505 1.00 25.52 C ATOM 1553 O ASP B 11 -12.858 2.832 43.568 1.00 23.50 O ATOM 1554 CB ASP B 11 -12.133 2.526 40.339 1.00 22.63 C ATOM 1555 CG ASP B 11 -11.052 1.765 41.083 1.00 29.20 C ATOM 1556 OD1 ASP B 11 -11.141 0.519 41.118 1.00 27.94 O ATOM 1557 OD2 ASP B 11 -10.129 2.400 41.640 1.00 25.95 O ATOM 1558 H ASP B 11 -14.176 3.919 39.535 1.00 0.00 H ATOM 1559 N PHE B 12 -12.745 4.765 42.415 1.00 19.83 N ATOM 1560 CA PHE B 12 -12.254 5.524 43.558 1.00 22.15 C ATOM 1561 C PHE B 12 -13.293 5.564 44.676 1.00 20.57 C ATOM 1562 O PHE B 12 -12.984 5.337 45.850 1.00 24.05 O ATOM 1563 CB PHE B 12 -11.869 6.946 43.139 1.00 21.08 C ATOM 1564 CG PHE B 12 -11.160 7.700 44.224 1.00 19.37 C ATOM 1565 CD1 PHE B 12 -11.879 8.398 45.183 1.00 22.48 C ATOM 1566 CD2 PHE B 12 -9.773 7.683 44.305 1.00 19.29 C ATOM 1567 CE1 PHE B 12 -11.214 9.093 46.205 1.00 22.26 C ATOM 1568 CE2 PHE B 12 -9.095 8.369 45.332 1.00 26.86 C ATOM 1569 CZ PHE B 12 -9.822 9.075 46.282 1.00 26.07 C ATOM 1570 H PHE B 12 -12.926 5.254 41.515 1.00 0.00 H ATOM 1571 N LEU B 13 -14.536 5.848 44.312 1.00 23.10 N ATOM 1572 CA LEU B 13 -15.591 5.899 45.318 1.00 24.54 C ATOM 1573 C LEU B 13 -15.804 4.528 45.955 1.00 25.96 C ATOM 1574 O LEU B 13 -16.049 4.436 47.147 1.00 26.63 O ATOM 1575 CB LEU B 13 -16.900 6.405 44.721 1.00 26.96 C ATOM 1576 CG LEU B 13 -16.869 7.843 44.207 1.00 18.39 C ATOM 1577 CD1 LEU B 13 -18.250 8.276 43.651 1.00 18.10 C ATOM 1578 CD2 LEU B 13 -16.450 8.754 45.322 1.00 24.88 C ATOM 1579 H LEU B 13 -14.758 6.034 43.313 1.00 0.00 H ATOM 1580 N SER B 14 -15.734 3.469 45.153 1.00 24.44 N ATOM 1581 CA SER B 14 -15.891 2.119 45.696 1.00 30.39 C ATOM 1582 C SER B 14 -14.792 1.830 46.730 1.00 26.56 C ATOM 1583 O SER B 14 -15.044 1.233 47.775 1.00 25.75 O ATOM 1584 CB SER B 14 -15.892 1.065 44.576 1.00 35.65 C ATOM 1585 OG SER B 14 -14.592 0.754 44.108 1.00 51.89 O ATOM 1586 HG SER B 14 -14.166 1.573 43.750 1.00 0.00 H ATOM 1587 H SER B 14 -15.567 3.601 44.135 1.00 0.00 H ATOM 1588 N TYR B 15 -13.574 2.261 46.419 1.00 25.24 N ATOM 1589 CA TYR B 15 -12.424 2.061 47.294 1.00 27.31 C ATOM 1590 C TYR B 15 -12.594 2.808 48.627 1.00 27.46 C ATOM 1591 O TYR B 15 -12.437 2.233 49.711 1.00 26.85 O ATOM 1592 CB TYR B 15 -11.161 2.527 46.568 1.00 30.42 C ATOM 1593 CG TYR B 15 -9.882 2.412 47.373 1.00 25.92 C ATOM 1594 CD1 TYR B 15 -9.434 1.182 47.840 1.00 26.76 C ATOM 1595 CD2 TYR B 15 -9.116 3.537 47.652 1.00 27.26 C ATOM 1596 CE1 TYR B 15 -8.255 1.077 48.567 1.00 32.77 C ATOM 1597 CE2 TYR B 15 -7.958 3.447 48.378 1.00 29.93 C ATOM 1598 CZ TYR B 15 -7.524 2.216 48.833 1.00 28.68 C ATOM 1599 OH TYR B 15 -6.362 2.123 49.548 1.00 29.92 O ATOM 1600 HH TYR B 15 -5.609 2.454 48.997 1.00 0.00 H ATOM 1601 H TYR B 15 -13.435 2.760 45.517 1.00 0.00 H ATOM 1602 N LYS B 16 -12.942 4.089 48.536 1.00 27.64 N ATOM 1603 CA LYS B 16 -13.121 4.925 49.714 1.00 31.83 C ATOM 1604 C LYS B 16 -14.274 4.453 50.581 1.00 33.99 C ATOM 1605 O LYS B 16 -14.191 4.508 51.806 1.00 32.78 O ATOM 1606 CB LYS B 16 -13.345 6.374 49.306 1.00 34.53 C ATOM 1607 CG LYS B 16 -12.120 7.018 48.733 1.00 46.36 C ATOM 1608 CD LYS B 16 -11.057 6.997 49.772 1.00 42.25 C ATOM 1609 CE LYS B 16 -9.654 7.035 49.209 1.00 38.38 C ATOM 1610 NZ LYS B 16 -8.756 6.875 50.388 1.00 26.60 N ATOM 1611 HZ1 LYS B 16 -8.922 7.654 51.057 1.00 0.00 H ATOM 1612 HZ2 LYS B 16 -8.957 5.968 50.855 1.00 0.00 H ATOM 1613 HZ3 LYS B 16 -7.765 6.892 50.072 1.00 0.00 H ATOM 1614 H LYS B 16 -13.091 4.506 47.595 1.00 0.00 H ATOM 1615 N LEU B 17 -15.356 4.011 49.948 1.00 28.89 N ATOM 1616 CA LEU B 17 -16.472 3.457 50.705 1.00 32.40 C ATOM 1617 C LEU B 17 -16.037 2.183 51.440 1.00 28.47 C ATOM 1618 O LEU B 17 -16.366 1.983 52.609 1.00 30.03 O ATOM 1619 CB LEU B 17 -17.655 3.183 49.777 1.00 32.28 C ATOM 1620 CG LEU B 17 -18.394 4.452 49.350 1.00 28.02 C ATOM 1621 CD1 LEU B 17 -19.303 4.173 48.144 1.00 24.21 C ATOM 1622 CD2 LEU B 17 -19.186 5.030 50.514 1.00 27.23 C ATOM 1623 H LEU B 17 -15.407 4.060 48.910 1.00 0.00 H ATOM 1624 N SER B 18 -15.282 1.332 50.756 1.00 28.86 N ATOM 1625 CA SER B 18 -14.885 0.049 51.336 1.00 31.60 C ATOM 1626 C SER B 18 -13.992 0.234 52.555 1.00 32.69 C ATOM 1627 O SER B 18 -14.058 -0.551 53.496 1.00 30.96 O ATOM 1628 CB SER B 18 -14.163 -0.807 50.300 1.00 40.75 C ATOM 1629 OG SER B 18 -12.863 -0.294 50.066 1.00 47.96 O ATOM 1630 HG SER B 18 -12.932 0.635 49.730 1.00 0.00 H ATOM 1631 H SER B 18 -14.969 1.580 49.796 1.00 0.00 H ATOM 1632 N GLN B 19 -13.180 1.291 52.531 1.00 35.11 N ATOM 1633 CA GLN B 19 -12.281 1.616 53.637 1.00 40.71 C ATOM 1634 C GLN B 19 -13.062 1.958 54.898 1.00 38.46 C ATOM 1635 O GLN B 19 -12.570 1.792 56.004 1.00 38.98 O ATOM 1636 CB GLN B 19 -11.375 2.789 53.253 1.00 40.26 C ATOM 1637 CG GLN B 19 -10.244 2.412 52.313 1.00 36.90 C ATOM 1638 CD GLN B 19 -9.408 3.602 51.911 1.00 34.67 C ATOM 1639 OE1 GLN B 19 -9.934 4.687 51.666 1.00 35.53 O ATOM 1640 NE2 GLN B 19 -8.102 3.399 51.809 1.00 32.39 N ATOM 1641 HE22 GLN B 19 -7.703 2.464 52.027 1.00 0.00 H ATOM 1642 HE21 GLN B 19 -7.477 4.175 51.511 1.00 0.00 H ATOM 1643 H GLN B 19 -13.186 1.908 51.694 1.00 0.00 H ATOM 1644 N LYS B 20 -14.286 2.442 54.723 1.00 34.84 N ATOM 1645 CA LYS B 20 -15.147 2.775 55.855 1.00 34.87 C ATOM 1646 C LYS B 20 -16.168 1.677 56.114 1.00 39.35 C ATOM 1647 O LYS B 20 -17.126 1.867 56.861 1.00 46.72 O ATOM 1648 CB LYS B 20 -15.851 4.115 55.641 1.00 41.54 C ATOM 1649 CG LYS B 20 -14.889 5.273 55.476 1.00 43.61 C ATOM 1650 CD LYS B 20 -14.103 5.506 56.771 1.00 51.80 C ATOM 1651 CE LYS B 20 -13.176 6.707 56.633 1.00 58.28 C ATOM 1652 NZ LYS B 20 -12.429 6.976 57.895 1.00 65.40 N ATOM 1653 HZ1 LYS B 20 -13.104 7.170 58.662 1.00 0.00 H ATOM 1654 HZ2 LYS B 20 -11.854 6.145 58.140 1.00 0.00 H ATOM 1655 HZ3 LYS B 20 -11.809 7.800 57.761 1.00 0.00 H ATOM 1656 H LYS B 20 -14.640 2.588 53.756 1.00 0.00 H ATOM 1657 N GLY B 21 -15.955 0.521 55.497 1.00 38.45 N ATOM 1658 CA GLY B 21 -16.824 -0.615 55.731 1.00 39.11 C ATOM 1659 C GLY B 21 -18.110 -0.595 54.918 1.00 37.63 C ATOM 1660 O GLY B 21 -19.036 -1.347 55.218 1.00 37.13 O ATOM 1661 H GLY B 21 -15.155 0.430 54.838 1.00 0.00 H ATOM 1662 N TYR B 22 -18.175 0.244 53.887 1.00 32.11 N ATOM 1663 CA TYR B 22 -19.369 0.274 53.052 1.00 34.92 C ATOM 1664 C TYR B 22 -19.124 -0.464 51.735 1.00 37.45 C ATOM 1665 O TYR B 22 -18.000 -0.500 51.250 1.00 42.70 O ATOM 1666 CB TYR B 22 -19.769 1.727 52.803 1.00 31.39 C ATOM 1667 CG TYR B 22 -20.150 2.471 54.073 1.00 34.93 C ATOM 1668 CD1 TYR B 22 -20.865 1.839 55.080 1.00 35.38 C ATOM 1669 CD2 TYR B 22 -19.761 3.792 54.272 1.00 38.50 C ATOM 1670 CE1 TYR B 22 -21.218 2.511 56.237 1.00 42.37 C ATOM 1671 CE2 TYR B 22 -20.103 4.474 55.427 1.00 32.60 C ATOM 1672 CZ TYR B 22 -20.830 3.830 56.406 1.00 41.64 C ATOM 1673 OH TYR B 22 -21.168 4.501 57.561 1.00 48.44 O ATOM 1674 HH TYR B 22 -21.718 5.292 57.333 1.00 0.00 H ATOM 1675 H TYR B 22 -17.376 0.876 53.678 1.00 0.00 H ATOM 1676 N SER B 23 -20.179 -0.904 51.060 1.00 37.14 N ATOM 1677 CA SER B 23 -19.959 -1.712 49.865 1.00 31.30 C ATOM 1678 C SER B 23 -20.641 -1.142 48.642 1.00 30.07 C ATOM 1679 O SER B 23 -21.866 -1.197 48.515 1.00 32.03 O ATOM 1680 CB SER B 23 -20.486 -3.131 50.075 1.00 33.14 C ATOM 1681 OG SER B 23 -19.747 -3.830 51.059 1.00 37.63 O ATOM 1682 HG SER B 23 -19.807 -3.346 51.921 1.00 0.00 H ATOM 1683 H SER B 23 -21.143 -0.677 51.377 1.00 0.00 H ATOM 1684 N TRP B 24 -19.824 -0.613 47.742 1.00 30.47 N ATOM 1685 CA TRP B 24 -20.275 -0.182 46.423 1.00 34.01 C ATOM 1686 C TRP B 24 -20.832 -1.392 45.681 1.00 33.04 C ATOM 1687 O TRP B 24 -21.877 -1.325 45.034 1.00 28.25 O ATOM 1688 CB TRP B 24 -19.131 0.423 45.625 1.00 30.97 C ATOM 1689 CG TRP B 24 -19.502 0.805 44.224 1.00 26.75 C ATOM 1690 CD1 TRP B 24 -19.435 0.028 43.106 1.00 28.42 C ATOM 1691 CD2 TRP B 24 -19.909 2.109 43.785 1.00 29.97 C ATOM 1692 NE1 TRP B 24 -19.835 0.755 41.999 1.00 31.52 N ATOM 1693 CE2 TRP B 24 -20.115 2.039 42.389 1.00 31.19 C ATOM 1694 CE3 TRP B 24 -20.134 3.326 44.440 1.00 33.21 C ATOM 1695 CZ2 TRP B 24 -20.549 3.138 41.635 1.00 27.98 C ATOM 1696 CZ3 TRP B 24 -20.564 4.424 43.684 1.00 32.42 C ATOM 1697 CH2 TRP B 24 -20.762 4.319 42.300 1.00 31.04 C ATOM 1698 HE1 TRP B 24 -19.911 0.387 41.029 1.00 0.00 H ATOM 1699 H TRP B 24 -18.819 -0.500 47.986 1.00 0.00 H ATOM 1700 N SER B 25 -20.086 -2.497 45.758 1.00 28.93 N ATOM 1701 CA SER B 25 -20.476 -3.715 45.074 1.00 33.99 C ATOM 1702 C SER B 25 -20.837 -4.788 46.082 1.00 38.48 C ATOM 1703 O SER B 25 -20.326 -4.788 47.197 1.00 37.09 O ATOM 1704 CB SER B 25 -19.325 -4.175 44.174 1.00 40.48 C ATOM 1705 OG SER B 25 -19.285 -5.580 44.055 1.00 46.79 O ATOM 1706 HG SER B 25 -18.531 -5.839 43.468 1.00 0.00 H ATOM 1707 H SER B 25 -19.210 -2.484 46.318 1.00 0.00 H ATOM 1708 N GLN B 26 -21.644 -5.755 45.662 1.00 36.22 N ATOM 1709 CA GLN B 26 -22.045 -6.822 46.559 1.00 44.47 C ATOM 1710 C GLN B 26 -20.841 -7.687 46.917 1.00 46.73 C ATOM 1711 O GLN B 26 -20.755 -8.241 48.009 1.00 44.00 O ATOM 1712 CB GLN B 26 -23.148 -7.667 45.920 1.00 54.80 C ATOM 1713 CG GLN B 26 -23.577 -8.857 46.751 1.00 69.08 C ATOM 1714 CD GLN B 26 -24.110 -8.436 48.108 1.00 77.76 C ATOM 1715 OE1 GLN B 26 -24.888 -7.485 48.211 1.00 83.67 O ATOM 1716 NE2 GLN B 26 -23.691 -9.136 49.155 1.00 80.08 N ATOM 1717 HE22 GLN B 26 -23.034 -9.931 49.020 1.00 0.00 H ATOM 1718 HE21 GLN B 26 -24.020 -8.890 50.110 1.00 0.00 H ATOM 1719 H GLN B 26 -21.991 -5.747 44.682 1.00 0.00 H ATOM 1720 N MET B 83 -19.926 -7.807 45.963 1.00 40.99 N ATOM 1721 CA MET B 83 -18.710 -8.585 46.131 1.00 42.05 C ATOM 1722 C MET B 83 -17.618 -7.874 46.957 1.00 43.62 C ATOM 1723 O MET B 83 -16.490 -8.377 47.044 1.00 42.19 O ATOM 1724 CB MET B 83 -18.157 -8.942 44.748 1.00 42.72 C ATOM 1725 CG MET B 83 -19.032 -9.934 43.985 1.00 45.72 C ATOM 1726 SD MET B 83 -19.238 -11.558 44.719 1.00 57.55 S ATOM 1727 CE MET B 83 -17.566 -12.199 44.662 1.00 53.28 C ATOM 1728 H MET B 83 -20.086 -7.323 45.056 1.00 0.00 H ATOM 1729 N ALA B 84 -17.931 -6.735 47.578 1.00 49.19 N ATOM 1730 CA ALA B 84 -16.876 -5.968 48.249 1.00 44.99 C ATOM 1731 C ALA B 84 -16.184 -6.713 49.400 1.00 47.02 C ATOM 1732 O ALA B 84 -14.955 -6.771 49.440 1.00 41.97 O ATOM 1733 CB ALA B 84 -17.447 -4.643 48.764 1.00 48.57 C ATOM 1734 H ALA B 84 -18.914 -6.394 47.586 1.00 0.00 H ATOM 1735 N ALA B 85 -16.958 -7.352 50.271 1.00 48.26 N ATOM 1736 CA ALA B 85 -16.388 -8.101 51.393 1.00 45.63 C ATOM 1737 C ALA B 85 -15.597 -9.309 50.911 1.00 48.61 C ATOM 1738 O ALA B 85 -14.519 -9.613 51.435 1.00 46.06 O ATOM 1739 CB ALA B 85 -17.483 -8.533 52.355 1.00 48.88 C ATOM 1740 H ALA B 85 -17.991 -7.319 50.153 1.00 0.00 H ATOM 1741 N VAL B 86 -16.135 -9.991 49.902 1.00 44.20 N ATOM 1742 CA VAL B 86 -15.504 -11.190 49.361 1.00 39.15 C ATOM 1743 C VAL B 86 -14.147 -10.888 48.752 1.00 37.36 C ATOM 1744 O VAL B 86 -13.186 -11.601 48.998 1.00 36.88 O ATOM 1745 CB VAL B 86 -16.392 -11.868 48.285 1.00 43.92 C ATOM 1746 CG1 VAL B 86 -15.704 -13.128 47.729 1.00 36.76 C ATOM 1747 CG2 VAL B 86 -17.762 -12.203 48.862 1.00 49.04 C ATOM 1748 H VAL B 86 -17.030 -9.660 49.488 1.00 0.00 H ATOM 1749 N LYS B 87 -14.072 -9.835 47.949 1.00 37.00 N ATOM 1750 CA LYS B 87 -12.806 -9.442 47.337 1.00 38.06 C ATOM 1751 C LYS B 87 -11.701 -9.223 48.366 1.00 36.93 C ATOM 1752 O LYS B 87 -10.583 -9.711 48.213 1.00 39.15 O ATOM 1753 CB LYS B 87 -12.973 -8.148 46.562 1.00 34.31 C ATOM 1754 CG LYS B 87 -13.768 -8.199 45.295 1.00 46.09 C ATOM 1755 CD LYS B 87 -13.867 -6.750 44.856 1.00 50.00 C ATOM 1756 CE LYS B 87 -14.625 -6.575 43.609 1.00 53.22 C ATOM 1757 NZ LYS B 87 -14.780 -5.125 43.296 1.00 55.84 N ATOM 1758 HZ1 LYS B 87 -15.290 -4.657 44.072 1.00 0.00 H ATOM 1759 HZ2 LYS B 87 -13.840 -4.693 43.186 1.00 0.00 H ATOM 1760 HZ3 LYS B 87 -15.318 -5.018 42.412 1.00 0.00 H ATOM 1761 H LYS B 87 -14.929 -9.280 47.752 1.00 0.00 H ATOM 1762 N GLN B 88 -12.035 -8.466 49.404 1.00 40.52 N ATOM 1763 CA GLN B 88 -11.064 -8.102 50.427 1.00 43.60 C ATOM 1764 C GLN B 88 -10.626 -9.330 51.209 1.00 44.03 C ATOM 1765 O GLN B 88 -9.439 -9.516 51.487 1.00 41.62 O ATOM 1766 CB GLN B 88 -11.644 -7.049 51.367 1.00 48.74 C ATOM 1767 CG GLN B 88 -10.646 -6.529 52.400 1.00 59.12 C ATOM 1768 CD GLN B 88 -9.433 -5.865 51.761 1.00 65.05 C ATOM 1769 OE1 GLN B 88 -9.522 -5.292 50.671 1.00 63.01 O ATOM 1770 NE2 GLN B 88 -8.290 -5.944 52.437 1.00 67.51 N ATOM 1771 HE22 GLN B 88 -8.260 -6.437 53.352 1.00 0.00 H ATOM 1772 HE21 GLN B 88 -7.426 -5.513 52.050 1.00 0.00 H ATOM 1773 H GLN B 88 -13.014 -8.125 49.489 1.00 0.00 H ATOM 1774 N ALA B 89 -11.594 -10.168 51.564 1.00 44.22 N ATOM 1775 CA ALA B 89 -11.299 -11.390 52.293 1.00 41.59 C ATOM 1776 C ALA B 89 -10.421 -12.301 51.454 1.00 41.10 C ATOM 1777 O ALA B 89 -9.508 -12.933 51.969 1.00 39.91 O ATOM 1778 CB ALA B 89 -12.579 -12.101 52.693 1.00 39.51 C ATOM 1779 H ALA B 89 -12.579 -9.946 51.316 1.00 0.00 H ATOM 1780 N LEU B 90 -10.699 -12.370 50.156 1.00 36.99 N ATOM 1781 CA LEU B 90 -9.933 -13.251 49.285 1.00 34.00 C ATOM 1782 C LEU B 90 -8.506 -12.725 49.080 1.00 32.79 C ATOM 1783 O LEU B 90 -7.554 -13.513 49.093 1.00 34.24 O ATOM 1784 CB LEU B 90 -10.649 -13.445 47.948 1.00 33.61 C ATOM 1785 CG LEU B 90 -10.048 -14.516 47.035 1.00 30.35 C ATOM 1786 CD1 LEU B 90 -9.963 -15.858 47.759 1.00 26.03 C ATOM 1787 CD2 LEU B 90 -10.885 -14.628 45.769 1.00 30.94 C ATOM 1788 H LEU B 90 -11.468 -11.792 49.760 1.00 0.00 H ATOM 1789 N ARG B 91 -8.359 -11.410 48.921 1.00 31.55 N ATOM 1790 CA ARG B 91 -7.035 -10.779 48.845 1.00 33.88 C ATOM 1791 C ARG B 91 -6.186 -11.134 50.059 1.00 33.86 C ATOM 1792 O ARG B 91 -5.031 -11.542 49.933 1.00 34.17 O ATOM 1793 CB ARG B 91 -7.132 -9.254 48.762 1.00 32.43 C ATOM 1794 CG ARG B 91 -7.608 -8.670 47.428 1.00 35.11 C ATOM 1795 CD ARG B 91 -7.559 -7.150 47.462 1.00 38.90 C ATOM 1796 NE ARG B 91 -7.848 -6.567 46.150 1.00 47.01 N ATOM 1797 CZ ARG B 91 -7.525 -5.333 45.770 1.00 52.57 C ATOM 1798 NH1 ARG B 91 -6.897 -4.503 46.598 1.00 52.96 N ATOM 1799 NH2 ARG B 91 -7.836 -4.922 44.549 1.00 56.41 N ATOM 1800 HE ARG B 91 -8.346 -7.165 45.460 1.00 0.00 H ATOM 1801 HH12 ARG B 91 -6.652 -3.542 46.284 1.00 0.00 H ATOM 1802 HH11 ARG B 91 -6.651 -4.815 47.559 1.00 0.00 H ATOM 1803 HH22 ARG B 91 -7.587 -3.959 44.245 1.00 0.00 H ATOM 1804 HH21 ARG B 91 -8.329 -5.562 43.895 1.00 0.00 H ATOM 1805 H ARG B 91 -9.207 -10.813 48.849 1.00 0.00 H ATOM 1806 N GLU B 92 -6.774 -10.959 51.238 1.00 36.00 N ATOM 1807 CA GLU B 92 -6.063 -11.194 52.483 1.00 33.22 C ATOM 1808 C GLU B 92 -5.709 -12.667 52.640 1.00 39.22 C ATOM 1809 O GLU B 92 -4.624 -12.994 53.115 1.00 35.10 O ATOM 1810 CB GLU B 92 -6.908 -10.736 53.664 1.00 43.72 C ATOM 1811 CG GLU B 92 -7.151 -9.248 53.670 1.00 52.88 C ATOM 1812 CD GLU B 92 -8.203 -8.831 54.669 1.00 57.28 C ATOM 1813 OE1 GLU B 92 -8.849 -9.711 55.278 1.00 62.08 O ATOM 1814 OE2 GLU B 92 -8.400 -7.613 54.817 1.00 57.91 O ATOM 1815 H GLU B 92 -7.766 -10.647 51.270 1.00 0.00 H ATOM 1816 N ALA B 93 -6.618 -13.551 52.227 1.00 33.71 N ATOM 1817 CA ALA B 93 -6.386 -14.995 52.322 1.00 36.26 C ATOM 1818 C ALA B 93 -5.284 -15.449 51.369 1.00 35.75 C ATOM 1819 O ALA B 93 -4.434 -16.276 51.729 1.00 29.57 O ATOM 1820 CB ALA B 93 -7.675 -15.763 52.044 1.00 34.57 C ATOM 1821 H ALA B 93 -7.514 -13.207 51.827 1.00 0.00 H ATOM 1822 N GLY B 94 -5.303 -14.896 50.157 1.00 31.27 N ATOM 1823 CA GLY B 94 -4.271 -15.167 49.170 1.00 27.02 C ATOM 1824 C GLY B 94 -2.911 -14.780 49.745 1.00 28.06 C ATOM 1825 O GLY B 94 -1.968 -15.561 49.669 1.00 28.93 O ATOM 1826 H GLY B 94 -6.080 -14.251 49.910 1.00 0.00 H ATOM 1827 N ASP B 95 -2.826 -13.591 50.344 1.00 26.38 N ATOM 1828 CA ASP B 95 -1.585 -13.140 50.989 1.00 28.16 C ATOM 1829 C ASP B 95 -1.106 -14.122 52.070 1.00 32.80 C ATOM 1830 O ASP B 95 0.082 -14.465 52.142 1.00 33.21 O ATOM 1831 CB ASP B 95 -1.768 -11.749 51.615 1.00 30.83 C ATOM 1832 CG ASP B 95 -1.844 -10.644 50.574 1.00 37.04 C ATOM 1833 OD1 ASP B 95 -1.408 -10.877 49.428 1.00 37.19 O ATOM 1834 OD2 ASP B 95 -2.350 -9.551 50.898 1.00 36.45 O ATOM 1835 H ASP B 95 -3.659 -12.968 50.355 1.00 0.00 H ATOM 1836 N GLU B 96 -2.032 -14.561 52.913 1.00 32.93 N ATOM 1837 CA GLU B 96 -1.682 -15.454 54.014 1.00 35.73 C ATOM 1838 C GLU B 96 -1.239 -16.818 53.489 1.00 35.84 C ATOM 1839 O GLU B 96 -0.287 -17.411 54.005 1.00 36.75 O ATOM 1840 CB GLU B 96 -2.863 -15.596 54.975 1.00 36.30 C ATOM 1841 CG GLU B 96 -2.617 -16.518 56.170 1.00 43.76 C ATOM 1842 CD GLU B 96 -1.710 -15.919 57.252 1.00 46.73 C ATOM 1843 OE1 GLU B 96 -1.241 -14.758 57.127 1.00 44.77 O ATOM 1844 OE2 GLU B 96 -1.486 -16.621 58.258 1.00 57.61 O ATOM 1845 H GLU B 96 -3.021 -14.265 52.788 1.00 0.00 H ATOM 1846 N PHE B 97 -1.930 -17.312 52.462 1.00 34.56 N ATOM 1847 CA PHE B 97 -1.555 -18.592 51.862 1.00 34.44 C ATOM 1848 C PHE B 97 -0.131 -18.548 51.311 1.00 34.17 C ATOM 1849 O PHE B 97 0.686 -19.438 51.547 1.00 31.84 O ATOM 1850 CB PHE B 97 -2.514 -18.969 50.732 1.00 29.11 C ATOM 1851 CG PHE B 97 -2.138 -20.257 50.034 1.00 30.22 C ATOM 1852 CD1 PHE B 97 -1.488 -20.238 48.809 1.00 26.45 C ATOM 1853 CD2 PHE B 97 -2.384 -21.480 50.640 1.00 31.32 C ATOM 1854 CE1 PHE B 97 -1.128 -21.437 48.178 1.00 26.27 C ATOM 1855 CE2 PHE B 97 -2.025 -22.675 50.026 1.00 26.29 C ATOM 1856 CZ PHE B 97 -1.388 -22.651 48.800 1.00 26.92 C ATOM 1857 H PHE B 97 -2.742 -16.783 52.084 1.00 0.00 H ATOM 1858 N GLU B 98 0.155 -17.491 50.566 1.00 32.82 N ATOM 1859 CA GLU B 98 1.446 -17.347 49.921 1.00 31.47 C ATOM 1860 C GLU B 98 2.552 -17.149 50.949 1.00 33.36 C ATOM 1861 O GLU B 98 3.670 -17.653 50.780 1.00 36.50 O ATOM 1862 CB GLU B 98 1.397 -16.187 48.920 1.00 30.08 C ATOM 1863 CG GLU B 98 0.520 -16.510 47.729 1.00 25.49 C ATOM 1864 CD GLU B 98 -0.031 -15.290 47.025 1.00 28.38 C ATOM 1865 OE1 GLU B 98 0.502 -14.170 47.208 1.00 29.51 O ATOM 1866 OE2 GLU B 98 -1.008 -15.469 46.276 1.00 28.13 O ATOM 1867 H GLU B 98 -0.562 -16.748 50.441 1.00 0.00 H ATOM 1868 N LEU B 99 2.243 -16.432 52.025 1.00 29.59 N ATOM 1869 CA LEU B 99 3.251 -16.153 53.030 1.00 35.28 C ATOM 1870 C LEU B 99 3.581 -17.374 53.884 1.00 37.36 C ATOM 1871 O LEU B 99 4.746 -17.583 54.228 1.00 38.34 O ATOM 1872 CB LEU B 99 2.790 -15.012 53.938 1.00 37.26 C ATOM 1873 CG LEU B 99 3.709 -14.628 55.106 1.00 47.74 C ATOM 1874 CD1 LEU B 99 4.965 -13.935 54.607 1.00 52.02 C ATOM 1875 CD2 LEU B 99 2.984 -13.757 56.133 1.00 51.90 C ATOM 1876 H LEU B 99 1.276 -16.070 52.147 1.00 0.00 H ATOM 1877 N ARG B 100 2.598 -18.221 54.187 1.00 33.86 N ATOM 1878 CA ARG B 100 2.889 -19.260 55.183 1.00 34.50 C ATOM 1879 C ARG B 100 2.633 -20.695 54.717 1.00 39.00 C ATOM 1880 O ARG B 100 3.187 -21.628 55.290 1.00 36.81 O ATOM 1881 CB ARG B 100 2.084 -18.993 56.463 1.00 45.87 C ATOM 1882 CG ARG B 100 2.133 -17.535 56.879 1.00 67.01 C ATOM 1883 CD ARG B 100 2.818 -17.317 58.216 1.00 87.54 C ATOM 1884 NE ARG B 100 2.813 -15.903 58.593 1.00 96.15 N ATOM 1885 CZ ARG B 100 1.901 -15.329 59.372 1.00 97.61 C ATOM 1886 NH1 ARG B 100 0.909 -16.047 59.882 1.00 93.14 N ATOM 1887 NH2 ARG B 100 1.983 -14.033 59.642 1.00101.58 N ATOM 1888 HE ARG B 100 3.579 -15.303 58.225 1.00 0.00 H ATOM 1889 HH12 ARG B 100 0.198 -15.593 60.491 1.00 0.00 H ATOM 1890 HH11 ARG B 100 0.842 -17.064 59.673 1.00 0.00 H ATOM 1891 HH22 ARG B 100 1.270 -13.583 60.251 1.00 0.00 H ATOM 1892 HH21 ARG B 100 2.760 -13.467 59.245 1.00 0.00 H ATOM 1893 H ARG B 100 1.663 -18.149 53.737 1.00 0.00 H ATOM 1894 N TYR B 101 1.844 -20.896 53.673 1.00 33.11 N ATOM 1895 CA TYR B 101 1.412 -22.267 53.376 1.00 33.53 C ATOM 1896 C TYR B 101 1.830 -22.801 52.008 1.00 34.90 C ATOM 1897 O TYR B 101 1.992 -24.013 51.861 1.00 30.70 O ATOM 1898 CB TYR B 101 -0.111 -22.374 53.525 1.00 33.43 C ATOM 1899 CG TYR B 101 -0.598 -22.040 54.932 1.00 33.28 C ATOM 1900 CD1 TYR B 101 -0.455 -22.939 55.979 1.00 44.43 C ATOM 1901 CD2 TYR B 101 -1.223 -20.821 55.196 1.00 32.87 C ATOM 1902 CE1 TYR B 101 -0.896 -22.621 57.259 1.00 53.26 C ATOM 1903 CE2 TYR B 101 -1.670 -20.501 56.448 1.00 41.33 C ATOM 1904 CZ TYR B 101 -1.504 -21.399 57.487 1.00 48.89 C ATOM 1905 OH TYR B 101 -1.952 -21.074 58.749 1.00 49.29 O ATOM 1906 HH TYR B 101 -1.492 -20.255 59.061 1.00 0.00 H ATOM 1907 H TYR B 101 1.537 -20.101 53.077 1.00 0.00 H ATOM 1908 N ARG B 102 1.963 -21.927 51.006 1.00 32.50 N ATOM 1909 CA ARG B 102 2.303 -22.341 49.640 1.00 30.41 C ATOM 1910 C ARG B 102 3.545 -23.237 49.633 1.00 29.71 C ATOM 1911 O ARG B 102 3.620 -24.221 48.905 1.00 29.37 O ATOM 1912 CB ARG B 102 2.547 -21.124 48.740 1.00 30.83 C ATOM 1913 CG ARG B 102 2.922 -21.483 47.309 1.00 33.57 C ATOM 1914 CD ARG B 102 3.311 -20.235 46.481 1.00 44.37 C ATOM 1915 NE ARG B 102 4.167 -20.591 45.343 1.00 50.66 N ATOM 1916 CZ ARG B 102 4.445 -19.796 44.309 1.00 50.99 C ATOM 1917 NH1 ARG B 102 5.223 -20.238 43.326 1.00 47.43 N ATOM 1918 NH2 ARG B 102 3.962 -18.557 44.255 1.00 39.17 N ATOM 1919 HE ARG B 102 4.591 -21.541 45.343 1.00 0.00 H ATOM 1920 HH12 ARG B 102 5.442 -19.620 42.518 1.00 0.00 H ATOM 1921 HH11 ARG B 102 5.613 -21.201 43.365 1.00 0.00 H ATOM 1922 HH22 ARG B 102 4.186 -17.947 43.443 1.00 0.00 H ATOM 1923 HH21 ARG B 102 3.361 -18.199 45.024 1.00 0.00 H ATOM 1924 H ARG B 102 1.820 -20.916 51.202 1.00 0.00 H ATOM 1925 N ARG B 103 4.521 -22.877 50.455 1.00 28.42 N ATOM 1926 CA ARG B 103 5.789 -23.586 50.537 1.00 28.36 C ATOM 1927 C ARG B 103 5.659 -25.096 50.800 1.00 28.04 C ATOM 1928 O ARG B 103 6.569 -25.866 50.506 1.00 29.70 O ATOM 1929 CB ARG B 103 6.617 -22.929 51.644 1.00 31.44 C ATOM 1930 CG ARG B 103 5.961 -23.062 53.022 1.00 31.94 C ATOM 1931 CD ARG B 103 6.704 -22.249 54.077 1.00 39.44 C ATOM 1932 NE ARG B 103 8.065 -22.679 54.338 1.00 42.69 N ATOM 1933 CZ ARG B 103 9.013 -21.851 54.759 1.00 51.69 C ATOM 1934 NH1 ARG B 103 8.730 -20.557 54.879 1.00 43.58 N ATOM 1935 NH2 ARG B 103 10.241 -22.296 55.016 1.00 47.06 N ATOM 1936 HE ARG B 103 8.308 -23.679 54.189 1.00 0.00 H ATOM 1937 HH12 ARG B 103 9.460 -19.893 55.207 1.00 0.00 H ATOM 1938 HH11 ARG B 103 7.778 -20.209 54.644 1.00 0.00 H ATOM 1939 HH22 ARG B 103 10.975 -21.637 55.345 1.00 0.00 H ATOM 1940 HH21 ARG B 103 10.467 -23.303 54.887 1.00 0.00 H ATOM 1941 H ARG B 103 4.374 -22.051 51.069 1.00 0.00 H ATOM 1942 N ALA B 104 4.547 -25.518 51.384 1.00 27.79 N ATOM 1943 CA ALA B 104 4.400 -26.922 51.762 1.00 28.85 C ATOM 1944 C ALA B 104 4.023 -27.814 50.583 1.00 27.38 C ATOM 1945 O ALA B 104 4.187 -29.046 50.619 1.00 28.36 O ATOM 1946 CB ALA B 104 3.361 -27.055 52.853 1.00 33.20 C ATOM 1947 H ALA B 104 3.775 -24.847 51.574 1.00 0.00 H ATOM 1948 N PHE B 105 3.567 -27.185 49.518 1.00 27.97 N ATOM 1949 CA PHE B 105 2.899 -27.955 48.469 1.00 29.07 C ATOM 1950 C PHE B 105 3.680 -28.068 47.168 1.00 30.54 C ATOM 1951 O PHE B 105 4.618 -27.316 46.919 1.00 31.65 O ATOM 1952 CB PHE B 105 1.506 -27.348 48.204 1.00 25.09 C ATOM 1953 CG PHE B 105 0.618 -27.344 49.422 1.00 26.87 C ATOM 1954 CD1 PHE B 105 0.374 -26.172 50.121 1.00 27.51 C ATOM 1955 CD2 PHE B 105 0.058 -28.527 49.882 1.00 27.07 C ATOM 1956 CE1 PHE B 105 -0.420 -26.181 51.261 1.00 26.95 C ATOM 1957 CE2 PHE B 105 -0.732 -28.556 51.027 1.00 31.30 C ATOM 1958 CZ PHE B 105 -0.980 -27.374 51.713 1.00 27.83 C ATOM 1959 H PHE B 105 3.681 -26.155 49.425 1.00 0.00 H ATOM 1960 N SER B 106 3.314 -29.063 46.368 1.00 27.52 N ATOM 1961 CA SER B 106 3.856 -29.196 45.029 1.00 29.80 C ATOM 1962 C SER B 106 3.564 -27.911 44.253 1.00 24.03 C ATOM 1963 O SER B 106 2.451 -27.397 44.271 1.00 25.93 O ATOM 1964 CB SER B 106 3.272 -30.414 44.314 1.00 31.43 C ATOM 1965 OG SER B 106 3.885 -30.573 43.054 1.00 35.35 O ATOM 1966 HG SER B 106 3.724 -29.765 42.506 1.00 0.00 H ATOM 1967 H SER B 106 2.624 -29.762 46.709 1.00 0.00 H ATOM 1968 N ASP B 107 4.585 -27.388 43.593 1.00 27.93 N ATOM 1969 CA ASP B 107 4.463 -26.146 42.838 1.00 27.74 C ATOM 1970 C ASP B 107 3.649 -26.366 41.566 1.00 27.58 C ATOM 1971 O ASP B 107 4.131 -26.958 40.601 1.00 27.89 O ATOM 1972 CB ASP B 107 5.859 -25.614 42.487 1.00 28.50 C ATOM 1973 CG ASP B 107 5.828 -24.216 41.883 1.00 35.05 C ATOM 1974 OD1 ASP B 107 4.795 -23.805 41.314 1.00 32.75 O ATOM 1975 OD2 ASP B 107 6.856 -23.520 41.980 1.00 35.24 O ATOM 1976 H ASP B 107 5.502 -27.878 43.613 1.00 0.00 H ATOM 1977 N LEU B 108 2.418 -25.888 41.564 1.00 23.97 N ATOM 1978 CA LEU B 108 1.552 -26.107 40.399 1.00 27.31 C ATOM 1979 C LEU B 108 2.026 -25.342 39.155 1.00 26.56 C ATOM 1980 O LEU B 108 1.694 -25.714 38.030 1.00 25.73 O ATOM 1981 CB LEU B 108 0.115 -25.713 40.740 1.00 20.77 C ATOM 1982 CG LEU B 108 -0.591 -26.578 41.782 1.00 33.43 C ATOM 1983 CD1 LEU B 108 -1.912 -25.946 42.173 1.00 32.91 C ATOM 1984 CD2 LEU B 108 -0.771 -28.021 41.296 1.00 31.63 C ATOM 1985 H LEU B 108 2.063 -25.358 42.385 1.00 0.00 H ATOM 1986 N THR B 109 2.787 -24.267 39.332 1.00 26.63 N ATOM 1987 CA THR B 109 3.289 -23.552 38.151 1.00 28.62 C ATOM 1988 C THR B 109 4.332 -24.400 37.414 1.00 34.08 C ATOM 1989 O THR B 109 4.481 -24.297 36.193 1.00 35.31 O ATOM 1990 CB THR B 109 3.897 -22.181 38.512 1.00 30.25 C ATOM 1991 OG1 THR B 109 5.046 -22.372 39.344 1.00 35.71 O ATOM 1992 CG2 THR B 109 2.874 -21.322 39.247 1.00 24.01 C ATOM 1993 HG1 THR B 109 4.777 -22.843 40.172 1.00 0.00 H ATOM 1994 H THR B 109 3.023 -23.938 40.290 1.00 0.00 H ATOM 1995 N SER B 110 5.036 -25.257 38.150 1.00 34.53 N ATOM 1996 CA SER B 110 5.965 -26.197 37.529 1.00 27.41 C ATOM 1997 C SER B 110 5.206 -27.303 36.797 1.00 32.65 C ATOM 1998 O SER B 110 5.654 -27.801 35.763 1.00 35.95 O ATOM 1999 CB SER B 110 6.902 -26.811 38.575 1.00 34.58 C ATOM 2000 OG SER B 110 7.676 -25.801 39.188 1.00 41.61 O ATOM 2001 HG SER B 110 8.276 -26.210 39.861 1.00 0.00 H ATOM 2002 H SER B 110 4.923 -25.257 39.184 1.00 0.00 H ATOM 2003 N GLN B 111 4.035 -27.670 37.306 1.00 26.64 N ATOM 2004 CA GLN B 111 3.285 -28.741 36.660 1.00 27.58 C ATOM 2005 C GLN B 111 2.622 -28.256 35.377 1.00 34.48 C ATOM 2006 O GLN B 111 2.394 -29.051 34.458 1.00 34.02 O ATOM 2007 CB GLN B 111 2.209 -29.307 37.580 1.00 29.01 C ATOM 2008 CG GLN B 111 2.749 -29.964 38.859 1.00 29.12 C ATOM 2009 CD GLN B 111 1.648 -30.652 39.646 1.00 40.57 C ATOM 2010 OE1 GLN B 111 0.524 -30.796 39.161 1.00 40.23 O ATOM 2011 NE2 GLN B 111 1.940 -31.002 40.898 1.00 36.97 N ATOM 2012 HE22 GLN B 111 2.903 -30.862 41.266 1.00 0.00 H ATOM 2013 HE21 GLN B 111 1.205 -31.415 41.507 1.00 0.00 H ATOM 2014 H GLN B 111 3.658 -27.200 38.154 1.00 0.00 H ATOM 2015 N LEU B 112 2.399 -26.952 35.265 1.00 29.35 N ATOM 2016 CA LEU B 112 1.686 -26.452 34.099 1.00 29.62 C ATOM 2017 C LEU B 112 2.698 -25.976 33.078 1.00 31.11 C ATOM 2018 O LEU B 112 2.505 -26.199 31.879 1.00 36.56 O ATOM 2019 CB LEU B 112 0.727 -25.310 34.465 1.00 23.87 C ATOM 2020 CG LEU B 112 -0.116 -24.750 33.308 1.00 25.51 C ATOM 2021 CD1 LEU B 112 -1.036 -25.847 32.751 1.00 26.13 C ATOM 2022 CD2 LEU B 112 -0.926 -23.563 33.752 1.00 26.66 C ATOM 2023 H LEU B 112 2.730 -26.296 36.001 1.00 0.00 H ATOM 2024 N HIS B 113 3.809 -25.419 33.571 1.00 32.24 N ATOM 2025 CA HIS B 113 4.853 -24.785 32.755 1.00 33.27 C ATOM 2026 C HIS B 113 4.194 -24.085 31.573 1.00 34.05 C ATOM 2027 O HIS B 113 4.308 -24.501 30.415 1.00 32.98 O ATOM 2028 CB HIS B 113 5.908 -25.798 32.296 1.00 43.46 C ATOM 2029 CG HIS B 113 5.341 -27.033 31.672 1.00 59.27 C ATOM 2030 ND1 HIS B 113 4.945 -27.089 30.352 1.00 68.88 N ATOM 2031 CD2 HIS B 113 5.118 -28.268 32.183 1.00 62.32 C ATOM 2032 CE1 HIS B 113 4.494 -28.301 30.080 1.00 69.45 C ATOM 2033 NE2 HIS B 113 4.588 -29.036 31.175 1.00 63.65 N ATOM 2034 H HIS B 113 3.943 -25.436 34.602 1.00 0.00 H ATOM 2035 N ILE B 114 3.521 -22.993 31.908 1.00 33.50 N ATOM 2036 CA ILE B 114 2.617 -22.323 30.988 1.00 28.26 C ATOM 2037 C ILE B 114 3.404 -21.674 29.853 1.00 33.42 C ATOM 2038 O ILE B 114 4.487 -21.128 30.068 1.00 39.37 O ATOM 2039 CB ILE B 114 1.736 -21.285 31.748 1.00 30.88 C ATOM 2040 CG1 ILE B 114 0.498 -20.898 30.926 1.00 35.29 C ATOM 2041 CG2 ILE B 114 2.553 -20.071 32.204 1.00 34.27 C ATOM 2042 CD1 ILE B 114 -0.500 -20.067 31.701 1.00 39.37 C ATOM 2043 H ILE B 114 3.644 -22.602 32.864 1.00 0.00 H ATOM 2044 N THR B 115 2.876 -21.799 28.635 1.00 36.49 N ATOM 2045 CA THR B 115 3.456 -21.201 27.432 1.00 41.45 C ATOM 2046 C THR B 115 2.307 -20.588 26.614 1.00 44.75 C ATOM 2047 O THR B 115 1.142 -20.772 26.977 1.00 42.46 O ATOM 2048 CB THR B 115 4.210 -22.239 26.577 1.00 43.76 C ATOM 2049 OG1 THR B 115 3.264 -23.109 25.942 1.00 47.98 O ATOM 2050 CG2 THR B 115 5.227 -23.046 27.415 1.00 37.67 C ATOM 2051 HG1 THR B 115 2.730 -23.574 26.633 1.00 0.00 H ATOM 2052 H THR B 115 2.002 -22.353 28.534 1.00 0.00 H ATOM 2053 N PRO B 116 2.613 -19.850 25.526 1.00 42.86 N ATOM 2054 CA PRO B 116 1.496 -19.333 24.722 1.00 54.80 C ATOM 2055 C PRO B 116 0.630 -20.432 24.113 1.00 53.03 C ATOM 2056 O PRO B 116 -0.484 -20.167 23.665 1.00 48.15 O ATOM 2057 CB PRO B 116 2.196 -18.535 23.612 1.00 60.86 C ATOM 2058 CG PRO B 116 3.598 -19.058 23.582 1.00 58.56 C ATOM 2059 CD PRO B 116 3.909 -19.382 25.000 1.00 50.67 C ATOM 2060 N GLY B 117 1.142 -21.656 24.094 1.00 46.60 N ATOM 2061 CA GLY B 117 0.406 -22.764 23.519 1.00 46.80 C ATOM 2062 C GLY B 117 -0.502 -23.436 24.525 1.00 45.58 C ATOM 2063 O GLY B 117 -1.278 -24.323 24.171 1.00 46.88 O ATOM 2064 H GLY B 117 2.086 -21.823 24.498 1.00 0.00 H ATOM 2065 N THR B 118 -0.412 -23.023 25.785 1.00 40.24 N ATOM 2066 CA THR B 118 -1.218 -23.657 26.813 1.00 40.05 C ATOM 2067 C THR B 118 -2.703 -23.354 26.621 1.00 37.10 C ATOM 2068 O THR B 118 -3.102 -22.204 26.417 1.00 38.20 O ATOM 2069 CB THR B 118 -0.801 -23.214 28.218 1.00 33.47 C ATOM 2070 OG1 THR B 118 0.612 -23.422 28.385 1.00 36.07 O ATOM 2071 CG2 THR B 118 -1.564 -24.018 29.262 1.00 30.83 C ATOM 2072 HG1 THR B 118 0.819 -24.383 28.266 1.00 0.00 H ATOM 2073 H THR B 118 0.234 -22.247 26.034 1.00 0.00 H ATOM 2074 N ALA B 119 -3.507 -24.405 26.661 1.00 40.16 N ATOM 2075 CA ALA B 119 -4.952 -24.268 26.543 1.00 43.02 C ATOM 2076 C ALA B 119 -5.604 -24.707 27.841 1.00 40.12 C ATOM 2077 O ALA B 119 -4.933 -25.286 28.720 1.00 40.13 O ATOM 2078 CB ALA B 119 -5.479 -25.070 25.359 1.00 39.19 C ATOM 2079 H ALA B 119 -3.096 -25.353 26.780 1.00 0.00 H ATOM 2080 N TYR B 120 -6.897 -24.426 27.971 1.00 33.89 N ATOM 2081 CA TYR B 120 -7.628 -24.702 29.208 1.00 32.45 C ATOM 2082 C TYR B 120 -7.426 -26.125 29.725 1.00 29.53 C ATOM 2083 O TYR B 120 -7.336 -26.340 30.931 1.00 28.29 O ATOM 2084 CB TYR B 120 -9.121 -24.464 29.021 1.00 35.71 C ATOM 2085 CG TYR B 120 -9.925 -24.809 30.256 1.00 32.77 C ATOM 2086 CD1 TYR B 120 -9.906 -23.981 31.370 1.00 29.74 C ATOM 2087 CD2 TYR B 120 -10.669 -25.991 30.326 1.00 32.47 C ATOM 2088 CE1 TYR B 120 -10.643 -24.284 32.496 1.00 29.70 C ATOM 2089 CE2 TYR B 120 -11.403 -26.306 31.464 1.00 29.82 C ATOM 2090 CZ TYR B 120 -11.380 -25.446 32.544 1.00 28.86 C ATOM 2091 OH TYR B 120 -12.107 -25.738 33.680 1.00 32.21 O ATOM 2092 HH TYR B 120 -13.067 -25.803 33.448 1.00 0.00 H ATOM 2093 H TYR B 120 -7.404 -23.998 27.170 1.00 0.00 H ATOM 2094 N GLN B 121 -7.384 -27.090 28.808 1.00 34.99 N ATOM 2095 CA GLN B 121 -7.247 -28.484 29.201 1.00 41.72 C ATOM 2096 C GLN B 121 -6.073 -28.754 30.142 1.00 37.91 C ATOM 2097 O GLN B 121 -6.203 -29.491 31.118 1.00 33.89 O ATOM 2098 CB GLN B 121 -7.068 -29.354 27.962 1.00 44.69 C ATOM 2099 CG GLN B 121 -6.887 -30.826 28.280 1.00 48.97 C ATOM 2100 CD GLN B 121 -7.079 -31.709 27.058 1.00 60.01 C ATOM 2101 OE1 GLN B 121 -7.849 -32.669 27.082 1.00 61.88 O ATOM 2102 NE2 GLN B 121 -6.368 -31.388 25.982 1.00 65.35 N ATOM 2103 HE22 GLN B 121 -5.729 -30.568 26.007 1.00 0.00 H ATOM 2104 HE21 GLN B 121 -6.450 -31.957 25.115 1.00 0.00 H ATOM 2105 H GLN B 121 -7.450 -26.844 27.800 1.00 0.00 H ATOM 2106 N SER B 122 -4.935 -28.141 29.850 1.00 37.08 N ATOM 2107 CA SER B 122 -3.742 -28.342 30.657 1.00 39.67 C ATOM 2108 C SER B 122 -3.937 -27.689 32.023 1.00 34.40 C ATOM 2109 O SER B 122 -3.582 -28.254 33.066 1.00 30.34 O ATOM 2110 CB SER B 122 -2.526 -27.783 29.929 1.00 44.53 C ATOM 2111 OG SER B 122 -2.311 -28.514 28.729 1.00 48.58 O ATOM 2112 HG SER B 122 -3.109 -28.434 28.148 1.00 0.00 H ATOM 2113 H SER B 122 -4.894 -27.504 29.029 1.00 0.00 H ATOM 2114 N PHE B 123 -4.512 -26.493 32.010 1.00 27.98 N ATOM 2115 CA PHE B 123 -4.832 -25.778 33.249 1.00 28.00 C ATOM 2116 C PHE B 123 -5.779 -26.607 34.122 1.00 27.19 C ATOM 2117 O PHE B 123 -5.561 -26.775 35.310 1.00 26.90 O ATOM 2118 CB PHE B 123 -5.448 -24.420 32.919 1.00 22.86 C ATOM 2119 CG PHE B 123 -5.950 -23.657 34.113 1.00 24.68 C ATOM 2120 CD1 PHE B 123 -5.076 -22.899 34.882 1.00 22.94 C ATOM 2121 CD2 PHE B 123 -7.296 -23.682 34.449 1.00 24.00 C ATOM 2122 CE1 PHE B 123 -5.534 -22.173 35.979 1.00 30.02 C ATOM 2123 CE2 PHE B 123 -7.773 -22.950 35.529 1.00 20.15 C ATOM 2124 CZ PHE B 123 -6.884 -22.196 36.302 1.00 23.82 C ATOM 2125 H PHE B 123 -4.742 -26.051 31.097 1.00 0.00 H ATOM 2126 N GLU B 124 -6.840 -27.126 33.521 1.00 24.39 N ATOM 2127 CA GLU B 124 -7.790 -27.924 34.278 1.00 30.09 C ATOM 2128 C GLU B 124 -7.125 -29.166 34.906 1.00 28.34 C ATOM 2129 O GLU B 124 -7.431 -29.520 36.041 1.00 30.56 O ATOM 2130 CB GLU B 124 -8.987 -28.328 33.407 1.00 29.21 C ATOM 2131 CG GLU B 124 -10.016 -29.109 34.204 1.00 34.88 C ATOM 2132 CD GLU B 124 -11.065 -29.756 33.341 1.00 45.09 C ATOM 2133 OE1 GLU B 124 -10.797 -29.986 32.142 1.00 54.17 O ATOM 2134 OE2 GLU B 124 -12.129 -30.104 33.890 1.00 41.46 O ATOM 2135 H GLU B 124 -6.993 -26.962 32.506 1.00 0.00 H ATOM 2136 N GLN B 125 -6.222 -29.808 34.168 1.00 29.47 N ATOM 2137 CA GLN B 125 -5.567 -31.029 34.642 1.00 28.06 C ATOM 2138 C GLN B 125 -4.760 -30.712 35.897 1.00 27.15 C ATOM 2139 O GLN B 125 -4.763 -31.463 36.876 1.00 28.16 O ATOM 2140 CB GLN B 125 -4.614 -31.589 33.575 1.00 37.25 C ATOM 2141 CG GLN B 125 -5.272 -32.159 32.327 1.00 51.51 C ATOM 2142 CD GLN B 125 -4.299 -32.379 31.167 1.00 63.35 C ATOM 2143 OE1 GLN B 125 -3.087 -32.214 31.307 1.00 65.43 O ATOM 2144 NE2 GLN B 125 -4.836 -32.760 30.016 1.00 69.20 N ATOM 2145 HE22 GLN B 125 -5.865 -32.888 29.940 1.00 0.00 H ATOM 2146 HE21 GLN B 125 -4.228 -32.931 29.190 1.00 0.00 H ATOM 2147 H GLN B 125 -5.975 -29.433 33.230 1.00 0.00 H ATOM 2148 N VAL B 126 -4.075 -29.581 35.858 1.00 25.32 N ATOM 2149 CA VAL B 126 -3.240 -29.170 36.982 1.00 25.76 C ATOM 2150 C VAL B 126 -4.084 -28.723 38.181 1.00 29.23 C ATOM 2151 O VAL B 126 -3.783 -29.068 39.329 1.00 29.03 O ATOM 2152 CB VAL B 126 -2.255 -28.063 36.560 1.00 26.91 C ATOM 2153 CG1 VAL B 126 -1.536 -27.513 37.785 1.00 24.58 C ATOM 2154 CG2 VAL B 126 -1.231 -28.634 35.590 1.00 28.36 C ATOM 2155 H VAL B 126 -4.132 -28.976 35.014 1.00 0.00 H ATOM 2156 N VAL B 127 -5.142 -27.962 37.926 1.00 26.58 N ATOM 2157 CA VAL B 127 -5.988 -27.520 39.021 1.00 25.49 C ATOM 2158 C VAL B 127 -6.726 -28.708 39.659 1.00 26.74 C ATOM 2159 O VAL B 127 -6.941 -28.728 40.864 1.00 37.65 O ATOM 2160 CB VAL B 127 -7.003 -26.444 38.540 1.00 25.82 C ATOM 2161 CG1 VAL B 127 -7.956 -26.080 39.667 1.00 22.92 C ATOM 2162 CG2 VAL B 127 -6.249 -25.187 38.068 1.00 19.81 C ATOM 2163 H VAL B 127 -5.363 -27.684 36.949 1.00 0.00 H ATOM 2164 N ASN B 128 -7.094 -29.702 38.858 1.00 29.07 N ATOM 2165 CA ASN B 128 -7.739 -30.918 39.370 1.00 31.25 C ATOM 2166 C ASN B 128 -6.871 -31.655 40.373 1.00 43.76 C ATOM 2167 O ASN B 128 -7.368 -32.364 41.245 1.00 42.46 O ATOM 2168 CB ASN B 128 -8.131 -31.840 38.226 1.00 39.69 C ATOM 2169 CG ASN B 128 -9.420 -31.410 37.570 1.00 40.09 C ATOM 2170 OD1 ASN B 128 -10.128 -30.555 38.095 1.00 37.74 O ATOM 2171 ND2 ASN B 128 -9.734 -31.995 36.426 1.00 45.81 N ATOM 2172 HD22 ASN B 128 -9.103 -32.714 36.019 1.00 0.00 H ATOM 2173 HD21 ASN B 128 -10.612 -31.736 35.933 1.00 0.00 H ATOM 2174 H ASN B 128 -6.920 -29.616 37.836 1.00 0.00 H ATOM 2175 N GLU B 129 -5.569 -31.483 40.218 1.00 40.36 N ATOM 2176 CA GLU B 129 -4.581 -32.053 41.109 1.00 45.46 C ATOM 2177 C GLU B 129 -4.707 -31.411 42.501 1.00 35.62 C ATOM 2178 O GLU B 129 -4.630 -32.079 43.531 1.00 40.68 O ATOM 2179 CB GLU B 129 -3.205 -31.841 40.487 1.00 48.77 C ATOM 2180 CG GLU B 129 -2.067 -32.432 41.202 1.00 51.84 C ATOM 2181 CD GLU B 129 -2.154 -33.925 41.295 1.00 51.97 C ATOM 2182 OE1 GLU B 129 -1.634 -34.456 42.293 1.00 50.68 O ATOM 2183 OE2 GLU B 129 -2.718 -34.565 40.369 1.00 39.19 O ATOM 2184 H GLU B 129 -5.238 -30.910 39.416 1.00 0.00 H ATOM 2185 N LEU B 130 -4.947 -30.107 42.511 1.00 34.41 N ATOM 2186 CA LEU B 130 -5.217 -29.349 43.724 1.00 28.16 C ATOM 2187 C LEU B 130 -6.444 -29.879 44.502 1.00 36.04 C ATOM 2188 O LEU B 130 -6.463 -29.901 45.739 1.00 30.26 O ATOM 2189 CB LEU B 130 -5.398 -27.875 43.345 1.00 33.62 C ATOM 2190 CG LEU B 130 -5.894 -26.794 44.297 1.00 29.48 C ATOM 2191 CD1 LEU B 130 -5.141 -26.800 45.608 1.00 35.00 C ATOM 2192 CD2 LEU B 130 -5.808 -25.404 43.619 1.00 23.33 C ATOM 2193 H LEU B 130 -4.942 -29.599 41.604 1.00 0.00 H ATOM 2194 N PHE B 131 -7.488 -30.270 43.773 1.00 34.20 N ATOM 2195 CA PHE B 131 -8.756 -30.672 44.386 1.00 33.90 C ATOM 2196 C PHE B 131 -8.976 -32.165 44.308 1.00 33.71 C ATOM 2197 O PHE B 131 -10.081 -32.652 44.547 1.00 39.26 O ATOM 2198 CB PHE B 131 -9.936 -29.944 43.696 1.00 33.44 C ATOM 2199 CG PHE B 131 -9.907 -28.455 43.856 1.00 30.06 C ATOM 2200 CD1 PHE B 131 -10.157 -27.880 45.092 1.00 29.85 C ATOM 2201 CD2 PHE B 131 -9.641 -27.623 42.776 1.00 29.40 C ATOM 2202 CE1 PHE B 131 -10.131 -26.511 45.244 1.00 32.13 C ATOM 2203 CE2 PHE B 131 -9.618 -26.254 42.928 1.00 31.73 C ATOM 2204 CZ PHE B 131 -9.866 -25.695 44.164 1.00 32.90 C ATOM 2205 H PHE B 131 -7.400 -30.290 42.737 1.00 0.00 H ATOM 2206 N ARG B 132 -7.906 -32.889 44.006 1.00 36.19 N ATOM 2207 CA ARG B 132 -7.960 -34.342 43.834 1.00 37.75 C ATOM 2208 C ARG B 132 -8.601 -35.042 45.028 1.00 44.67 C ATOM 2209 O ARG B 132 -9.341 -36.007 44.872 1.00 44.26 O ATOM 2210 CB ARG B 132 -6.547 -34.867 43.572 1.00 44.49 C ATOM 2211 CG ARG B 132 -6.427 -36.344 43.327 1.00 50.70 C ATOM 2212 CD ARG B 132 -4.985 -36.679 42.995 1.00 51.78 C ATOM 2213 NE ARG B 132 -4.805 -38.081 42.630 1.00 68.03 N ATOM 2214 CZ ARG B 132 -5.001 -38.577 41.418 1.00 77.83 C ATOM 2215 NH1 ARG B 132 -4.804 -39.869 41.191 1.00 80.57 N ATOM 2216 NH2 ARG B 132 -5.396 -37.780 40.437 1.00 80.10 N ATOM 2217 HE ARG B 132 -4.501 -38.738 43.376 1.00 0.00 H ATOM 2218 HH12 ARG B 132 -4.958 -40.259 40.239 1.00 0.00 H ATOM 2219 HH11 ARG B 132 -4.496 -40.492 41.965 1.00 0.00 H ATOM 2220 HH22 ARG B 132 -5.551 -38.166 39.484 1.00 0.00 H ATOM 2221 HH21 ARG B 132 -5.551 -36.768 40.620 1.00 0.00 H ATOM 2222 H ARG B 132 -6.993 -32.405 43.887 1.00 0.00 H ATOM 2223 N ASP B 133 -8.305 -34.557 46.228 1.00 45.36 N ATOM 2224 CA ASP B 133 -8.804 -35.172 47.454 1.00 50.86 C ATOM 2225 C ASP B 133 -9.987 -34.425 48.066 1.00 49.21 C ATOM 2226 O ASP B 133 -10.293 -34.591 49.247 1.00 52.84 O ATOM 2227 CB ASP B 133 -7.663 -35.289 48.458 1.00 58.36 C ATOM 2228 CG ASP B 133 -6.542 -36.168 47.943 1.00 71.89 C ATOM 2229 OD1 ASP B 133 -6.837 -37.139 47.208 1.00 73.52 O ATOM 2230 OD2 ASP B 133 -5.367 -35.869 48.238 1.00 76.94 O ATOM 2231 H ASP B 133 -7.700 -33.714 46.296 1.00 0.00 H ATOM 2232 N GLY B 134 -10.626 -33.581 47.261 1.00 46.16 N ATOM 2233 CA GLY B 134 -11.813 -32.855 47.673 1.00 45.93 C ATOM 2234 C GLY B 134 -11.644 -31.349 47.724 1.00 44.31 C ATOM 2235 O GLY B 134 -10.528 -30.825 47.704 1.00 39.74 O ATOM 2236 H GLY B 134 -10.261 -33.436 46.298 1.00 0.00 H ATOM 2237 N VAL B 135 -12.771 -30.646 47.801 1.00 44.60 N ATOM 2238 CA VAL B 135 -12.761 -29.194 47.876 1.00 40.74 C ATOM 2239 C VAL B 135 -12.860 -28.709 49.325 1.00 46.73 C ATOM 2240 O VAL B 135 -13.604 -29.269 50.127 1.00 48.50 O ATOM 2241 CB VAL B 135 -13.920 -28.578 47.049 1.00 42.65 C ATOM 2242 CG1 VAL B 135 -13.868 -27.047 47.092 1.00 37.47 C ATOM 2243 CG2 VAL B 135 -13.866 -29.064 45.602 1.00 38.07 C ATOM 2244 H VAL B 135 -13.682 -31.148 47.808 1.00 0.00 H ATOM 2245 N ASN B 136 -12.084 -27.684 49.659 1.00 42.97 N ATOM 2246 CA ASN B 136 -12.330 -26.897 50.861 1.00 44.23 C ATOM 2247 C ASN B 136 -11.907 -25.453 50.578 1.00 44.04 C ATOM 2248 O ASN B 136 -11.351 -25.164 49.510 1.00 33.58 O ATOM 2249 CB ASN B 136 -11.619 -27.487 52.091 1.00 41.05 C ATOM 2250 CG ASN B 136 -10.102 -27.562 51.944 1.00 38.93 C ATOM 2251 OD1 ASN B 136 -9.469 -26.680 51.367 1.00 41.88 O ATOM 2252 ND2 ASN B 136 -9.510 -28.618 52.506 1.00 40.85 N ATOM 2253 HD22 ASN B 136 -10.083 -29.342 52.985 1.00 0.00 H ATOM 2254 HD21 ASN B 136 -8.476 -28.717 52.465 1.00 0.00 H ATOM 2255 H ASN B 136 -11.280 -27.437 49.047 1.00 0.00 H ATOM 2256 N TRP B 137 -12.179 -24.544 51.510 1.00 40.87 N ATOM 2257 CA TRP B 137 -11.934 -23.125 51.248 1.00 39.04 C ATOM 2258 C TRP B 137 -10.450 -22.825 51.045 1.00 36.67 C ATOM 2259 O TRP B 137 -10.084 -22.013 50.185 1.00 33.47 O ATOM 2260 CB TRP B 137 -12.486 -22.266 52.384 1.00 41.41 C ATOM 2261 CG TRP B 137 -13.980 -22.179 52.421 1.00 38.91 C ATOM 2262 CD1 TRP B 137 -14.802 -22.628 53.415 1.00 41.93 C ATOM 2263 CD2 TRP B 137 -14.835 -21.581 51.432 1.00 34.08 C ATOM 2264 NE1 TRP B 137 -16.116 -22.359 53.101 1.00 45.73 N ATOM 2265 CE2 TRP B 137 -16.162 -21.717 51.891 1.00 42.84 C ATOM 2266 CE3 TRP B 137 -14.608 -20.955 50.201 1.00 33.51 C ATOM 2267 CZ2 TRP B 137 -17.253 -21.254 51.163 1.00 46.59 C ATOM 2268 CZ3 TRP B 137 -15.700 -20.493 49.481 1.00 39.68 C ATOM 2269 CH2 TRP B 137 -17.000 -20.641 49.965 1.00 42.30 C ATOM 2270 HE1 TRP B 137 -16.940 -22.603 53.687 1.00 0.00 H ATOM 2271 H TRP B 137 -12.567 -24.842 52.428 1.00 0.00 H ATOM 2272 N GLY B 138 -9.604 -23.488 51.831 1.00 34.92 N ATOM 2273 CA GLY B 138 -8.168 -23.300 51.736 1.00 38.61 C ATOM 2274 C GLY B 138 -7.641 -23.626 50.348 1.00 32.94 C ATOM 2275 O GLY B 138 -6.779 -22.929 49.816 1.00 30.35 O ATOM 2276 H GLY B 138 -9.982 -24.158 52.531 1.00 0.00 H ATOM 2277 N ARG B 139 -8.162 -24.693 49.753 1.00 34.27 N ATOM 2278 CA ARG B 139 -7.724 -25.098 48.423 1.00 30.83 C ATOM 2279 C ARG B 139 -8.262 -24.151 47.370 1.00 28.31 C ATOM 2280 O ARG B 139 -7.619 -23.934 46.345 1.00 28.38 O ATOM 2281 CB ARG B 139 -8.145 -26.538 48.140 1.00 26.60 C ATOM 2282 CG ARG B 139 -7.306 -27.529 48.970 1.00 23.82 C ATOM 2283 CD ARG B 139 -7.924 -28.917 49.072 1.00 27.32 C ATOM 2284 NE ARG B 139 -7.220 -29.707 50.070 1.00 31.62 N ATOM 2285 CZ ARG B 139 -7.533 -30.951 50.416 1.00 40.76 C ATOM 2286 NH1 ARG B 139 -8.549 -31.583 49.830 1.00 44.67 N ATOM 2287 NH2 ARG B 139 -6.821 -31.567 51.346 1.00 38.76 N ATOM 2288 HE ARG B 139 -6.410 -29.264 50.549 1.00 0.00 H ATOM 2289 HH12 ARG B 139 -8.786 -32.557 50.108 1.00 0.00 H ATOM 2290 HH11 ARG B 139 -9.105 -31.103 49.094 1.00 0.00 H ATOM 2291 HH22 ARG B 139 -7.059 -32.541 51.623 1.00 0.00 H ATOM 2292 HH21 ARG B 139 -6.024 -31.077 51.800 1.00 0.00 H ATOM 2293 H ARG B 139 -8.893 -25.247 50.243 1.00 0.00 H ATOM 2294 N ILE B 140 -9.430 -23.570 47.628 1.00 32.72 N ATOM 2295 CA ILE B 140 -9.956 -22.542 46.729 1.00 29.68 C ATOM 2296 C ILE B 140 -9.064 -21.291 46.800 1.00 29.99 C ATOM 2297 O ILE B 140 -8.767 -20.664 45.787 1.00 30.00 O ATOM 2298 CB ILE B 140 -11.418 -22.188 47.061 1.00 27.83 C ATOM 2299 CG1 ILE B 140 -12.326 -23.371 46.724 1.00 31.55 C ATOM 2300 CG2 ILE B 140 -11.872 -20.944 46.291 1.00 27.82 C ATOM 2301 CD1 ILE B 140 -13.804 -23.130 47.051 1.00 35.08 C ATOM 2302 H ILE B 140 -9.972 -23.847 48.472 1.00 0.00 H ATOM 2303 N VAL B 141 -8.616 -20.935 47.999 1.00 26.77 N ATOM 2304 CA VAL B 141 -7.663 -19.840 48.107 1.00 25.82 C ATOM 2305 C VAL B 141 -6.394 -20.191 47.322 1.00 24.32 C ATOM 2306 O VAL B 141 -5.881 -19.365 46.571 1.00 26.32 O ATOM 2307 CB VAL B 141 -7.295 -19.537 49.562 1.00 28.41 C ATOM 2308 CG1 VAL B 141 -6.166 -18.510 49.595 1.00 25.32 C ATOM 2309 CG2 VAL B 141 -8.529 -19.040 50.326 1.00 27.97 C ATOM 2310 H VAL B 141 -8.943 -21.433 48.851 1.00 0.00 H ATOM 2311 N ALA B 142 -5.912 -21.429 47.484 1.00 23.44 N ATOM 2312 CA ALA B 142 -4.749 -21.886 46.726 1.00 23.70 C ATOM 2313 C ALA B 142 -4.980 -21.770 45.208 1.00 23.55 C ATOM 2314 O ALA B 142 -4.079 -21.377 44.472 1.00 21.14 O ATOM 2315 CB ALA B 142 -4.398 -23.313 47.094 1.00 22.16 C ATOM 2316 H ALA B 142 -6.371 -22.074 48.158 1.00 0.00 H ATOM 2317 N PHE B 143 -6.184 -22.096 44.752 1.00 25.12 N ATOM 2318 CA PHE B 143 -6.560 -21.947 43.335 1.00 24.28 C ATOM 2319 C PHE B 143 -6.393 -20.503 42.861 1.00 23.97 C ATOM 2320 O PHE B 143 -5.784 -20.249 41.806 1.00 23.43 O ATOM 2321 CB PHE B 143 -8.008 -22.467 43.157 1.00 22.97 C ATOM 2322 CG PHE B 143 -8.722 -22.006 41.890 1.00 20.07 C ATOM 2323 CD1 PHE B 143 -8.532 -22.665 40.684 1.00 24.90 C ATOM 2324 CD2 PHE B 143 -9.639 -20.962 41.943 1.00 21.14 C ATOM 2325 CE1 PHE B 143 -9.217 -22.271 39.526 1.00 24.25 C ATOM 2326 CE2 PHE B 143 -10.338 -20.540 40.787 1.00 24.79 C ATOM 2327 CZ PHE B 143 -10.129 -21.216 39.576 1.00 23.55 C ATOM 2328 H PHE B 143 -6.888 -22.470 45.420 1.00 0.00 H ATOM 2329 N PHE B 144 -6.903 -19.547 43.632 1.00 21.67 N ATOM 2330 CA PHE B 144 -6.759 -18.138 43.249 1.00 24.36 C ATOM 2331 C PHE B 144 -5.295 -17.724 43.257 1.00 25.26 C ATOM 2332 O PHE B 144 -4.825 -17.069 42.317 1.00 24.14 O ATOM 2333 CB PHE B 144 -7.583 -17.231 44.166 1.00 26.80 C ATOM 2334 CG PHE B 144 -9.001 -17.115 43.740 1.00 27.52 C ATOM 2335 CD1 PHE B 144 -9.392 -16.097 42.874 1.00 26.64 C ATOM 2336 CD2 PHE B 144 -9.944 -18.041 44.168 1.00 26.44 C ATOM 2337 CE1 PHE B 144 -10.713 -16.002 42.442 1.00 30.43 C ATOM 2338 CE2 PHE B 144 -11.260 -17.941 43.746 1.00 27.38 C ATOM 2339 CZ PHE B 144 -11.641 -16.920 42.887 1.00 26.69 C ATOM 2340 H PHE B 144 -7.405 -19.798 44.508 1.00 0.00 H ATOM 2341 N SER B 145 -4.580 -18.129 44.304 1.00 24.94 N ATOM 2342 CA SER B 145 -3.163 -17.832 44.419 1.00 23.57 C ATOM 2343 C SER B 145 -2.398 -18.391 43.218 1.00 22.61 C ATOM 2344 O SER B 145 -1.512 -17.731 42.677 1.00 24.19 O ATOM 2345 CB SER B 145 -2.603 -18.404 45.723 1.00 23.58 C ATOM 2346 OG SER B 145 -1.206 -18.214 45.784 1.00 21.86 O ATOM 2347 HG SER B 145 -1.004 -17.246 45.743 1.00 0.00 H ATOM 2348 H SER B 145 -5.047 -18.671 45.058 1.00 0.00 H ATOM 2349 N PHE B 146 -2.761 -19.603 42.801 1.00 21.30 N ATOM 2350 CA PHE B 146 -2.166 -20.235 41.627 1.00 26.49 C ATOM 2351 C PHE B 146 -2.439 -19.388 40.355 1.00 22.87 C ATOM 2352 O PHE B 146 -1.531 -19.093 39.575 1.00 20.02 O ATOM 2353 CB PHE B 146 -2.708 -21.669 41.484 1.00 20.88 C ATOM 2354 CG PHE B 146 -2.260 -22.372 40.234 1.00 24.46 C ATOM 2355 CD1 PHE B 146 -0.932 -22.335 39.833 1.00 21.67 C ATOM 2356 CD2 PHE B 146 -3.171 -23.110 39.479 1.00 21.36 C ATOM 2357 CE1 PHE B 146 -0.515 -22.995 38.674 1.00 23.59 C ATOM 2358 CE2 PHE B 146 -2.762 -23.789 38.332 1.00 24.98 C ATOM 2359 CZ PHE B 146 -1.440 -23.728 37.927 1.00 22.28 C ATOM 2360 H PHE B 146 -3.494 -20.117 43.330 1.00 0.00 H ATOM 2361 N GLY B 147 -3.682 -18.968 40.164 1.00 21.39 N ATOM 2362 CA GLY B 147 -3.986 -18.078 39.048 1.00 20.34 C ATOM 2363 C GLY B 147 -3.166 -16.791 39.078 1.00 27.46 C ATOM 2364 O GLY B 147 -2.649 -16.341 38.041 1.00 22.13 O ATOM 2365 H GLY B 147 -4.439 -19.272 40.809 1.00 0.00 H ATOM 2366 N GLY B 148 -3.034 -16.196 40.265 1.00 22.52 N ATOM 2367 CA GLY B 148 -2.224 -14.996 40.419 1.00 23.30 C ATOM 2368 C GLY B 148 -0.781 -15.234 40.022 1.00 26.64 C ATOM 2369 O GLY B 148 -0.177 -14.450 39.294 1.00 26.29 O ATOM 2370 H GLY B 148 -3.518 -16.596 41.094 1.00 0.00 H ATOM 2371 N ALA B 149 -0.224 -16.339 40.494 1.00 20.74 N ATOM 2372 CA ALA B 149 1.173 -16.660 40.203 1.00 25.43 C ATOM 2373 C ALA B 149 1.382 -16.907 38.707 1.00 21.41 C ATOM 2374 O ALA B 149 2.425 -16.546 38.157 1.00 22.67 O ATOM 2375 CB ALA B 149 1.635 -17.877 41.030 1.00 25.91 C ATOM 2376 H ALA B 149 -0.788 -16.988 41.080 1.00 0.00 H ATOM 2377 N LEU B 150 0.414 -17.549 38.054 1.00 22.82 N ATOM 2378 CA LEU B 150 0.499 -17.760 36.607 1.00 22.82 C ATOM 2379 C LEU B 150 0.524 -16.429 35.859 1.00 26.06 C ATOM 2380 O LEU B 150 1.246 -16.267 34.880 1.00 24.90 O ATOM 2381 CB LEU B 150 -0.680 -18.601 36.104 1.00 22.18 C ATOM 2382 CG LEU B 150 -0.641 -20.077 36.498 1.00 24.65 C ATOM 2383 CD1 LEU B 150 -1.896 -20.788 35.945 1.00 23.71 C ATOM 2384 CD2 LEU B 150 0.640 -20.728 35.996 1.00 26.49 C ATOM 2385 H LEU B 150 -0.411 -17.904 38.578 1.00 0.00 H ATOM 2386 N CYS B 151 -0.279 -15.477 36.313 1.00 21.88 N ATOM 2387 CA CYS B 151 -0.314 -14.182 35.657 1.00 23.78 C ATOM 2388 C CYS B 151 1.029 -13.466 35.794 1.00 27.54 C ATOM 2389 O CYS B 151 1.531 -12.882 34.826 1.00 28.04 O ATOM 2390 CB CYS B 151 -1.455 -13.316 36.211 1.00 28.84 C ATOM 2391 SG CYS B 151 -3.087 -13.854 35.660 1.00 26.18 S ATOM 2392 H CYS B 151 -0.884 -15.658 37.139 1.00 0.00 H ATOM 2393 N VAL B 152 1.593 -13.503 36.993 1.00 25.83 N ATOM 2394 CA VAL B 152 2.893 -12.876 37.247 1.00 26.21 C ATOM 2395 C VAL B 152 3.967 -13.520 36.363 1.00 30.58 C ATOM 2396 O VAL B 152 4.742 -12.830 35.716 1.00 33.27 O ATOM 2397 CB VAL B 152 3.269 -12.988 38.734 1.00 29.75 C ATOM 2398 CG1 VAL B 152 4.737 -12.548 38.985 1.00 28.73 C ATOM 2399 CG2 VAL B 152 2.287 -12.163 39.567 1.00 29.82 C ATOM 2400 H VAL B 152 1.102 -13.988 37.771 1.00 0.00 H ATOM 2401 N GLU B 153 3.984 -14.851 36.326 1.00 29.54 N ATOM 2402 CA GLU B 153 4.943 -15.595 35.508 1.00 29.56 C ATOM 2403 C GLU B 153 4.812 -15.266 34.029 1.00 34.18 C ATOM 2404 O GLU B 153 5.814 -15.166 33.308 1.00 32.62 O ATOM 2405 CB GLU B 153 4.766 -17.105 35.703 1.00 33.95 C ATOM 2406 CG GLU B 153 5.819 -17.938 34.972 1.00 37.94 C ATOM 2407 CD GLU B 153 5.508 -19.435 34.970 1.00 41.99 C ATOM 2408 OE1 GLU B 153 4.699 -19.885 35.805 1.00 38.48 O ATOM 2409 OE2 GLU B 153 6.122 -20.168 34.170 1.00 46.71 O ATOM 2410 H GLU B 153 3.293 -15.379 36.897 1.00 0.00 H ATOM 2411 N SER B 154 3.571 -15.132 33.564 1.00 28.63 N ATOM 2412 CA SER B 154 3.309 -14.801 32.170 1.00 32.97 C ATOM 2413 C SER B 154 3.918 -13.451 31.799 1.00 37.46 C ATOM 2414 O SER B 154 4.520 -13.296 30.739 1.00 40.98 O ATOM 2415 CB SER B 154 1.803 -14.796 31.902 1.00 30.19 C ATOM 2416 OG SER B 154 1.282 -16.114 32.044 1.00 33.08 O ATOM 2417 HG SER B 154 1.450 -16.436 32.965 1.00 0.00 H ATOM 2418 H SER B 154 2.769 -15.267 34.212 1.00 0.00 H ATOM 2419 N VAL B 155 3.748 -12.471 32.677 1.00 31.63 N ATOM 2420 CA VAL B 155 4.306 -11.147 32.435 1.00 35.70 C ATOM 2421 C VAL B 155 5.835 -11.201 32.508 1.00 36.46 C ATOM 2422 O VAL B 155 6.520 -10.611 31.669 1.00 38.73 O ATOM 2423 CB VAL B 155 3.749 -10.116 33.438 1.00 39.92 C ATOM 2424 CG1 VAL B 155 4.358 -8.745 33.194 1.00 41.41 C ATOM 2425 CG2 VAL B 155 2.217 -10.050 33.331 1.00 32.71 C ATOM 2426 H VAL B 155 3.210 -12.650 33.549 1.00 0.00 H ATOM 2427 N ASP B 156 6.361 -11.933 33.492 1.00 37.92 N ATOM 2428 CA ASP B 156 7.804 -12.157 33.614 1.00 39.90 C ATOM 2429 C ASP B 156 8.415 -12.671 32.317 1.00 42.74 C ATOM 2430 O ASP B 156 9.476 -12.217 31.893 1.00 49.54 O ATOM 2431 CB ASP B 156 8.119 -13.192 34.700 1.00 36.62 C ATOM 2432 CG ASP B 156 7.944 -12.668 36.103 1.00 38.75 C ATOM 2433 OD1 ASP B 156 7.845 -11.445 36.291 1.00 47.74 O ATOM 2434 OD2 ASP B 156 7.922 -13.511 37.030 1.00 38.56 O ATOM 2435 H ASP B 156 5.725 -12.359 34.196 1.00 0.00 H ATOM 2436 N LYS B 157 7.733 -13.629 31.695 1.00 43.61 N ATOM 2437 CA LYS B 157 8.268 -14.298 30.510 1.00 46.78 C ATOM 2438 C LYS B 157 7.776 -13.683 29.201 1.00 48.34 C ATOM 2439 O LYS B 157 7.853 -14.320 28.150 1.00 55.72 O ATOM 2440 CB LYS B 157 7.940 -15.799 30.554 1.00 48.16 C ATOM 2441 CG LYS B 157 8.635 -16.540 31.692 1.00 54.74 C ATOM 2442 CD LYS B 157 8.262 -18.015 31.748 1.00 55.52 C ATOM 2443 CE LYS B 157 9.181 -18.760 32.716 1.00 58.18 C ATOM 2444 NZ LYS B 157 8.461 -19.625 33.684 1.00 60.21 N ATOM 2445 HZ1 LYS B 157 7.818 -19.042 34.257 1.00 0.00 H ATOM 2446 HZ2 LYS B 157 7.913 -20.341 33.166 1.00 0.00 H ATOM 2447 HZ3 LYS B 157 9.150 -20.096 34.305 1.00 0.00 H ATOM 2448 H LYS B 157 6.800 -13.908 32.059 1.00 0.00 H ATOM 2449 N GLU B 158 7.295 -12.443 29.280 1.00 46.83 N ATOM 2450 CA GLU B 158 6.817 -11.694 28.117 1.00 56.78 C ATOM 2451 C GLU B 158 5.726 -12.433 27.339 1.00 55.04 C ATOM 2452 O GLU B 158 5.714 -12.436 26.107 1.00 59.85 O ATOM 2453 CB GLU B 158 7.990 -11.345 27.194 1.00 65.74 C ATOM 2454 CG GLU B 158 8.893 -10.182 27.671 1.00 78.25 C ATOM 2455 CD GLU B 158 8.157 -9.077 28.437 1.00 90.80 C ATOM 2456 OE1 GLU B 158 6.984 -8.773 28.104 1.00 97.15 O ATOM 2457 OE2 GLU B 158 8.744 -8.533 29.403 1.00 91.59 O ATOM 2458 H GLU B 158 7.257 -11.985 30.213 1.00 0.00 H ATOM 2459 N MET B 159 4.817 -13.064 28.075 1.00 48.70 N ATOM 2460 CA MET B 159 3.647 -13.715 27.494 1.00 46.29 C ATOM 2461 C MET B 159 2.395 -13.096 28.098 1.00 36.96 C ATOM 2462 O MET B 159 1.518 -13.802 28.586 1.00 39.26 O ATOM 2463 CB MET B 159 3.673 -15.222 27.781 1.00 50.51 C ATOM 2464 CG MET B 159 4.935 -15.921 27.332 1.00 57.88 C ATOM 2465 SD MET B 159 4.942 -17.662 27.789 1.00 69.97 S ATOM 2466 CE MET B 159 4.825 -17.550 29.569 1.00 62.86 C ATOM 2467 H MET B 159 4.944 -13.095 29.107 1.00 0.00 H ATOM 2468 N GLN B 160 2.300 -11.773 28.028 1.00 39.29 N ATOM 2469 CA GLN B 160 1.260 -11.024 28.735 1.00 46.61 C ATOM 2470 C GLN B 160 -0.137 -11.410 28.224 1.00 43.02 C ATOM 2471 O GLN B 160 -1.139 -11.214 28.914 1.00 39.17 O ATOM 2472 CB GLN B 160 1.532 -9.514 28.620 1.00 64.49 C ATOM 2473 CG GLN B 160 0.750 -8.675 29.620 1.00 78.99 C ATOM 2474 CD GLN B 160 1.652 -7.690 30.373 1.00 93.93 C ATOM 2475 OE1 GLN B 160 2.840 -7.549 30.060 1.00 99.05 O ATOM 2476 NE2 GLN B 160 1.093 -7.024 31.381 1.00 95.89 N ATOM 2477 HE22 GLN B 160 0.090 -7.173 31.610 1.00 0.00 H ATOM 2478 HE21 GLN B 160 1.660 -6.354 31.940 1.00 0.00 H ATOM 2479 H GLN B 160 2.989 -11.251 27.450 1.00 0.00 H ATOM 2480 N VAL B 161 -0.188 -11.963 27.015 1.00 40.47 N ATOM 2481 CA VAL B 161 -1.443 -12.421 26.420 1.00 44.53 C ATOM 2482 C VAL B 161 -2.114 -13.509 27.266 1.00 45.60 C ATOM 2483 O VAL B 161 -3.338 -13.689 27.216 1.00 41.83 O ATOM 2484 CB VAL B 161 -1.207 -12.978 24.989 1.00 58.01 C ATOM 2485 CG1 VAL B 161 -0.308 -14.211 25.018 1.00 59.57 C ATOM 2486 CG2 VAL B 161 -2.524 -13.286 24.292 1.00 64.34 C ATOM 2487 H VAL B 161 0.694 -12.073 26.475 1.00 0.00 H ATOM 2488 N LEU B 162 -1.322 -14.219 28.068 1.00 33.74 N ATOM 2489 CA LEU B 162 -1.866 -15.300 28.865 1.00 32.12 C ATOM 2490 C LEU B 162 -2.697 -14.789 30.041 1.00 35.43 C ATOM 2491 O LEU B 162 -3.544 -15.510 30.548 1.00 29.57 O ATOM 2492 CB LEU B 162 -0.733 -16.196 29.385 1.00 33.48 C ATOM 2493 CG LEU B 162 0.076 -16.947 28.319 1.00 45.66 C ATOM 2494 CD1 LEU B 162 1.082 -17.911 28.956 1.00 41.04 C ATOM 2495 CD2 LEU B 162 -0.845 -17.682 27.348 1.00 55.25 C ATOM 2496 H LEU B 162 -0.308 -13.996 28.122 1.00 0.00 H ATOM 2497 N VAL B 163 -2.480 -13.543 30.458 1.00 35.03 N ATOM 2498 CA VAL B 163 -3.188 -13.035 31.634 1.00 30.63 C ATOM 2499 C VAL B 163 -4.699 -13.066 31.422 1.00 24.25 C ATOM 2500 O VAL B 163 -5.436 -13.547 32.282 1.00 25.97 O ATOM 2501 CB VAL B 163 -2.753 -11.590 32.000 1.00 32.66 C ATOM 2502 CG1 VAL B 163 -3.667 -11.021 33.079 1.00 30.42 C ATOM 2503 CG2 VAL B 163 -1.306 -11.581 32.483 1.00 27.93 C ATOM 2504 H VAL B 163 -1.809 -12.932 29.949 1.00 0.00 H ATOM 2505 N SER B 164 -5.150 -12.589 30.267 1.00 28.02 N ATOM 2506 CA SER B 164 -6.584 -12.605 29.971 1.00 28.95 C ATOM 2507 C SER B 164 -7.092 -14.045 29.856 1.00 32.88 C ATOM 2508 O SER B 164 -8.199 -14.380 30.278 1.00 28.02 O ATOM 2509 CB SER B 164 -6.881 -11.824 28.685 1.00 40.20 C ATOM 2510 OG SER B 164 -6.219 -12.388 27.559 1.00 44.80 O ATOM 2511 HG SER B 164 -5.241 -12.375 27.712 1.00 0.00 H ATOM 2512 H SER B 164 -4.482 -12.203 29.570 1.00 0.00 H ATOM 2513 N ARG B 165 -6.250 -14.904 29.311 1.00 33.79 N ATOM 2514 CA ARG B 165 -6.601 -16.310 29.128 1.00 28.78 C ATOM 2515 C ARG B 165 -6.768 -17.005 30.487 1.00 27.29 C ATOM 2516 O ARG B 165 -7.713 -17.770 30.718 1.00 25.13 O ATOM 2517 CB ARG B 165 -5.529 -16.970 28.272 1.00 39.30 C ATOM 2518 CG ARG B 165 -5.827 -18.359 27.823 1.00 54.99 C ATOM 2519 CD ARG B 165 -4.761 -18.829 26.843 1.00 57.28 C ATOM 2520 NE ARG B 165 -4.749 -18.050 25.614 1.00 51.81 N ATOM 2521 CZ ARG B 165 -3.865 -18.227 24.639 1.00 54.05 C ATOM 2522 NH1 ARG B 165 -2.917 -19.147 24.767 1.00 52.94 N ATOM 2523 NH2 ARG B 165 -3.920 -17.485 23.546 1.00 60.59 N ATOM 2524 HE ARG B 165 -5.473 -17.314 25.492 1.00 0.00 H ATOM 2525 HH12 ARG B 165 -2.223 -19.288 24.005 1.00 0.00 H ATOM 2526 HH11 ARG B 165 -2.868 -19.727 25.629 1.00 0.00 H ATOM 2527 HH22 ARG B 165 -3.225 -17.628 22.785 1.00 0.00 H ATOM 2528 HH21 ARG B 165 -4.658 -16.759 23.447 1.00 0.00 H ATOM 2529 H ARG B 165 -5.314 -14.571 29.004 1.00 0.00 H ATOM 2530 N ILE B 166 -5.846 -16.725 31.392 1.00 22.90 N ATOM 2531 CA ILE B 166 -5.888 -17.296 32.731 1.00 23.59 C ATOM 2532 C ILE B 166 -7.151 -16.863 33.464 1.00 23.48 C ATOM 2533 O ILE B 166 -7.807 -17.671 34.122 1.00 23.31 O ATOM 2534 CB ILE B 166 -4.625 -16.882 33.533 1.00 26.51 C ATOM 2535 CG1 ILE B 166 -3.395 -17.561 32.922 1.00 27.45 C ATOM 2536 CG2 ILE B 166 -4.759 -17.248 35.010 1.00 23.56 C ATOM 2537 CD1 ILE B 166 -2.086 -16.853 33.224 1.00 25.74 C ATOM 2538 H ILE B 166 -5.070 -16.080 31.141 1.00 0.00 H ATOM 2539 N ALA B 167 -7.500 -15.586 33.335 1.00 22.87 N ATOM 2540 CA ALA B 167 -8.696 -15.082 33.994 1.00 25.04 C ATOM 2541 C ALA B 167 -9.921 -15.850 33.506 1.00 26.75 C ATOM 2542 O ALA B 167 -10.793 -16.209 34.290 1.00 26.97 O ATOM 2543 CB ALA B 167 -8.867 -13.584 33.739 1.00 25.55 C ATOM 2544 H ALA B 167 -6.916 -14.945 32.761 1.00 0.00 H ATOM 2545 N ALA B 168 -9.990 -16.077 32.200 1.00 24.48 N ATOM 2546 CA ALA B 168 -11.106 -16.838 31.625 1.00 24.40 C ATOM 2547 C ALA B 168 -11.124 -18.306 32.082 1.00 28.54 C ATOM 2548 O ALA B 168 -12.188 -18.874 32.359 1.00 27.04 O ATOM 2549 CB ALA B 168 -11.054 -16.759 30.095 1.00 27.52 C ATOM 2550 H ALA B 168 -9.243 -15.711 31.576 1.00 0.00 H ATOM 2551 N TRP B 169 -9.949 -18.923 32.137 1.00 24.53 N ATOM 2552 CA TRP B 169 -9.818 -20.295 32.649 1.00 27.18 C ATOM 2553 C TRP B 169 -10.324 -20.404 34.078 1.00 25.80 C ATOM 2554 O TRP B 169 -11.022 -21.352 34.439 1.00 25.20 O ATOM 2555 CB TRP B 169 -8.368 -20.744 32.620 1.00 23.98 C ATOM 2556 CG TRP B 169 -7.778 -20.902 31.265 1.00 24.09 C ATOM 2557 CD1 TRP B 169 -8.419 -20.957 30.056 1.00 27.21 C ATOM 2558 CD2 TRP B 169 -6.382 -21.017 30.987 1.00 26.43 C ATOM 2559 NE1 TRP B 169 -7.491 -21.112 29.040 1.00 31.60 N ATOM 2560 CE2 TRP B 169 -6.236 -21.151 29.604 1.00 28.33 C ATOM 2561 CE3 TRP B 169 -5.236 -21.017 31.813 1.00 24.99 C ATOM 2562 CZ2 TRP B 169 -4.979 -21.294 29.007 1.00 38.03 C ATOM 2563 CZ3 TRP B 169 -4.005 -21.156 31.220 1.00 29.14 C ATOM 2564 CH2 TRP B 169 -3.874 -21.282 29.844 1.00 28.47 C ATOM 2565 HE1 TRP B 169 -7.705 -21.186 28.025 1.00 0.00 H ATOM 2566 H TRP B 169 -9.099 -18.422 31.809 1.00 0.00 H ATOM 2567 N MET B 170 -9.946 -19.432 34.903 1.00 23.36 N ATOM 2568 CA MET B 170 -10.370 -19.453 36.294 1.00 25.10 C ATOM 2569 C MET B 170 -11.896 -19.342 36.381 1.00 25.69 C ATOM 2570 O MET B 170 -12.521 -20.075 37.144 1.00 26.43 O ATOM 2571 CB MET B 170 -9.668 -18.334 37.086 1.00 24.82 C ATOM 2572 CG MET B 170 -8.178 -18.583 37.264 1.00 23.49 C ATOM 2573 SD MET B 170 -7.405 -17.151 38.042 1.00 24.79 S ATOM 2574 CE MET B 170 -8.142 -17.320 39.667 1.00 25.90 C ATOM 2575 H MET B 170 -9.347 -18.657 34.554 1.00 0.00 H ATOM 2576 N ALA B 171 -12.503 -18.473 35.565 1.00 27.86 N ATOM 2577 CA ALA B 171 -13.959 -18.349 35.559 1.00 31.18 C ATOM 2578 C ALA B 171 -14.620 -19.661 35.149 1.00 33.60 C ATOM 2579 O ALA B 171 -15.603 -20.107 35.754 1.00 29.84 O ATOM 2580 CB ALA B 171 -14.426 -17.201 34.606 1.00 30.28 C ATOM 2581 H ALA B 171 -11.933 -17.880 34.929 1.00 0.00 H ATOM 2582 N THR B 172 -14.062 -20.278 34.117 1.00 29.27 N ATOM 2583 CA THR B 172 -14.574 -21.537 33.611 1.00 29.46 C ATOM 2584 C THR B 172 -14.449 -22.640 34.661 1.00 30.00 C ATOM 2585 O THR B 172 -15.397 -23.392 34.890 1.00 31.92 O ATOM 2586 CB THR B 172 -13.832 -21.954 32.328 1.00 31.99 C ATOM 2587 OG1 THR B 172 -14.152 -21.027 31.270 1.00 37.21 O ATOM 2588 CG2 THR B 172 -14.253 -23.351 31.914 1.00 33.80 C ATOM 2589 HG1 THR B 172 -13.871 -20.116 31.535 1.00 0.00 H ATOM 2590 H THR B 172 -13.234 -19.847 33.658 1.00 0.00 H ATOM 2591 N TYR B 173 -13.292 -22.712 35.313 1.00 26.39 N ATOM 2592 CA TYR B 173 -13.083 -23.730 36.339 1.00 28.41 C ATOM 2593 C TYR B 173 -14.016 -23.521 37.531 1.00 26.74 C ATOM 2594 O TYR B 173 -14.610 -24.458 38.051 1.00 29.93 O ATOM 2595 CB TYR B 173 -11.629 -23.738 36.827 1.00 22.08 C ATOM 2596 CG TYR B 173 -11.337 -25.023 37.564 1.00 25.32 C ATOM 2597 CD1 TYR B 173 -11.649 -25.159 38.919 1.00 22.77 C ATOM 2598 CD2 TYR B 173 -10.807 -26.117 36.895 1.00 24.14 C ATOM 2599 CE1 TYR B 173 -11.425 -26.339 39.591 1.00 25.38 C ATOM 2600 CE2 TYR B 173 -10.572 -27.322 37.569 1.00 28.96 C ATOM 2601 CZ TYR B 173 -10.896 -27.417 38.913 1.00 29.95 C ATOM 2602 OH TYR B 173 -10.671 -28.590 39.593 1.00 30.18 O ATOM 2603 HH TYR B 173 -11.188 -29.320 39.169 1.00 0.00 H ATOM 2604 H TYR B 173 -12.531 -22.039 35.091 1.00 0.00 H ATOM 2605 N LEU B 174 -14.122 -22.270 37.956 1.00 25.53 N ATOM 2606 CA LEU B 174 -15.016 -21.867 39.029 1.00 33.55 C ATOM 2607 C LEU B 174 -16.450 -22.316 38.711 1.00 36.39 C ATOM 2608 O LEU B 174 -17.102 -22.974 39.523 1.00 36.26 O ATOM 2609 CB LEU B 174 -14.915 -20.350 39.207 1.00 40.08 C ATOM 2610 CG LEU B 174 -15.201 -19.644 40.523 1.00 52.01 C ATOM 2611 CD1 LEU B 174 -14.429 -20.307 41.638 1.00 42.78 C ATOM 2612 CD2 LEU B 174 -14.775 -18.187 40.389 1.00 54.26 C ATOM 2613 H LEU B 174 -13.537 -21.541 37.500 1.00 0.00 H ATOM 2614 N ASN B 175 -16.938 -21.975 37.517 1.00 34.38 N ATOM 2615 CA ASN B 175 -18.282 -22.371 37.112 1.00 31.96 C ATOM 2616 C ASN B 175 -18.475 -23.877 36.991 1.00 42.37 C ATOM 2617 O ASN B 175 -19.500 -24.406 37.421 1.00 42.99 O ATOM 2618 CB ASN B 175 -18.668 -21.728 35.772 1.00 34.85 C ATOM 2619 CG ASN B 175 -19.052 -20.277 35.898 1.00 39.17 C ATOM 2620 OD1 ASN B 175 -20.203 -19.964 36.214 1.00 43.59 O ATOM 2621 ND2 ASN B 175 -18.111 -19.382 35.635 1.00 46.25 N ATOM 2622 HD22 ASN B 175 -17.155 -19.695 35.373 1.00 0.00 H ATOM 2623 HD21 ASN B 175 -18.329 -18.367 35.691 1.00 0.00 H ATOM 2624 H ASN B 175 -16.350 -21.418 36.864 1.00 0.00 H ATOM 2625 N ASP B 176 -17.491 -24.570 36.421 1.00 38.58 N ATOM 2626 CA ASP B 176 -17.661 -25.989 36.118 1.00 32.24 C ATOM 2627 C ASP B 176 -17.512 -26.874 37.349 1.00 36.14 C ATOM 2628 O ASP B 176 -18.212 -27.877 37.479 1.00 35.98 O ATOM 2629 CB ASP B 176 -16.637 -26.454 35.073 1.00 36.49 C ATOM 2630 CG ASP B 176 -16.970 -25.987 33.669 1.00 43.39 C ATOM 2631 OD1 ASP B 176 -18.001 -25.308 33.500 1.00 38.39 O ATOM 2632 OD2 ASP B 176 -16.207 -26.326 32.738 1.00 39.45 O ATOM 2633 H ASP B 176 -16.594 -24.097 36.190 1.00 0.00 H ATOM 2634 N HIS B 177 -16.587 -26.509 38.235 1.00 33.09 N ATOM 2635 CA HIS B 177 -16.152 -27.442 39.281 1.00 35.34 C ATOM 2636 C HIS B 177 -16.328 -26.969 40.721 1.00 38.23 C ATOM 2637 O HIS B 177 -16.425 -27.789 41.628 1.00 41.60 O ATOM 2638 CB HIS B 177 -14.684 -27.805 39.066 1.00 34.89 C ATOM 2639 CG HIS B 177 -14.421 -28.454 37.746 1.00 42.24 C ATOM 2640 ND1 HIS B 177 -14.811 -29.744 37.460 1.00 55.08 N ATOM 2641 CD2 HIS B 177 -13.803 -27.991 36.633 1.00 36.29 C ATOM 2642 CE1 HIS B 177 -14.456 -30.045 36.223 1.00 55.93 C ATOM 2643 NE2 HIS B 177 -13.840 -29.000 35.700 1.00 38.90 N ATOM 2644 H HIS B 177 -16.171 -25.557 38.185 1.00 0.00 H ATOM 2645 N LEU B 178 -16.362 -25.664 40.950 1.00 36.52 N ATOM 2646 CA LEU B 178 -16.312 -25.186 42.326 1.00 35.98 C ATOM 2647 C LEU B 178 -17.619 -24.568 42.757 1.00 39.32 C ATOM 2648 O LEU B 178 -17.996 -24.664 43.924 1.00 36.57 O ATOM 2649 CB LEU B 178 -15.174 -24.172 42.505 1.00 33.29 C ATOM 2650 CG LEU B 178 -13.786 -24.744 42.227 1.00 32.60 C ATOM 2651 CD1 LEU B 178 -12.720 -23.662 42.326 1.00 30.34 C ATOM 2652 CD2 LEU B 178 -13.519 -25.864 43.223 1.00 29.39 C ATOM 2653 H LEU B 178 -16.423 -24.991 40.160 1.00 0.00 H ATOM 2654 N GLU B 179 -18.335 -23.964 41.811 1.00 43.18 N ATOM 2655 CA GLU B 179 -19.547 -23.251 42.174 1.00 43.35 C ATOM 2656 C GLU B 179 -20.598 -24.148 42.839 1.00 45.69 C ATOM 2657 O GLU B 179 -21.267 -23.698 43.766 1.00 45.14 O ATOM 2658 CB GLU B 179 -20.162 -22.563 40.948 1.00 50.18 C ATOM 2659 CG GLU B 179 -19.693 -21.121 40.772 1.00 60.02 C ATOM 2660 CD GLU B 179 -20.212 -20.206 41.862 1.00 63.57 C ATOM 2661 OE1 GLU B 179 -21.296 -20.488 42.413 1.00 66.29 O ATOM 2662 OE2 GLU B 179 -19.536 -19.202 42.168 1.00 68.76 O ATOM 2663 H GLU B 179 -18.028 -24.003 40.818 1.00 0.00 H ATOM 2664 N PRO B 180 -20.760 -25.409 42.377 1.00 49.05 N ATOM 2665 CA PRO B 180 -21.717 -26.240 43.118 1.00 52.30 C ATOM 2666 C PRO B 180 -21.315 -26.455 44.576 1.00 53.56 C ATOM 2667 O PRO B 180 -22.181 -26.403 45.452 1.00 53.81 O ATOM 2668 CB PRO B 180 -21.715 -27.559 42.338 1.00 59.07 C ATOM 2669 CG PRO B 180 -21.362 -27.160 40.948 1.00 58.39 C ATOM 2670 CD PRO B 180 -20.332 -26.068 41.129 1.00 49.33 C ATOM 2671 N TRP B 181 -20.028 -26.706 44.824 1.00 53.28 N ATOM 2672 CA TRP B 181 -19.529 -26.871 46.189 1.00 46.41 C ATOM 2673 C TRP B 181 -19.692 -25.590 47.013 1.00 44.22 C ATOM 2674 O TRP B 181 -20.103 -25.643 48.172 1.00 45.75 O ATOM 2675 CB TRP B 181 -18.055 -27.295 46.187 1.00 47.15 C ATOM 2676 CG TRP B 181 -17.505 -27.555 47.571 1.00 42.00 C ATOM 2677 CD1 TRP B 181 -17.439 -28.757 48.219 1.00 42.37 C ATOM 2678 CD2 TRP B 181 -16.958 -26.580 48.476 1.00 45.69 C ATOM 2679 NE1 TRP B 181 -16.873 -28.591 49.466 1.00 44.12 N ATOM 2680 CE2 TRP B 181 -16.573 -27.264 49.647 1.00 43.91 C ATOM 2681 CE3 TRP B 181 -16.753 -25.195 48.406 1.00 45.30 C ATOM 2682 CZ2 TRP B 181 -15.999 -26.609 50.741 1.00 41.69 C ATOM 2683 CZ3 TRP B 181 -16.179 -24.547 49.492 1.00 41.10 C ATOM 2684 CH2 TRP B 181 -15.810 -25.256 50.643 1.00 39.60 C ATOM 2685 HE1 TRP B 181 -16.701 -29.349 50.157 1.00 0.00 H ATOM 2686 H TRP B 181 -19.364 -26.786 44.028 1.00 0.00 H ATOM 2687 N ILE B 182 -19.362 -24.445 46.420 1.00 39.19 N ATOM 2688 CA ILE B 182 -19.448 -23.175 47.138 1.00 37.87 C ATOM 2689 C ILE B 182 -20.877 -22.918 47.622 1.00 47.97 C ATOM 2690 O ILE B 182 -21.093 -22.509 48.766 1.00 49.03 O ATOM 2691 CB ILE B 182 -18.974 -21.982 46.267 1.00 37.30 C ATOM 2692 CG1 ILE B 182 -17.465 -22.060 46.031 1.00 34.00 C ATOM 2693 CG2 ILE B 182 -19.331 -20.660 46.926 1.00 39.57 C ATOM 2694 CD1 ILE B 182 -16.953 -21.076 44.988 1.00 35.83 C ATOM 2695 H ILE B 182 -19.038 -24.454 45.432 1.00 0.00 H ATOM 2696 N GLN B 183 -21.849 -23.197 46.758 1.00 47.63 N ATOM 2697 CA GLN B 183 -23.245 -22.927 47.075 1.00 55.71 C ATOM 2698 C GLN B 183 -23.774 -23.846 48.177 1.00 65.43 C ATOM 2699 O GLN B 183 -24.625 -23.443 48.975 1.00 68.85 O ATOM 2700 CB GLN B 183 -24.101 -23.073 45.814 1.00 59.61 C ATOM 2701 CG GLN B 183 -24.996 -21.873 45.511 1.00 73.39 C ATOM 2702 CD GLN B 183 -24.208 -20.683 44.990 1.00 82.56 C ATOM 2703 OE1 GLN B 183 -23.320 -20.833 44.150 1.00 84.78 O ATOM 2704 NE2 GLN B 183 -24.531 -19.492 45.484 1.00 85.39 N ATOM 2705 HE22 GLN B 183 -25.288 -19.411 46.192 1.00 0.00 H ATOM 2706 HE21 GLN B 183 -24.027 -18.641 45.162 1.00 0.00 H ATOM 2707 H GLN B 183 -21.608 -23.616 45.837 1.00 0.00 H ATOM 2708 N GLU B 184 -23.290 -25.084 48.213 1.00 68.34 N ATOM 2709 CA GLU B 184 -23.708 -26.019 49.255 1.00 70.15 C ATOM 2710 C GLU B 184 -22.963 -25.792 50.575 1.00 62.71 C ATOM 2711 O GLU B 184 -23.354 -26.318 51.614 1.00 69.69 O ATOM 2712 CB GLU B 184 -23.570 -27.465 48.776 1.00 79.13 C ATOM 2713 CG GLU B 184 -24.590 -27.804 47.699 1.00 90.82 C ATOM 2714 CD GLU B 184 -24.487 -29.230 47.204 1.00 96.83 C ATOM 2715 OE1 GLU B 184 -23.354 -29.724 47.018 1.00 96.14 O ATOM 2716 OE2 GLU B 184 -25.548 -29.860 47.001 1.00102.32 O ATOM 2717 H GLU B 184 -22.606 -25.390 47.491 1.00 0.00 H ATOM 2718 N ASN B 185 -21.866 -25.041 50.530 1.00 55.76 N ATOM 2719 CA ASN B 185 -21.084 -24.811 51.739 1.00 55.35 C ATOM 2720 C ASN B 185 -21.200 -23.374 52.239 1.00 60.72 C ATOM 2721 O ASN B 185 -20.298 -22.862 52.898 1.00 63.56 O ATOM 2722 CB ASN B 185 -19.622 -25.165 51.494 1.00 52.21 C ATOM 2723 CG ASN B 185 -19.403 -26.659 51.393 1.00 57.78 C ATOM 2724 OD1 ASN B 185 -19.058 -27.321 52.373 1.00 60.75 O ATOM 2725 ND2 ASN B 185 -19.624 -27.203 50.205 1.00 56.51 N ATOM 2726 HD22 ASN B 185 -19.914 -26.605 49.405 1.00 0.00 H ATOM 2727 HD21 ASN B 185 -19.507 -28.228 50.073 1.00 0.00 H ATOM 2728 H ASN B 185 -21.565 -24.616 49.630 1.00 0.00 H ATOM 2729 N GLY B 186 -22.326 -22.735 51.925 1.00 57.15 N ATOM 2730 CA GLY B 186 -22.677 -21.459 52.518 1.00 62.21 C ATOM 2731 C GLY B 186 -22.382 -20.246 51.659 1.00 61.18 C ATOM 2732 O GLY B 186 -22.666 -19.115 52.054 1.00 61.25 O ATOM 2733 H GLY B 186 -22.973 -23.164 51.233 1.00 0.00 H ATOM 2734 N GLY B 187 -21.830 -20.478 50.473 1.00 59.19 N ATOM 2735 CA GLY B 187 -21.526 -19.397 49.554 1.00 57.40 C ATOM 2736 C GLY B 187 -20.336 -18.566 50.000 1.00 54.74 C ATOM 2737 O GLY B 187 -19.728 -18.829 51.038 1.00 54.37 O ATOM 2738 H GLY B 187 -21.611 -21.456 50.197 1.00 0.00 H ATOM 2739 N TRP B 188 -20.003 -17.552 49.208 1.00 53.45 N ATOM 2740 CA TRP B 188 -18.863 -16.689 49.505 1.00 47.16 C ATOM 2741 C TRP B 188 -19.033 -15.893 50.797 1.00 48.55 C ATOM 2742 O TRP B 188 -18.044 -15.494 51.415 1.00 46.88 O ATOM 2743 CB TRP B 188 -18.600 -15.729 48.339 1.00 38.69 C ATOM 2744 CG TRP B 188 -17.894 -16.381 47.193 1.00 35.58 C ATOM 2745 CD1 TRP B 188 -18.415 -16.703 45.972 1.00 40.31 C ATOM 2746 CD2 TRP B 188 -16.540 -16.840 47.186 1.00 39.18 C ATOM 2747 NE1 TRP B 188 -17.453 -17.306 45.192 1.00 41.03 N ATOM 2748 CE2 TRP B 188 -16.294 -17.403 45.916 1.00 41.33 C ATOM 2749 CE3 TRP B 188 -15.503 -16.813 48.127 1.00 39.39 C ATOM 2750 CZ2 TRP B 188 -15.054 -17.942 45.566 1.00 38.60 C ATOM 2751 CZ3 TRP B 188 -14.272 -17.347 47.776 1.00 37.91 C ATOM 2752 CH2 TRP B 188 -14.057 -17.901 46.505 1.00 34.02 C ATOM 2753 HE1 TRP B 188 -17.585 -17.634 44.214 1.00 0.00 H ATOM 2754 H TRP B 188 -20.569 -17.368 48.355 1.00 0.00 H ATOM 2755 N ASP B 189 -20.279 -15.659 51.199 1.00 46.65 N ATOM 2756 CA ASP B 189 -20.552 -14.989 52.466 1.00 55.57 C ATOM 2757 C ASP B 189 -19.985 -15.801 53.628 1.00 56.90 C ATOM 2758 O ASP B 189 -19.529 -15.247 54.633 1.00 55.42 O ATOM 2759 CB ASP B 189 -22.055 -14.762 52.660 1.00 59.18 C ATOM 2760 CG ASP B 189 -22.602 -13.665 51.763 1.00 63.38 C ATOM 2761 OD1 ASP B 189 -21.794 -12.906 51.184 1.00 60.82 O ATOM 2762 OD2 ASP B 189 -23.841 -13.553 51.650 1.00 64.29 O ATOM 2763 H ASP B 189 -21.074 -15.959 50.599 1.00 0.00 H ATOM 2764 N THR B 190 -20.043 -17.120 53.495 1.00 56.39 N ATOM 2765 CA THR B 190 -19.515 -18.004 54.522 1.00 56.75 C ATOM 2766 C THR B 190 -17.991 -17.983 54.485 1.00 52.26 C ATOM 2767 O THR B 190 -17.332 -18.057 55.521 1.00 51.32 O ATOM 2768 CB THR B 190 -20.042 -19.435 54.357 1.00 54.72 C ATOM 2769 OG1 THR B 190 -21.462 -19.433 54.549 1.00 53.70 O ATOM 2770 CG2 THR B 190 -19.407 -20.362 55.380 1.00 52.80 C ATOM 2771 HG1 THR B 190 -21.884 -18.841 53.877 1.00 0.00 H ATOM 2772 H THR B 190 -20.474 -17.529 52.641 1.00 0.00 H ATOM 2773 N PHE B 191 -17.423 -17.889 53.290 1.00 42.73 N ATOM 2774 CA PHE B 191 -15.976 -17.714 53.184 1.00 39.96 C ATOM 2775 C PHE B 191 -15.515 -16.464 53.928 1.00 46.05 C ATOM 2776 O PHE B 191 -14.518 -16.499 54.650 1.00 47.63 O ATOM 2777 CB PHE B 191 -15.524 -17.633 51.728 1.00 39.58 C ATOM 2778 CG PHE B 191 -14.071 -17.268 51.573 1.00 38.26 C ATOM 2779 CD1 PHE B 191 -13.081 -18.210 51.796 1.00 36.76 C ATOM 2780 CD2 PHE B 191 -13.693 -15.983 51.209 1.00 36.31 C ATOM 2781 CE1 PHE B 191 -11.735 -17.886 51.659 1.00 37.23 C ATOM 2782 CE2 PHE B 191 -12.344 -15.648 51.069 1.00 38.64 C ATOM 2783 CZ PHE B 191 -11.363 -16.605 51.297 1.00 32.48 C ATOM 2784 H PHE B 191 -18.006 -17.940 52.430 1.00 0.00 H ATOM 2785 N VAL B 192 -16.246 -15.364 53.747 1.00 42.24 N ATOM 2786 CA VAL B 192 -15.877 -14.095 54.370 1.00 45.75 C ATOM 2787 C VAL B 192 -15.888 -14.174 55.895 1.00 49.19 C ATOM 2788 O VAL B 192 -14.963 -13.699 56.553 1.00 52.90 O ATOM 2789 CB VAL B 192 -16.818 -12.958 53.909 1.00 49.75 C ATOM 2790 CG1 VAL B 192 -16.600 -11.698 54.726 1.00 53.88 C ATOM 2791 CG2 VAL B 192 -16.619 -12.676 52.430 1.00 45.11 C ATOM 2792 H VAL B 192 -17.096 -15.410 53.150 1.00 0.00 H ATOM 2793 N GLU B 193 -16.907 -14.805 56.459 1.00 54.65 N ATOM 2794 CA GLU B 193 -16.968 -14.920 57.912 1.00 63.24 C ATOM 2795 C GLU B 193 -15.857 -15.844 58.445 1.00 58.92 C ATOM 2796 O GLU B 193 -15.363 -15.641 59.550 1.00 63.41 O ATOM 2797 CB GLU B 193 -18.368 -15.369 58.358 1.00 73.77 C ATOM 2798 CG GLU B 193 -18.891 -16.610 57.678 1.00 81.26 C ATOM 2799 CD GLU B 193 -20.239 -17.057 58.221 1.00 90.08 C ATOM 2800 OE1 GLU B 193 -20.721 -16.442 59.195 1.00 91.63 O ATOM 2801 OE2 GLU B 193 -20.812 -18.029 57.680 1.00 95.54 O ATOM 2802 H GLU B 193 -17.659 -15.216 55.870 1.00 0.00 H ATOM 2803 N LEU B 194 -15.431 -16.820 57.647 1.00 54.92 N ATOM 2804 CA LEU B 194 -14.394 -17.759 58.083 1.00 58.35 C ATOM 2805 C LEU B 194 -12.973 -17.231 57.848 1.00 53.10 C ATOM 2806 O LEU B 194 -12.067 -17.492 58.638 1.00 55.34 O ATOM 2807 CB LEU B 194 -14.553 -19.104 57.368 1.00 46.33 C ATOM 2808 CG LEU B 194 -15.772 -19.977 57.668 1.00 55.42 C ATOM 2809 CD1 LEU B 194 -15.800 -21.163 56.717 1.00 56.58 C ATOM 2810 CD2 LEU B 194 -15.755 -20.457 59.114 1.00 58.32 C ATOM 2811 H LEU B 194 -15.842 -16.918 56.697 1.00 0.00 H ATOM 2812 N TYR B 195 -12.781 -16.476 56.774 1.00 45.04 N ATOM 2813 CA TYR B 195 -11.438 -16.075 56.369 1.00 48.42 C ATOM 2814 C TYR B 195 -11.198 -14.574 56.457 1.00 53.55 C ATOM 2815 O TYR B 195 -10.069 -14.110 56.293 1.00 57.66 O ATOM 2816 CB TYR B 195 -11.150 -16.588 54.953 1.00 47.48 C ATOM 2817 CG TYR B 195 -10.878 -18.076 54.945 1.00 52.22 C ATOM 2818 CD1 TYR B 195 -9.574 -18.555 54.914 1.00 49.60 C ATOM 2819 CD2 TYR B 195 -11.914 -18.999 55.030 1.00 53.08 C ATOM 2820 CE1 TYR B 195 -9.306 -19.906 54.936 1.00 46.69 C ATOM 2821 CE2 TYR B 195 -11.653 -20.361 55.057 1.00 49.13 C ATOM 2822 CZ TYR B 195 -10.342 -20.807 55.006 1.00 48.40 C ATOM 2823 OH TYR B 195 -10.053 -22.153 55.033 1.00 48.77 O ATOM 2824 HH TYR B 195 -10.400 -22.547 55.872 1.00 0.00 H ATOM 2825 H TYR B 195 -13.600 -16.166 56.213 1.00 0.00 H ATOM 2826 N GLY B 196 -12.262 -13.820 56.710 1.00 51.34 N ATOM 2827 CA GLY B 196 -12.147 -12.383 56.864 1.00 57.72 C ATOM 2828 C GLY B 196 -11.683 -12.033 58.266 1.00 56.71 C ATOM 2829 O GLY B 196 -11.129 -10.960 58.496 1.00 66.11 O ATOM 2830 H GLY B 196 -13.196 -14.269 56.799 1.00 0.00 H TER 2831 GLY B 196 HETATM 2832 O HOH 1 -14.881 30.143 44.557 1.00 47.15 O HETATM 2833 O HOH 2 1.037 23.976 44.035 1.00 42.49 O HETATM 2834 O HOH 3 -3.586 22.249 59.201 1.00 28.15 O HETATM 2835 O HOH 4 -4.656 7.319 54.012 1.00 48.17 O HETATM 2836 O HOH 5 -11.738 24.361 56.786 1.00 47.24 O HETATM 2837 O HOH 6 1.674 21.082 47.509 1.00 44.66 O HETATM 2838 O HOH 7 -7.296 21.130 59.302 1.00 55.15 O HETATM 2839 O HOH 8 -9.171 28.511 46.560 1.00 31.02 O HETATM 2840 O HOH 9 -0.250 31.310 41.912 1.00 60.56 O HETATM 2841 O HOH 10 -9.457 22.480 57.640 1.00 56.82 O HETATM 2842 O HOH 11 -10.869 27.885 55.561 1.00 60.62 O HETATM 2843 O HOH 12 -1.998 24.893 47.509 1.00 27.80 O HETATM 2844 O HOH 13 -1.099 28.505 44.992 1.00 55.44 O HETATM 2845 O HOH 14 -2.787 27.573 46.798 1.00 39.37 O HETATM 2846 O HOH 15 -6.908 19.499 25.933 1.00 18.14 O HETATM 2847 O HOH 16 -13.939 13.174 30.824 1.00 18.58 O HETATM 2848 O HOH 17 -20.265 15.796 30.312 1.00 19.80 O HETATM 2849 O HOH 18 -4.550 19.325 24.667 1.00 19.20 O HETATM 2850 O HOH 19 -16.891 10.791 32.906 1.00 18.68 O HETATM 2851 O HOH 20 -20.235 21.337 34.194 1.00 22.29 O HETATM 2852 O HOH 21 -9.701 15.096 25.428 1.00 20.53 O HETATM 2853 O HOH 22 1.668 16.554 33.907 1.00 21.83 O HETATM 2854 O HOH 23 -19.453 10.324 31.959 1.00 20.61 O HETATM 2855 O HOH 24 -26.150 13.988 39.926 1.00 25.03 O HETATM 2856 O HOH 25 -5.698 10.298 29.832 1.00 24.11 O HETATM 2857 O HOH 26 -28.107 22.954 45.156 1.00 33.13 O HETATM 2858 O HOH 27 -2.942 8.867 29.293 1.00 28.32 O HETATM 2859 O HOH 28 -6.645 -0.084 30.038 1.00 30.09 O HETATM 2860 O HOH 29 -12.131 10.371 50.431 1.00 26.80 O HETATM 2861 O HOH 30 -20.844 18.197 52.666 1.00 30.57 O HETATM 2862 O HOH 31 -9.635 21.802 32.065 1.00 24.03 O HETATM 2863 O HOH 32 -19.864 -16.446 33.014 1.00 32.84 O HETATM 2864 O HOH 33 -23.733 24.078 36.155 1.00 34.32 O HETATM 2865 O HOH 34 -13.995 -14.803 30.752 1.00 30.19 O HETATM 2866 O HOH 35 -18.372 26.641 36.370 1.00 37.71 O HETATM 2867 O HOH 36 -0.694 5.674 49.407 1.00 31.93 O HETATM 2868 O HOH 37 -2.687 -2.046 38.969 1.00 32.13 O HETATM 2869 O HOH 38 -17.327 27.396 48.227 1.00 36.35 O HETATM 2870 O HOH 39 -8.043 12.916 25.223 1.00 31.86 O HETATM 2871 O HOH 40 0.025 2.219 39.176 1.00 32.61 O HETATM 2872 O HOH 41 -3.367 -4.591 38.406 1.00 28.68 O HETATM 2873 O HOH 42 -6.677 26.541 43.349 1.00 33.16 O HETATM 2874 O HOH 43 4.299 16.445 33.724 1.00 33.51 O HETATM 2875 O HOH 44 -10.077 -10.754 45.476 1.00 34.22 O HETATM 2876 O HOH 45 1.905 -11.495 43.400 1.00 31.78 O HETATM 2877 O HOH 46 2.674 -11.138 46.043 1.00 34.56 O HETATM 2878 O HOH 47 -13.296 9.266 52.566 1.00 36.10 O HETATM 2879 O HOH 48 -2.110 13.672 26.864 1.00 37.02 O HETATM 2880 O HOH 49 -8.368 -4.253 37.664 1.00 33.02 O HETATM 2881 O HOH 50 -2.293 3.420 49.911 1.00 30.64 O HETATM 2882 O HOH 51 0.765 2.811 41.790 1.00 35.58 O HETATM 2883 O HOH 52 -8.760 24.343 33.573 1.00 35.11 O HETATM 2884 O HOH 53 -4.793 11.564 27.335 1.00 39.77 O HETATM 2885 O HOH 54 -22.326 26.079 39.703 1.00 33.60 O HETATM 2886 O HOH 55 -0.326 6.715 51.957 1.00 33.39 O HETATM 2887 O HOH 56 -4.482 15.185 56.299 1.00 25.19 O HETATM 2888 O HOH 57 -9.135 -2.582 32.755 1.00 36.85 O HETATM 2889 O HOH 58 -17.763 29.153 40.665 1.00 32.15 O HETATM 2890 O HOH 59 -5.903 -3.698 28.200 1.00 43.87 O HETATM 2891 O HOH 60 2.201 5.657 32.791 1.00 38.23 O HETATM 2892 O HOH 61 -4.859 27.337 45.116 1.00 33.88 O HETATM 2893 O HOH 62 -20.674 23.930 56.734 1.00 40.97 O HETATM 2894 O HOH 63 -16.671 11.899 55.143 1.00 46.69 O HETATM 2895 O HOH 64 -20.753 25.692 32.977 1.00 40.39 O HETATM 2896 O HOH 65 0.881 17.006 44.019 1.00 41.15 O HETATM 2897 O HOH 66 -33.476 14.698 46.792 1.00 39.89 O HETATM 2898 O HOH 67 -12.957 -1.408 45.539 1.00 51.36 O HETATM 2899 O HOH 68 2.417 -4.747 33.882 1.00 45.03 O HETATM 2900 O HOH 69 -9.441 -1.819 35.755 1.00 39.36 O HETATM 2901 O HOH 70 -13.722 -7.311 33.418 1.00 40.36 O HETATM 2902 O HOH 71 -12.859 -6.428 39.645 1.00 39.16 O HETATM 2903 O HOH 72 1.838 5.743 44.754 1.00 34.66 O HETATM 2904 O HOH 73 -17.344 6.814 58.588 1.00 49.89 O HETATM 2905 O HOH 74 -27.175 6.316 45.791 1.00 37.89 O HETATM 2906 O HOH 75 -16.705 28.884 43.350 1.00 34.62 O HETATM 2907 O HOH 76 -3.863 -1.732 28.833 1.00 39.46 O HETATM 2908 O HOH 77 3.317 5.770 30.363 1.00 63.30 O HETATM 2909 O HOH 78 4.757 14.392 42.329 1.00 52.37 O HETATM 2910 O HOH 79 -7.916 12.915 56.339 1.00 49.92 O HETATM 2911 O HOH 80 -10.526 31.398 38.913 1.00 50.98 O HETATM 2912 O HOH 81 -24.092 27.916 38.463 1.00 45.40 O HETATM 2913 O HOH 82 2.370 6.198 47.729 1.00 54.84 O HETATM 2914 O HOH 83 -17.377 22.242 28.963 1.00 37.07 O HETATM 2915 O HOH 84 -5.973 25.100 34.955 1.00 30.14 O HETATM 2916 O HOH 85 -9.595 19.851 54.061 1.00 44.24 O HETATM 2917 O HOH 86 -8.936 26.719 36.998 1.00 43.87 O HETATM 2918 O HOH 87 -6.488 -1.221 39.949 1.00 42.28 O HETATM 2919 O HOH 88 6.174 8.014 41.149 1.00 50.00 O HETATM 2920 O HOH 89 4.733 4.577 38.082 1.00 45.92 O HETATM 2921 O HOH 90 -1.744 24.022 34.574 1.00 41.84 O HETATM 2922 O HOH 91 -1.460 27.385 41.802 1.00 48.57 O HETATM 2923 O HOH 92 0.929 19.526 43.495 1.00 45.32 O HETATM 2924 O HOH 93 -14.417 10.125 54.923 1.00 44.72 O HETATM 2925 O HOH 94 3.014 17.441 45.167 1.00 57.70 O HETATM 2926 O HOH 95 -11.309 -5.462 33.172 1.00 52.25 O HETATM 2927 O HOH 96 1.509 18.683 35.105 1.00 41.55 O HETATM 2928 O HOH 97 -6.191 6.383 30.517 1.00 53.50 O HETATM 2929 O HOH 98 -6.073 -1.054 45.941 1.00 40.82 O HETATM 2930 O HOH 99 -31.295 7.548 51.404 1.00 48.91 O HETATM 2931 O HOH 100 0.026 7.907 27.103 1.00 64.41 O HETATM 2932 O HOH 101 -25.771 21.920 49.864 1.00 47.32 O HETATM 2933 O HOH 102 -0.688 -3.438 31.907 1.00 50.20 O HETATM 2934 O HOH 103 -10.970 18.698 55.625 1.00 45.08 O HETATM 2935 O HOH 104 -0.082 24.267 40.105 1.00 45.99 O HETATM 2936 O HOH 105 2.334 1.967 37.748 1.00 48.50 O HETATM 2937 O HOH 106 -15.650 9.196 58.313 1.00 60.35 O HETATM 2938 O HOH 107 -31.384 5.278 54.522 1.00 64.94 O HETATM 2939 O HOH 108 0.108 -3.681 45.453 1.00 59.92 O HETATM 2940 O HOH 109 6.052 14.480 33.156 1.00 45.63 O HETATM 2941 O HOH 110 -24.372 -15.464 34.597 1.00 44.95 O HETATM 2942 O HOH 111 -0.561 -1.147 39.681 1.00 45.89 O HETATM 2943 O HOH 112 -6.481 -0.855 42.756 1.00 57.14 O HETATM 2944 O HOH 113 -8.328 -2.146 38.813 1.00 64.66 O HETATM 2945 O HOH 114 4.164 -5.057 46.773 1.00 52.15 O HETATM 2946 O HOH 115 -9.928 -10.038 29.610 1.00 45.63 O HETATM 2947 O HOH 116 -8.119 -3.335 28.734 1.00 57.31 O HETATM 2948 O HOH 117 -4.505 0.370 47.427 1.00 55.34 O HETATM 2949 O HOH 118 3.798 13.740 29.689 1.00 41.36 O HETATM 2950 O HOH 119 -15.278 16.928 57.158 1.00 63.30 O HETATM 2951 O HOH 120 -0.990 9.872 27.568 1.00 51.50 O HETATM 2952 O HOH 121 -27.711 21.944 51.264 1.00 58.27 O HETATM 2953 O HOH 122 -14.892 14.158 55.788 1.00 54.09 O HETATM 2954 O HOH 123 -24.711 24.015 49.172 1.00 50.88 O HETATM 2955 O HOH 124 -13.164 23.391 30.427 1.00 50.42 O HETATM 2956 O HOH 125 -18.149 25.210 32.599 1.00 64.63 O HETATM 2957 O HOH 126 -17.918 17.354 56.690 1.00 62.81 O HETATM 2958 O HOH 127 8.224 -8.521 39.693 1.00 49.08 O HETATM 2959 O HOH 128 7.619 5.307 40.191 1.00 59.45 O HETATM 2960 O HOH 129 -11.049 23.813 31.068 1.00 50.09 O HETATM 2961 O HOH 130 -25.036 -7.236 34.340 1.00 68.40 O HETATM 2962 O HOH 131 5.695 17.642 28.422 1.00 76.06 O HETATM 2963 O HOH 132 -10.713 -4.143 45.450 1.00 44.88 O HETATM 2964 O HOH 133 7.513 12.808 44.107 1.00 55.92 O HETATM 2965 O HOH 134 3.185 9.294 29.074 1.00 55.03 O HETATM 2966 O HOH 135 -5.149 -6.193 51.291 1.00 61.81 O HETATM 2967 O HOH 136 -5.855 9.311 26.388 1.00 64.53 O HETATM 2968 O HOH 137 -29.426 24.390 43.332 1.00 52.76 O HETATM 2969 O HOH 138 -27.560 22.141 39.124 1.00 26.49 O HETATM 2970 O HOH 139 -26.558 -15.609 37.645 1.00 51.28 O HETATM 2971 O HOH 140 5.383 3.160 43.095 1.00 43.78 O HETATM 2972 O HOH 141 -3.664 -35.354 46.717 1.00 44.84 O HETATM 2973 O HOH 142 -4.652 -33.608 48.613 1.00 39.45 O HETATM 2974 O HOH 143 -4.996 -38.356 45.822 1.00 52.95 O HETATM 2975 O HOH 144 -13.896 -31.819 32.982 1.00 42.63 O HETATM 2976 O HOH 145 8.309 -26.985 52.159 1.00 27.61 O HETATM 2977 O HOH 146 -6.338 -30.381 55.213 1.00 67.16 O HETATM 2978 O HOH 147 -2.980 -33.900 44.684 1.00 32.50 O HETATM 2979 O HOH 148 3.741 -23.023 57.711 1.00 52.51 O HETATM 2980 O HOH 149 -17.196 -30.859 38.887 1.00 48.85 O HETATM 2981 O HOH 150 7.423 -28.362 44.082 1.00 45.29 O HETATM 2982 O HOH 151 -3.293 -30.705 52.523 1.00 37.71 O HETATM 2983 O HOH 152 -5.232 3.144 53.930 1.00 54.93 O HETATM 2984 O HOH 153 3.599 -25.202 56.246 1.00 51.94 O HETATM 2985 O HOH 154 -3.620 -33.580 50.793 1.00 45.03 O HETATM 2986 O HOH 155 -4.690 -34.541 52.490 1.00 56.97 O HETATM 2987 O HOH 156 -16.129 14.528 28.314 1.00 18.82 O HETATM 2988 O HOH 157 -12.338 7.254 27.721 1.00 22.75 O HETATM 2989 O HOH 158 -21.515 10.006 33.750 1.00 23.26 O HETATM 2990 O HOH 159 -14.978 17.317 20.813 1.00 23.09 O HETATM 2991 O HOH 160 3.366 -22.351 34.783 1.00 29.90 O HETATM 2992 O HOH 161 -0.490 -15.336 43.638 1.00 24.50 O HETATM 2993 O HOH 162 -14.263 -17.880 30.842 1.00 24.55 O HETATM 2994 O HOH 163 -14.247 1.267 37.472 1.00 27.08 O HETATM 2995 O HOH 164 -10.254 -12.780 30.193 1.00 26.14 O HETATM 2996 O HOH 165 -9.181 4.922 41.546 1.00 28.55 O HETATM 2997 O HOH 166 1.797 -14.151 42.776 1.00 33.01 O HETATM 2998 O HOH 167 -13.769 -27.626 33.260 1.00 34.78 O HETATM 2999 O HOH 168 3.822 -17.182 46.230 1.00 41.71 O HETATM 3000 O HOH 169 4.732 -20.158 51.674 1.00 29.00 O HETATM 3001 O HOH 170 -18.668 -16.674 35.403 1.00 37.75 O HETATM 3002 O HOH 171 -25.673 6.443 36.202 1.00 34.17 O HETATM 3003 O HOH 172 4.778 -16.394 39.593 1.00 30.69 O HETATM 3004 O HOH 173 -17.111 -0.385 48.450 1.00 30.36 O HETATM 3005 O HOH 174 -17.701 -17.845 42.489 1.00 46.15 O HETATM 3006 O HOH 175 -19.168 -9.381 49.422 1.00 43.40 O HETATM 3007 O HOH 176 -3.880 -10.885 28.355 1.00 38.27 O HETATM 3008 O HOH 177 -22.781 -5.781 43.053 1.00 41.35 O HETATM 3009 O HOH 178 -23.245 7.926 33.047 1.00 36.36 O HETATM 3010 O HOH 179 -21.482 1.707 37.042 1.00 41.65 O HETATM 3011 O HOH 180 -7.606 8.271 29.672 1.00 33.03 O HETATM 3012 O HOH 181 -17.358 4.021 32.048 1.00 44.14 O HETATM 3013 O HOH 182 -12.706 6.513 53.030 1.00 32.17 O HETATM 3014 O HOH 183 -18.424 -28.202 43.185 1.00 47.56 O HETATM 3015 O HOH 184 -3.228 -11.295 54.845 1.00 39.43 O HETATM 3016 O HOH 185 -13.438 -4.599 48.514 1.00 42.55 O HETATM 3017 O HOH 186 6.101 -19.412 38.445 1.00 49.12 O HETATM 3018 O HOH 187 -12.748 -0.874 39.480 1.00 40.92 O HETATM 3019 O HOH 188 -10.518 -0.982 31.548 1.00 41.20 O HETATM 3020 O HOH 189 -17.061 -2.278 46.637 1.00 48.54 O HETATM 3021 O HOH 190 -0.924 -12.542 55.659 1.00 42.08 O HETATM 3022 O HOH 191 -2.809 -8.995 53.479 1.00 46.94 O HETATM 3023 O HOH 192 5.632 -29.515 40.981 1.00 52.03 O HETATM 3024 O HOH 193 -22.557 -0.942 52.537 1.00 44.01 O HETATM 3025 O HOH 194 -18.261 -23.278 54.602 1.00 54.59 O HETATM 3026 O HOH 195 -6.508 -32.436 46.751 1.00 40.23 O HETATM 3027 O HOH 196 -6.272 -4.652 49.507 1.00 46.11 O HETATM 3028 O HOH 197 -2.493 -26.869 26.432 1.00 56.01 O HETATM 3029 O HOH 198 -0.307 -31.966 36.956 1.00 40.52 O HETATM 3030 O HOH 199 5.371 -23.070 45.035 1.00 60.83 O HETATM 3031 O HOH 200 -21.784 -17.412 46.775 1.00 43.90 O HETATM 3032 O HOH 201 -17.923 -1.269 38.672 1.00 51.11 O HETATM 3033 O HOH 202 -24.688 -17.058 51.556 1.00 63.66 O HETATM 3034 O HOH 203 1.957 -12.713 51.424 1.00 40.82 O HETATM 3035 O HOH 204 -10.476 -5.256 47.977 1.00 57.77 O HETATM 3036 O HOH 205 1.607 -26.162 29.165 1.00 49.79 O HETATM 3037 O HOH 206 7.054 -15.150 38.689 1.00 50.79 O HETATM 3038 O HOH 207 -22.028 -23.753 38.136 1.00 38.40 O HETATM 3039 O HOH 208 -8.965 10.238 26.086 1.00 43.03 O HETATM 3040 O HOH 209 -20.135 -30.533 37.035 1.00 59.14 O HETATM 3041 O HOH 210 -14.045 6.802 24.444 1.00 44.78 O HETATM 3042 O HOH 211 -8.948 -1.233 40.939 1.00 47.19 O HETATM 3043 O HOH 212 -20.153 -0.333 39.659 1.00 53.97 O HETATM 3044 O HOH 213 -11.433 -30.746 53.510 1.00 56.66 O HETATM 3045 O HOH 214 -1.240 -30.461 32.236 1.00 47.96 O HETATM 3046 O HOH 215 2.940 -31.667 34.442 1.00 56.99 O HETATM 3047 O HOH 216 -11.639 2.871 29.588 1.00 49.27 O HETATM 3048 O HOH 217 -13.418 -2.961 42.455 1.00 67.61 O HETATM 3049 O HOH 218 -16.364 1.924 31.291 1.00 63.65 O HETATM 3050 O HOH 219 -17.732 -22.427 32.652 1.00 35.28 O HETATM 3051 O HOH 220 3.545 -24.553 46.178 1.00 41.90 O HETATM 3052 O HOH 221 -14.725 -3.509 46.078 1.00 44.30 O HETATM 3053 O HOH 222 -7.121 0.434 52.221 1.00 45.82 O HETATM 3054 O HOH 223 -22.721 -15.948 49.664 1.00 55.15 O HETATM 3055 O HOH 224 -20.202 -10.495 52.038 1.00 58.44 O HETATM 3056 O HOH 225 2.868 -25.670 27.080 1.00 61.09 O HETATM 3057 O HOH 226 -12.663 -13.895 34.103 1.00 40.30 O HETATM 3058 O HOH 227 1.030 -29.948 32.591 1.00 62.35 O HETATM 3059 O HOH 228 -14.960 -0.199 39.512 1.00 74.02 O HETATM 3060 O HOH 229 5.559 -18.747 40.982 1.00 49.23 O HETATM 3061 O HOH 230 -11.434 -24.340 55.245 1.00 56.02 O HETATM 3062 O HOH 231 -22.917 -2.049 42.295 1.00 53.13 O HETATM 3063 O HOH 232 -22.216 -21.936 36.406 1.00 51.90 O HETATM 3064 O HOH 233 -6.259 13.500 17.832 1.00 72.11 O HETATM 3065 O HOH 234 7.890 -23.486 44.779 1.00 61.41 O HETATM 3066 O HOH 235 6.755 -22.640 35.674 1.00 54.60 O HETATM 3067 O HOH 236 -13.504 -25.741 53.918 1.00 53.93 O HETATM 3068 O HOH 237 -5.441 11.528 22.345 1.00 55.26 O HETATM 3069 O HOH 238 -23.962 -4.987 49.895 1.00 55.01 O HETATM 3070 O HOH 239 -10.330 4.770 56.717 1.00 56.16 O HETATM 3071 O HOH 240 -20.701 -2.966 53.743 1.00 52.90 O HETATM 3072 O HOH 241 4.095 -15.037 41.942 1.00 47.79 O HETATM 3073 O HOH 242 -12.054 4.535 26.575 1.00 66.22 O HETATM 3074 O HOH 243 -8.964 3.874 28.501 1.00 59.22 O HETATM 3075 O HOH 244 -1.216 -7.369 32.310 1.00 57.98 O HETATM 3076 O HOH 245 -21.574 -13.153 47.320 1.00 57.54 O HETATM 3077 O HOH 246 -22.154 -7.579 50.473 1.00 51.79 O HETATM 3078 O HOH 247 -0.436 -7.582 21.981 1.00 53.27 O HETATM 3079 O HOH 248 -3.021 -18.603 59.066 1.00 55.49 O HETATM 3080 O HOH 249 8.074 -11.090 39.355 1.00 41.01 O HETATM 3081 O HOH 250 -22.305 -11.457 48.745 1.00 58.51 O HETATM 3082 C1 UNN A 251 -10.865 17.399 50.720 1.00 0.05 C HETATM 3083 S1 UNN A 251 -9.746 18.316 49.854 1.00 0.03 S HETATM 3084 C7 UNN A 251 -10.308 19.741 50.669 1.00 0.21 C HETATM 3085 N1 UNN A 251 -11.349 19.529 51.491 1.00 -0.31 N HETATM 3086 C6 UNN A 251 -11.633 18.199 51.561 1.00 0.01 C HETATM 3087 C5 UNN A 251 -12.599 17.587 52.355 1.00 -0.06 C HETATM 3088 C4 UNN A 251 -12.769 16.204 52.302 1.00 -0.08 C HETATM 3089 C3 UNN A 251 -11.988 15.416 51.457 1.00 -0.08 C HETATM 3090 C2 UNN A 251 -11.023 16.027 50.669 1.00 -0.05 C HETATM 3091 H UNN A 251 -10.396 15.431 50.016 1.00 0.06 H HETATM 3092 H UNN A 251 -12.133 14.342 51.416 1.00 0.05 H HETATM 3093 H UNN A 251 -13.520 15.734 52.927 1.00 0.05 H HETATM 3094 H UNN A 251 -13.218 18.185 53.014 1.00 0.05 H HETATM 3095 N2 UNN A 251 -9.917 20.999 50.337 1.00 -0.19 N HETATM 3096 C8 UNN A 251 -8.991 21.337 49.437 1.00 0.24 C HETATM 3097 O1 UNN A 251 -8.384 20.412 48.921 1.00 -0.37 O HETATM 3098 C9 UNN A 251 -8.849 22.749 48.966 1.00 0.06 C HETATM 3099 C10 UNN A 251 -9.911 23.589 49.284 1.00 -0.05 C HETATM 3100 C11 UNN A 251 -9.962 24.896 48.815 1.00 -0.07 C HETATM 3101 C12 UNN A 251 -8.934 25.341 47.993 1.00 -0.06 C HETATM 3102 C13 UNN A 251 -7.906 24.487 47.620 1.00 -0.03 C HETATM 3103 C14 UNN A 251 -7.848 23.189 48.106 1.00 0.00 C HETATM 3104 C15 UNN A 251 -6.719 22.266 47.697 1.00 0.07 C HETATM 3105 N3 UNN A 251 -5.560 22.893 47.120 1.00 -0.26 N HETATM 3106 C16 UNN A 251 -5.485 24.341 46.987 1.00 0.05 C HETATM 3107 C17 UNN A 251 -6.823 25.013 46.710 1.00 0.00 C HETATM 3108 H UNN A 251 -6.718 26.096 46.868 1.00 0.04 H HETATM 3109 H UNN A 251 -7.110 24.821 45.666 1.00 0.04 H HETATM 3110 H UNN A 251 -4.803 24.576 46.157 1.00 0.06 H HETATM 3111 H UNN A 251 -5.080 24.753 47.923 1.00 0.06 H HETATM 3112 C18 UNN A 251 -4.529 22.084 46.814 1.00 0.18 C HETATM 3113 S2 UNN A 251 -4.586 20.378 47.136 1.00 0.03 S HETATM 3114 C21 UNN A 251 -2.989 20.261 46.475 1.00 0.04 C HETATM 3115 C19 UNN A 251 -2.501 21.507 46.055 1.00 0.03 C HETATM 3116 N4 UNN A 251 -3.383 22.506 46.243 1.00 -0.32 N HETATM 3117 C20 UNN A 251 -1.181 21.789 45.402 1.00 0.04 C HETATM 3118 O2 UNN A 251 -1.085 22.833 44.699 1.00 -0.57 O HETATM 3119 O3 UNN A 251 -0.236 20.973 45.521 1.00 -0.57 O HETATM 3120 C22 UNN A 251 -2.286 18.919 46.426 1.00 -0.01 C HETATM 3121 C23 UNN A 251 -1.450 18.686 47.700 1.00 -0.01 C HETATM 3122 C24 UNN A 251 -0.458 17.557 47.508 1.00 0.07 C HETATM 3123 O4 UNN A 251 -1.217 16.348 47.350 1.00 -0.32 O HETATM 3124 C25 UNN A 251 -0.656 15.135 47.061 1.00 0.08 C HETATM 3125 C26 UNN A 251 -1.404 14.004 46.776 1.00 -0.04 C HETATM 3126 C27 UNN A 251 -0.761 12.802 46.504 1.00 -0.04 C HETATM 3127 C28 UNN A 251 0.626 12.709 46.525 1.00 0.10 C HETATM 3128 N5 UNN A 251 1.155 11.513 46.216 1.00 -0.14 N HETATM 3129 N6 UNN A 251 0.483 10.293 46.343 1.00 -0.18 N HETATM 3130 C31 UNN A 251 1.283 9.305 45.895 1.00 0.04 C HETATM 3131 C32 UNN A 251 2.480 9.957 45.454 1.00 0.06 C HETATM 3132 C33 UNN A 251 3.637 9.429 44.896 1.00 0.03 C HETATM 3133 N7 UNN A 251 4.642 10.246 44.560 1.00 -0.28 N HETATM 3134 C34 UNN A 251 4.478 11.557 44.772 1.00 0.08 C HETATM 3135 N8 UNN A 251 3.407 12.149 45.301 1.00 -0.24 N HETATM 3136 C35 UNN A 251 2.369 11.343 45.658 1.00 0.19 C HETATM 3137 H UNN A 251 5.299 12.203 44.484 1.00 0.11 H HETATM 3138 H UNN A 251 3.725 8.361 44.734 1.00 0.09 H HETATM 3139 H UNN A 251 1.066 8.238 45.873 1.00 0.08 H HETATM 3140 C29 UNN A 251 1.385 13.850 46.808 1.00 -0.04 C HETATM 3141 C30 UNN A 251 0.737 15.057 47.087 1.00 -0.04 C HETATM 3142 H UNN A 251 1.321 15.939 47.325 1.00 0.05 H HETATM 3143 H UNN A 251 2.468 13.798 46.811 1.00 0.06 H HETATM 3144 H UNN A 251 -1.351 11.923 46.272 1.00 0.06 H HETATM 3145 H UNN A 251 -2.487 14.056 46.765 1.00 0.05 H HETATM 3146 H UNN A 251 0.152 17.739 46.611 1.00 0.06 H HETATM 3147 H UNN A 251 0.198 17.478 48.387 1.00 0.06 H HETATM 3148 H UNN A 251 -2.125 18.432 48.530 1.00 0.03 H HETATM 3149 H UNN A 251 -0.901 19.608 47.942 1.00 0.03 H HETATM 3150 H UNN A 251 -1.621 18.893 45.550 1.00 0.04 H HETATM 3151 H UNN A 251 -3.039 18.122 46.339 1.00 0.04 H HETATM 3152 H UNN A 251 -6.392 21.718 48.593 1.00 0.07 H HETATM 3153 H UNN A 251 -7.118 21.555 46.958 1.00 0.07 H HETATM 3154 H UNN A 251 -8.935 26.366 47.639 1.00 0.06 H HETATM 3155 H UNN A 251 -10.783 25.552 49.084 1.00 0.06 H HETATM 3156 H UNN A 251 -10.714 23.217 49.910 1.00 0.06 H HETATM 3157 H UNN A 251 -10.370 21.750 50.817 1.00 0.24 H CONECT 1 2 7 8 9 CONECT 8 1 CONECT 9 1 CONECT 1414 1415 1418 1419 1420 CONECT 1418 1414 CONECT 1419 1414 CONECT 1420 1414 CONECT 3082 3083 3086 3090 CONECT 3083 3082 3084 CONECT 3084 3083 3085 3095 CONECT 3085 3084 3086 CONECT 3086 3082 3085 3087 CONECT 3087 3086 3088 3094 CONECT 3088 3087 3089 3093 CONECT 3089 3088 3090 3092 CONECT 3090 3082 3089 3091 CONECT 3091 3090 CONECT 3092 3089 CONECT 3093 3088 CONECT 3094 3087 CONECT 3095 3084 3096 3157 CONECT 3096 3095 3097 3098 CONECT 3097 3096 CONECT 3098 3096 3099 3103 CONECT 3099 3098 3100 3156 CONECT 3100 3099 3101 3155 CONECT 3101 3100 3102 3154 CONECT 3102 3101 3103 3107 CONECT 3103 3098 3102 3104 CONECT 3104 3103 3105 3152 3153 CONECT 3105 3104 3106 3112 CONECT 3106 3105 3107 3110 3111 CONECT 3107 3102 3106 3108 3109 CONECT 3108 3107 CONECT 3109 3107 CONECT 3110 3106 CONECT 3111 3106 CONECT 3112 3105 3113 3116 CONECT 3113 3112 3114 CONECT 3114 3113 3115 3120 CONECT 3115 3114 3116 3117 CONECT 3116 3112 3115 CONECT 3117 3115 3118 3119 CONECT 3118 3117 CONECT 3119 3117 CONECT 3120 3114 3121 3150 3151 CONECT 3121 3120 3122 3148 3149 CONECT 3122 3121 3123 3146 3147 CONECT 3123 3122 3124 CONECT 3124 3123 3125 3141 CONECT 3125 3124 3126 3145 CONECT 3126 3125 3127 3144 CONECT 3127 3126 3128 3140 CONECT 3128 3127 3129 3136 CONECT 3129 3128 3130 CONECT 3130 3129 3131 3139 CONECT 3131 3130 3132 3136 CONECT 3132 3131 3133 3138 CONECT 3133 3132 3134 CONECT 3134 3133 3135 3137 CONECT 3135 3134 3136 CONECT 3136 3128 3131 3135 CONECT 3137 3134 CONECT 3138 3132 CONECT 3139 3130 CONECT 3140 3127 3141 3143 CONECT 3141 3124 3140 3142 CONECT 3142 3141 CONECT 3143 3140 CONECT 3144 3126 CONECT 3145 3125 CONECT 3146 3122 CONECT 3147 3122 CONECT 3148 3121 CONECT 3149 3121 CONECT 3150 3120 CONECT 3151 3120 CONECT 3152 3104 CONECT 3153 3104 CONECT 3154 3101 CONECT 3155 3100 CONECT 3156 3099 CONECT 3157 3095 MASTER 0 0 0 0 0 0 0 0 3155 2 83 24 END
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Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
4tuh
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Bcl-2-like protein 1 Bcl-xL
Ligand Name
38H
EC.Number
E.C.-.-.-.-
Resolution
1.8(Å)
Affinity (Kd/Ki/IC50)
IC50>100uM
Release Year
2014
Protein/NA Sequence
Check fasta file
Primary Reference
(2014) Acs Med.Chem.Lett. Vol. 5: pp. 662-667
Ligand Properties
Formula
C
3
5
H
2
8
N
8
O
4
S
2
Molecular Weight
688.778
Exact Mass
688.167
No. of atoms
77
No. of bonds
84
Polar Surface Area
204.73
LOGP Value
7.45 (
Computed with XLOGP3
)
6.54 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 8
No. of Rotatable Bonds: 10
No. of Nitrogen and Oxygen Atoms: 12
No. of Rings: 8
Canonical SMILES
OC(=O)c1nc(sc1CCCOc1ccc(cc1)n1ncc2c1ncnc2)N1CCc2c(C1)c(ccc2)C(=O)Nc1nc2c(s1)cccc2
InChI String
InChI=1S/C35H28N8O4S2/c44-32(41-34-39-27-7-1-2-8-28(27)48-34)25-6-3-5-21-14-15-42(19-26(21)25)35-40-30(33(45)46)29(49-35)9-4-16-47-24-12-10-23(11-13-24)43-31-22(18-38-43)17-36-20-37-31/h1-3,5-8,10-13,17-18,20H,4,9,14-16,19H2,(H,45,46)(H,39,41,44)
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):
Q07817
Entrez Gene ID
NCBI Entrez Gene ID:
598
ASD
Information of known allosteric effects of PDB entries
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