Browse entries in the PDBbind-CN Database
HEADER 6BIN_COMPLEX COMPND 6BIN_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 179 GLU GLU HIS VAL ILE ILE GLN ALA GLU PHE TYR LEU ASN SEQRES 2 A 179 PRO ASP GLN SER GLY GLU PHE MET PHE ASP PHE ASP GLY SEQRES 3 A 179 ASP GLU ILE PHE HIS VAL ASP MET ALA LYS LYS GLU THR SEQRES 4 A 179 VAL TRP ARG LEU GLU GLU PHE GLY ARG PHE ALA SER PHE SEQRES 5 A 179 GLU ALA GLN GLY ALA LEU ALA ASN ILE ALA VAL ASP LYS SEQRES 6 A 179 ALA ASN LEU GLU ILE MET THR LYS ARG SER ASN TYR THR SEQRES 7 A 179 PRO ILE THR ASN VAL PRO PRO GLU VAL THR VAL LEU THR SEQRES 8 A 179 ASN SER PRO VAL GLU LEU ARG GLU PRO ASN VAL LEU ILE SEQRES 9 A 179 CYS PHE ILE ASP LYS PHE THR PRO PRO VAL VAL ASN VAL SEQRES 10 A 179 THR TRP LEU ARG ASN GLY LYS PRO VAL THR THR GLY VAL SEQRES 11 A 179 SER GLU THR VAL PHE LEU PRO ARG GLU ASP HIS LEU PHE SEQRES 12 A 179 ARG LYS PHE HIS TYR LEU PRO PHE LEU PRO SER THR GLU SEQRES 13 A 179 ASP VAL TYR ASP CYS ARG VAL GLU HIS TRP GLY LEU ASP SEQRES 14 A 179 GLU PRO LEU LEU LYS HIS TRP GLU PHE ASP SEQRES 1 B 189 ASP THR ARG PRO ARG PHE LEU GLU GLN VAL LYS HIS GLU SEQRES 2 B 189 CYS HIS PHE PHE ASN GLY THR GLU ARG VAL ARG PHE LEU SEQRES 3 B 189 ASP ARG TYR PHE TYR HIS GLN GLU GLU TYR VAL ARG PHE SEQRES 4 B 189 ASP SER ASP VAL GLY GLU TYR ARG ALA VAL THR GLU LEU SEQRES 5 B 189 GLY ARG PRO ASP ALA GLU TYR TRP ASN SER GLN LYS ASP SEQRES 6 B 189 LEU LEU GLU GLN LYS ARG ALA ALA VAL ASP THR TYR CYS SEQRES 7 B 189 ARG HIS ASN TYR GLY VAL GLY GLU SER PHE THR VAL GLN SEQRES 8 B 189 ARG ARG VAL TYR PRO GLU VAL THR VAL TYR PRO ALA LYS SEQRES 9 B 189 THR GLN PRO LEU GLN HIS HIS ASN LEU LEU VAL CYS SER SEQRES 10 B 189 VAL ASN GLY PHE TYR PRO GLY SER ILE GLU VAL ARG TRP SEQRES 11 B 189 PHE ARG ASN GLY GLN GLU GLU LYS THR GLY VAL VAL SER SEQRES 12 B 189 THR GLY LEU ILE GLN ASN GLY ASP TRP THR PHE GLN THR SEQRES 13 B 189 LEU VAL MET LEU GLU THR VAL PRO ARG SER GLY GLU VAL SEQRES 14 B 189 TYR THR CYS GLN VAL GLU HIS PRO SER LEU THR SER PRO SEQRES 15 B 189 LEU THR VAL GLU TRP ARG ALA HET GLN A 482 199 SSBOND 1 CYS A 107 CYS A 163 SSBOND 2 CYS B 15 CYS B 79 SSBOND 3 CYS B 117 CYS B 173 ATOM 1 N GLU A 3 36.427 13.088 -18.963 1.00 35.69 N ATOM 2 CA GLU A 3 37.044 12.404 -17.833 1.00 50.09 C ATOM 3 C GLU A 3 35.994 11.811 -16.903 1.00 38.78 C ATOM 4 O GLU A 3 34.811 11.760 -17.237 1.00 38.89 O ATOM 5 CB GLU A 3 37.954 13.359 -17.051 1.00 42.58 C ATOM 6 CG GLU A 3 37.264 14.598 -16.498 1.00 37.17 C ATOM 7 CD GLU A 3 37.129 15.705 -17.527 1.00 52.63 C ATOM 8 OE1 GLU A 3 36.210 15.626 -18.371 1.00 55.59 O ATOM 9 OE2 GLU A 3 37.946 16.649 -17.496 1.00 43.88 O ATOM 10 HN3 GLU A 3 35.823 13.858 -18.612 1.00 0.00 H ATOM 11 HN2 GLU A 3 35.850 12.412 -19.503 1.00 0.00 H ATOM 12 HN1 GLU A 3 37.169 13.480 -19.577 1.00 0.00 H ATOM 13 N GLU A 4 36.439 11.352 -15.735 1.00 41.02 N ATOM 14 CA GLU A 4 35.540 10.841 -14.709 1.00 37.86 C ATOM 15 C GLU A 4 35.798 11.408 -13.322 1.00 38.88 C ATOM 16 O GLU A 4 34.878 11.393 -12.496 1.00 37.70 O ATOM 17 CB GLU A 4 35.611 9.308 -14.641 1.00 34.29 C ATOM 18 CG GLU A 4 37.014 8.748 -14.473 1.00 43.04 C ATOM 19 CD GLU A 4 37.036 7.231 -14.483 1.00 48.82 C ATOM 20 OE1 GLU A 4 36.958 6.626 -13.393 1.00 51.72 O ATOM 21 OE2 GLU A 4 37.123 6.644 -15.582 1.00 50.79 O ATOM 22 H GLU A 4 37.462 11.359 -15.549 1.00 0.00 H ATOM 23 N HIS A 5 37.000 11.907 -13.038 1.00 32.95 N ATOM 24 CA HIS A 5 37.309 12.503 -11.747 1.00 24.88 C ATOM 25 C HIS A 5 38.327 13.614 -11.951 1.00 27.19 C ATOM 26 O HIS A 5 39.255 13.472 -12.752 1.00 26.18 O ATOM 27 CB HIS A 5 37.849 11.462 -10.760 1.00 25.37 C ATOM 28 CG HIS A 5 36.866 10.386 -10.421 1.00 28.14 C ATOM 29 ND1 HIS A 5 35.522 10.636 -10.241 1.00 24.60 N ATOM 30 CD2 HIS A 5 37.028 9.054 -10.239 1.00 30.25 C ATOM 31 CE1 HIS A 5 34.900 9.506 -9.957 1.00 26.17 C ATOM 32 NE2 HIS A 5 35.791 8.531 -9.950 1.00 34.42 N ATOM 33 H HIS A 5 37.743 11.869 -13.764 1.00 0.00 H ATOM 34 N VAL A 6 38.143 14.718 -11.231 1.00 23.10 N ATOM 35 CA VAL A 6 39.021 15.877 -11.326 1.00 17.33 C ATOM 36 C VAL A 6 39.392 16.322 -9.919 1.00 20.90 C ATOM 37 O VAL A 6 38.511 16.575 -9.090 1.00 17.34 O ATOM 38 CB VAL A 6 38.365 17.038 -12.098 1.00 20.66 C ATOM 39 CG1 VAL A 6 39.298 18.237 -12.139 1.00 17.90 C ATOM 40 CG2 VAL A 6 37.995 16.604 -13.506 1.00 24.35 C ATOM 41 H VAL A 6 37.339 14.755 -10.573 1.00 0.00 H ATOM 42 N ILE A 7 40.692 16.415 -9.652 1.00 23.73 N ATOM 43 CA ILE A 7 41.214 16.938 -8.396 1.00 16.40 C ATOM 44 C ILE A 7 41.852 18.288 -8.690 1.00 15.85 C ATOM 45 O ILE A 7 42.732 18.391 -9.554 1.00 17.04 O ATOM 46 CB ILE A 7 42.224 15.978 -7.750 1.00 21.29 C ATOM 47 CG1 ILE A 7 41.591 14.603 -7.529 1.00 16.02 C ATOM 48 CG2 ILE A 7 42.736 16.547 -6.435 1.00 12.14 C ATOM 49 CD1 ILE A 7 42.534 13.593 -6.911 1.00 19.67 C ATOM 50 H ILE A 7 41.369 16.099 -10.375 1.00 0.00 H ATOM 51 N ILE A 8 41.408 19.322 -7.981 1.00 17.21 N ATOM 52 CA ILE A 8 41.887 20.683 -8.186 1.00 14.25 C ATOM 53 C ILE A 8 42.444 21.209 -6.872 1.00 16.26 C ATOM 54 O ILE A 8 41.758 21.183 -5.844 1.00 17.19 O ATOM 55 CB ILE A 8 40.773 21.609 -8.709 1.00 18.48 C ATOM 56 CG1 ILE A 8 40.254 21.113 -10.060 1.00 13.83 C ATOM 57 CG2 ILE A 8 41.279 23.041 -8.817 1.00 8.86 C ATOM 58 CD1 ILE A 8 39.092 21.918 -10.598 1.00 13.07 C ATOM 59 H ILE A 8 40.689 19.152 -7.249 1.00 0.00 H ATOM 60 N GLN A 9 43.688 21.681 -6.909 1.00 14.52 N ATOM 61 CA GLN A 9 44.304 22.396 -5.795 1.00 15.05 C ATOM 62 C GLN A 9 44.109 23.884 -6.065 1.00 15.34 C ATOM 63 O GLN A 9 44.802 24.470 -6.900 1.00 16.39 O ATOM 64 CB GLN A 9 45.777 22.027 -5.661 1.00 14.55 C ATOM 65 CG GLN A 9 46.567 22.886 -4.691 1.00 14.44 C ATOM 66 CD GLN A 9 48.060 22.634 -4.787 1.00 17.66 C ATOM 67 OE1 GLN A 9 48.498 21.498 -4.973 1.00 17.25 O ATOM 68 NE2 GLN A 9 48.849 23.695 -4.675 1.00 17.04 N ATOM 69 HE22 GLN A 9 48.435 24.636 -4.518 1.00 0.00 H ATOM 70 HE21 GLN A 9 49.881 23.585 -4.744 1.00 0.00 H ATOM 71 H GLN A 9 44.248 21.533 -7.773 1.00 0.00 H ATOM 72 N ALA A 10 43.156 24.491 -5.364 1.00 14.37 N ATOM 73 CA ALA A 10 42.749 25.869 -5.606 1.00 14.38 C ATOM 74 C ALA A 10 43.288 26.775 -4.507 1.00 16.88 C ATOM 75 O ALA A 10 43.127 26.481 -3.318 1.00 21.81 O ATOM 76 CB ALA A 10 41.225 25.980 -5.683 1.00 8.87 C ATOM 77 H ALA A 10 42.679 23.958 -4.609 1.00 0.00 H ATOM 78 N GLU A 11 43.925 27.872 -4.909 1.00 16.94 N ATOM 79 CA GLU A 11 44.454 28.866 -3.989 1.00 17.28 C ATOM 80 C GLU A 11 44.094 30.256 -4.488 1.00 14.10 C ATOM 81 O GLU A 11 43.908 30.470 -5.688 1.00 11.10 O ATOM 82 CB GLU A 11 45.971 28.766 -3.856 1.00 14.30 C ATOM 83 CG GLU A 11 46.521 27.364 -3.832 1.00 21.50 C ATOM 84 CD GLU A 11 47.949 27.289 -4.345 1.00 28.71 C ATOM 85 OE1 GLU A 11 48.397 26.185 -4.741 1.00 27.80 O ATOM 86 OE2 GLU A 11 48.634 28.345 -4.373 1.00 27.21 O ATOM 87 H GLU A 11 44.050 28.026 -5.930 1.00 0.00 H ATOM 88 N PHE A 12 43.985 31.199 -3.554 1.00 12.30 N ATOM 89 CA PHE A 12 43.841 32.595 -3.935 1.00 12.84 C ATOM 90 C PHE A 12 44.419 33.484 -2.845 1.00 12.02 C ATOM 91 O PHE A 12 44.495 33.096 -1.676 1.00 11.77 O ATOM 92 CB PHE A 12 42.376 32.973 -4.235 1.00 14.09 C ATOM 93 CG PHE A 12 41.486 33.067 -3.019 1.00 14.80 C ATOM 94 CD1 PHE A 12 41.480 34.205 -2.223 1.00 11.43 C ATOM 95 CD2 PHE A 12 40.618 32.035 -2.702 1.00 14.59 C ATOM 96 CE1 PHE A 12 40.660 34.292 -1.117 1.00 12.72 C ATOM 97 CE2 PHE A 12 39.787 32.123 -1.601 1.00 13.83 C ATOM 98 CZ PHE A 12 39.808 33.253 -0.809 1.00 11.71 C ATOM 99 H PHE A 12 44.003 30.936 -2.548 1.00 0.00 H ATOM 100 N TYR A 13 44.833 34.682 -3.251 1.00 14.64 N ATOM 101 CA TYR A 13 45.266 35.731 -2.340 1.00 16.72 C ATOM 102 C TYR A 13 44.592 37.029 -2.757 1.00 18.44 C ATOM 103 O TYR A 13 44.430 37.294 -3.952 1.00 17.59 O ATOM 104 CB TYR A 13 46.792 35.892 -2.342 1.00 15.91 C ATOM 105 CG TYR A 13 47.306 36.806 -1.252 1.00 17.23 C ATOM 106 CD1 TYR A 13 47.575 36.317 0.020 1.00 20.06 C ATOM 107 CD2 TYR A 13 47.520 38.156 -1.493 1.00 17.33 C ATOM 108 CE1 TYR A 13 48.042 37.148 1.021 1.00 18.50 C ATOM 109 CE2 TYR A 13 47.986 38.994 -0.500 1.00 20.41 C ATOM 110 CZ TYR A 13 48.246 38.485 0.755 1.00 21.65 C ATOM 111 OH TYR A 13 48.711 39.318 1.746 1.00 31.50 O ATOM 112 HH TYR A 13 48.845 38.797 2.577 1.00 0.00 H ATOM 113 H TYR A 13 44.848 34.879 -4.272 1.00 0.00 H ATOM 114 N LEU A 14 44.194 37.834 -1.774 1.00 16.34 N ATOM 115 CA LEU A 14 43.354 38.998 -2.026 1.00 17.97 C ATOM 116 C LEU A 14 43.889 40.215 -1.288 1.00 21.44 C ATOM 117 O LEU A 14 44.087 40.171 -0.070 1.00 21.17 O ATOM 118 CB LEU A 14 41.910 38.723 -1.599 1.00 15.92 C ATOM 119 CG LEU A 14 40.915 39.865 -1.800 1.00 17.62 C ATOM 120 CD1 LEU A 14 40.588 40.049 -3.273 1.00 12.77 C ATOM 121 CD2 LEU A 14 39.661 39.600 -1.001 1.00 13.31 C ATOM 122 H LEU A 14 44.491 37.626 -0.799 1.00 0.00 H ATOM 123 N ASN A 15 44.109 41.299 -2.028 1.00 16.44 N ATOM 124 CA ASN A 15 44.468 42.589 -1.447 1.00 17.70 C ATOM 125 C ASN A 15 43.282 43.547 -1.558 1.00 20.46 C ATOM 126 O ASN A 15 42.463 43.410 -2.465 1.00 21.36 O ATOM 127 CB ASN A 15 45.698 43.176 -2.147 1.00 15.20 C ATOM 128 CG ASN A 15 46.991 42.534 -1.689 1.00 21.86 C ATOM 129 OD1 ASN A 15 47.098 42.064 -0.556 1.00 21.52 O ATOM 130 ND2 ASN A 15 47.987 42.516 -2.568 1.00 22.13 N ATOM 131 HD22 ASN A 15 47.852 42.925 -3.515 1.00 0.00 H ATOM 132 HD21 ASN A 15 48.901 42.093 -2.309 1.00 0.00 H ATOM 133 H ASN A 15 44.022 41.224 -3.062 1.00 0.00 H ATOM 134 N PRO A 16 43.181 44.521 -0.637 1.00 20.69 N ATOM 135 CA PRO A 16 44.079 44.783 0.493 1.00 21.55 C ATOM 136 C PRO A 16 43.734 43.958 1.728 1.00 25.03 C ATOM 137 O PRO A 16 44.309 44.174 2.795 1.00 22.50 O ATOM 138 CB PRO A 16 43.858 46.270 0.762 1.00 16.57 C ATOM 139 CG PRO A 16 42.423 46.474 0.420 1.00 16.95 C ATOM 140 CD PRO A 16 42.127 45.547 -0.737 1.00 16.24 C ATOM 141 N ASP A 17 42.799 43.017 1.573 1.00 21.31 N ATOM 142 CA ASP A 17 42.357 42.201 2.698 1.00 18.99 C ATOM 143 C ASP A 17 43.452 41.279 3.217 1.00 19.35 C ATOM 144 O ASP A 17 43.372 40.836 4.367 1.00 25.41 O ATOM 145 CB ASP A 17 41.135 41.376 2.295 1.00 19.21 C ATOM 146 CG ASP A 17 40.031 42.226 1.697 1.00 27.33 C ATOM 147 OD1 ASP A 17 40.128 42.574 0.501 1.00 22.65 O ATOM 148 OD2 ASP A 17 39.065 42.546 2.423 1.00 33.57 O ATOM 149 H ASP A 17 42.379 42.864 0.634 1.00 0.00 H ATOM 150 N GLN A 18 44.466 40.987 2.398 1.00 25.45 N ATOM 151 CA GLN A 18 45.550 40.075 2.766 1.00 19.80 C ATOM 152 C GLN A 18 45.003 38.707 3.168 1.00 26.33 C ATOM 153 O GLN A 18 45.480 38.077 4.115 1.00 24.16 O ATOM 154 CB GLN A 18 46.424 40.670 3.873 1.00 21.09 C ATOM 155 CG GLN A 18 46.933 42.066 3.554 1.00 27.11 C ATOM 156 CD GLN A 18 48.084 42.489 4.442 1.00 34.07 C ATOM 157 OE1 GLN A 18 49.223 42.602 3.988 1.00 37.90 O ATOM 158 NE2 GLN A 18 47.794 42.728 5.716 1.00 26.96 N ATOM 159 HE22 GLN A 18 46.817 42.620 6.056 1.00 0.00 H ATOM 160 HE21 GLN A 18 48.544 43.023 6.373 1.00 0.00 H ATOM 161 H GLN A 18 44.486 41.428 1.456 1.00 0.00 H ATOM 162 N SER A 19 43.992 38.247 2.438 1.00 22.84 N ATOM 163 CA SER A 19 43.339 36.973 2.700 1.00 16.75 C ATOM 164 C SER A 19 43.872 35.920 1.739 1.00 18.94 C ATOM 165 O SER A 19 43.984 36.172 0.535 1.00 20.01 O ATOM 166 CB SER A 19 41.822 37.099 2.552 1.00 18.03 C ATOM 167 OG SER A 19 41.328 38.203 3.289 1.00 38.14 O ATOM 168 HG SER A 19 40.346 38.261 3.176 1.00 0.00 H ATOM 169 H SER A 19 43.652 38.824 1.643 1.00 0.00 H ATOM 170 N GLY A 20 44.196 34.749 2.270 1.00 20.63 N ATOM 171 CA GLY A 20 44.677 33.653 1.455 1.00 19.47 C ATOM 172 C GLY A 20 43.981 32.360 1.819 1.00 22.81 C ATOM 173 O GLY A 20 43.632 32.120 2.974 1.00 32.01 O ATOM 174 H GLY A 20 44.102 34.614 3.297 1.00 0.00 H ATOM 175 N GLU A 21 43.774 31.523 0.804 1.00 15.89 N ATOM 176 CA GLU A 21 43.136 30.231 1.002 1.00 21.34 C ATOM 177 C GLU A 21 43.836 29.171 0.167 1.00 12.90 C ATOM 178 O GLU A 21 44.425 29.462 -0.875 1.00 11.30 O ATOM 179 CB GLU A 21 41.643 30.270 0.658 1.00 20.44 C ATOM 180 CG GLU A 21 40.808 31.059 1.651 1.00 28.14 C ATOM 181 CD GLU A 21 39.430 30.465 1.854 1.00 31.42 C ATOM 182 OE1 GLU A 21 39.132 29.423 1.232 1.00 32.83 O ATOM 183 OE2 GLU A 21 38.644 31.041 2.634 1.00 29.18 O ATOM 184 H GLU A 21 44.075 31.800 -0.152 1.00 0.00 H ATOM 185 N PHE A 22 43.758 27.933 0.650 1.00 15.21 N ATOM 186 CA PHE A 22 44.381 26.782 0.006 1.00 14.16 C ATOM 187 C PHE A 22 43.488 25.584 0.280 1.00 14.28 C ATOM 188 O PHE A 22 43.262 25.243 1.444 1.00 20.89 O ATOM 189 CB PHE A 22 45.796 26.550 0.550 1.00 18.02 C ATOM 190 CG PHE A 22 46.532 25.408 -0.102 1.00 19.90 C ATOM 191 CD1 PHE A 22 47.506 25.654 -1.053 1.00 16.90 C ATOM 192 CD2 PHE A 22 46.274 24.093 0.258 1.00 15.82 C ATOM 193 CE1 PHE A 22 48.194 24.614 -1.649 1.00 20.86 C ATOM 194 CE2 PHE A 22 46.956 23.049 -0.335 1.00 17.75 C ATOM 195 CZ PHE A 22 47.918 23.310 -1.289 1.00 22.17 C ATOM 196 H PHE A 22 43.226 27.779 1.530 1.00 0.00 H ATOM 197 N MET A 23 42.982 24.950 -0.775 1.00 12.87 N ATOM 198 CA MET A 23 42.053 23.843 -0.601 1.00 17.40 C ATOM 199 C MET A 23 42.204 22.858 -1.752 1.00 15.08 C ATOM 200 O MET A 23 42.820 23.153 -2.779 1.00 16.67 O ATOM 201 CB MET A 23 40.606 24.345 -0.495 1.00 15.76 C ATOM 202 CG MET A 23 40.120 25.139 -1.702 1.00 16.55 C ATOM 203 SD MET A 23 39.359 24.118 -2.981 1.00 29.85 S ATOM 204 CE MET A 23 37.894 23.540 -2.128 1.00 20.32 C ATOM 205 H MET A 23 43.253 25.249 -1.734 1.00 0.00 H ATOM 206 N PHE A 24 41.631 21.674 -1.557 1.00 14.49 N ATOM 207 CA PHE A 24 41.580 20.629 -2.568 1.00 15.52 C ATOM 208 C PHE A 24 40.126 20.321 -2.895 1.00 19.19 C ATOM 209 O PHE A 24 39.293 20.186 -1.993 1.00 18.40 O ATOM 210 CB PHE A 24 42.290 19.356 -2.094 1.00 14.31 C ATOM 211 CG PHE A 24 43.702 19.223 -2.592 1.00 16.50 C ATOM 212 CD1 PHE A 24 44.709 20.029 -2.090 1.00 16.50 C ATOM 213 CD2 PHE A 24 44.023 18.279 -3.554 1.00 15.00 C ATOM 214 CE1 PHE A 24 46.010 19.903 -2.544 1.00 17.06 C ATOM 215 CE2 PHE A 24 45.322 18.148 -4.012 1.00 16.78 C ATOM 216 CZ PHE A 24 46.316 18.961 -3.506 1.00 15.79 C ATOM 217 H PHE A 24 41.196 21.485 -0.632 1.00 0.00 H ATOM 218 N ASP A 25 39.828 20.209 -4.186 1.00 22.60 N ATOM 219 CA ASP A 25 38.479 19.948 -4.667 1.00 20.13 C ATOM 220 C ASP A 25 38.452 18.631 -5.428 1.00 22.19 C ATOM 221 O ASP A 25 39.346 18.350 -6.232 1.00 27.96 O ATOM 222 CB ASP A 25 37.989 21.093 -5.565 1.00 23.36 C ATOM 223 CG ASP A 25 36.631 20.814 -6.186 1.00 33.29 C ATOM 224 OD1 ASP A 25 35.706 21.627 -5.978 1.00 31.03 O ATOM 225 OD2 ASP A 25 36.491 19.794 -6.895 1.00 35.87 O ATOM 226 H ASP A 25 40.593 20.312 -4.883 1.00 0.00 H ATOM 227 N PHE A 26 37.424 17.825 -5.169 1.00 26.53 N ATOM 228 CA PHE A 26 37.204 16.567 -5.877 1.00 19.51 C ATOM 229 C PHE A 26 35.784 16.571 -6.424 1.00 16.94 C ATOM 230 O PHE A 26 34.822 16.449 -5.659 1.00 23.29 O ATOM 231 CB PHE A 26 37.434 15.362 -4.962 1.00 18.01 C ATOM 232 CG PHE A 26 37.182 14.037 -5.630 1.00 20.51 C ATOM 233 CD1 PHE A 26 38.187 13.403 -6.342 1.00 17.66 C ATOM 234 CD2 PHE A 26 35.940 13.425 -5.544 1.00 24.03 C ATOM 235 CE1 PHE A 26 37.958 12.186 -6.959 1.00 21.14 C ATOM 236 CE2 PHE A 26 35.706 12.208 -6.159 1.00 19.39 C ATOM 237 CZ PHE A 26 36.716 11.588 -6.867 1.00 22.63 C ATOM 238 H PHE A 26 36.748 18.104 -4.430 1.00 0.00 H ATOM 239 N ASP A 27 35.657 16.722 -7.745 1.00 22.59 N ATOM 240 CA ASP A 27 34.369 16.681 -8.442 1.00 20.71 C ATOM 241 C ASP A 27 33.375 17.699 -7.887 1.00 26.22 C ATOM 242 O ASP A 27 32.160 17.510 -7.988 1.00 36.16 O ATOM 243 CB ASP A 27 33.761 15.275 -8.407 1.00 21.79 C ATOM 244 CG ASP A 27 34.590 14.262 -9.172 1.00 30.05 C ATOM 245 OD1 ASP A 27 35.493 14.678 -9.928 1.00 25.24 O ATOM 246 OD2 ASP A 27 34.333 13.048 -9.023 1.00 33.91 O ATOM 247 H ASP A 27 36.517 16.877 -8.308 1.00 0.00 H ATOM 248 N GLY A 28 33.872 18.786 -7.302 1.00 25.14 N ATOM 249 CA GLY A 28 33.022 19.824 -6.761 1.00 24.36 C ATOM 250 C GLY A 28 32.881 19.818 -5.254 1.00 27.15 C ATOM 251 O GLY A 28 32.290 20.756 -4.703 1.00 26.10 O ATOM 252 H GLY A 28 34.904 18.893 -7.232 1.00 0.00 H ATOM 253 N ASP A 29 33.392 18.797 -4.573 1.00 24.19 N ATOM 254 CA ASP A 29 33.388 18.745 -3.120 1.00 19.56 C ATOM 255 C ASP A 29 34.792 18.991 -2.586 1.00 22.52 C ATOM 256 O ASP A 29 35.790 18.699 -3.252 1.00 22.76 O ATOM 257 CB ASP A 29 32.863 17.401 -2.608 1.00 19.31 C ATOM 258 CG ASP A 29 31.349 17.340 -2.583 1.00 28.38 C ATOM 259 OD1 ASP A 29 30.748 17.897 -1.640 1.00 22.20 O ATOM 260 OD2 ASP A 29 30.762 16.734 -3.504 1.00 29.87 O ATOM 261 H ASP A 29 33.811 18.004 -5.100 1.00 0.00 H ATOM 262 N GLU A 30 34.859 19.534 -1.375 1.00 19.69 N ATOM 263 CA GLU A 30 36.127 19.878 -0.751 1.00 17.77 C ATOM 264 C GLU A 30 36.689 18.671 -0.012 1.00 20.19 C ATOM 265 O GLU A 30 36.007 18.075 0.827 1.00 23.60 O ATOM 266 CB GLU A 30 35.952 21.048 0.216 1.00 17.04 C ATOM 267 CG GLU A 30 37.228 21.441 0.939 1.00 26.48 C ATOM 268 CD GLU A 30 36.960 22.179 2.234 1.00 24.30 C ATOM 269 OE1 GLU A 30 37.820 22.125 3.138 1.00 26.64 O ATOM 270 OE2 GLU A 30 35.886 22.806 2.350 1.00 30.29 O ATOM 271 H GLU A 30 33.976 19.719 -0.857 1.00 0.00 H ATOM 272 N ILE A 31 37.932 18.311 -0.332 1.00 15.85 N ATOM 273 CA ILE A 31 38.624 17.282 0.434 1.00 17.15 C ATOM 274 C ILE A 31 39.146 17.859 1.742 1.00 19.70 C ATOM 275 O ILE A 31 38.876 17.330 2.827 1.00 20.48 O ATOM 276 CB ILE A 31 39.760 16.662 -0.400 1.00 18.69 C ATOM 277 CG1 ILE A 31 39.206 16.048 -1.687 1.00 16.54 C ATOM 278 CG2 ILE A 31 40.510 15.620 0.416 1.00 16.84 C ATOM 279 CD1 ILE A 31 40.274 15.489 -2.599 1.00 12.65 C ATOM 280 H ILE A 31 38.411 18.768 -1.134 1.00 0.00 H ATOM 281 N PHE A 32 39.894 18.955 1.658 1.00 14.43 N ATOM 282 CA PHE A 32 40.399 19.630 2.844 1.00 19.27 C ATOM 283 C PHE A 32 40.784 21.052 2.467 1.00 18.98 C ATOM 284 O PHE A 32 40.837 21.416 1.290 1.00 20.57 O ATOM 285 CB PHE A 32 41.595 18.888 3.452 1.00 19.57 C ATOM 286 CG PHE A 32 42.858 18.990 2.638 1.00 18.10 C ATOM 287 CD1 PHE A 32 43.773 20.006 2.874 1.00 24.00 C ATOM 288 CD2 PHE A 32 43.135 18.065 1.646 1.00 21.83 C ATOM 289 CE1 PHE A 32 44.933 20.103 2.131 1.00 18.62 C ATOM 290 CE2 PHE A 32 44.297 18.156 0.900 1.00 22.94 C ATOM 291 CZ PHE A 32 45.197 19.175 1.145 1.00 20.48 C ATOM 292 H PHE A 32 40.124 19.340 0.720 1.00 0.00 H ATOM 293 N HIS A 33 41.052 21.852 3.494 1.00 19.06 N ATOM 294 CA HIS A 33 41.666 23.158 3.329 1.00 18.86 C ATOM 295 C HIS A 33 42.634 23.371 4.482 1.00 22.38 C ATOM 296 O HIS A 33 42.599 22.658 5.487 1.00 19.56 O ATOM 297 CB HIS A 33 40.627 24.287 3.279 1.00 17.36 C ATOM 298 CG HIS A 33 40.022 24.613 4.609 1.00 22.98 C ATOM 299 ND1 HIS A 33 38.875 24.006 5.073 1.00 24.48 N ATOM 300 CD2 HIS A 33 40.403 25.485 5.572 1.00 18.95 C ATOM 301 CE1 HIS A 33 38.576 24.489 6.266 1.00 24.81 C ATOM 302 NE2 HIS A 33 39.488 25.388 6.592 1.00 23.55 N ATOM 303 H HIS A 33 40.813 21.530 4.454 1.00 0.00 H ATOM 304 N VAL A 34 43.508 24.359 4.325 1.00 21.29 N ATOM 305 CA VAL A 34 44.513 24.687 5.327 1.00 22.01 C ATOM 306 C VAL A 34 44.100 25.977 6.018 1.00 27.31 C ATOM 307 O VAL A 34 43.849 26.992 5.357 1.00 21.46 O ATOM 308 CB VAL A 34 45.912 24.815 4.703 1.00 18.71 C ATOM 309 CG1 VAL A 34 46.925 25.238 5.756 1.00 21.61 C ATOM 310 CG2 VAL A 34 46.321 23.499 4.063 1.00 20.51 C ATOM 311 H VAL A 34 43.473 24.921 3.451 1.00 0.00 H ATOM 312 N ASP A 35 44.016 25.933 7.345 1.00 30.88 N ATOM 313 CA ASP A 35 43.766 27.131 8.134 1.00 34.25 C ATOM 314 C ASP A 35 45.069 27.906 8.273 1.00 40.55 C ATOM 315 O ASP A 35 46.026 27.415 8.879 1.00 36.54 O ATOM 316 CB ASP A 35 43.203 26.764 9.505 1.00 41.22 C ATOM 317 CG ASP A 35 42.760 27.978 10.296 1.00 45.60 C ATOM 318 OD1 ASP A 35 43.619 28.616 10.940 1.00 39.76 O ATOM 319 OD2 ASP A 35 41.552 28.294 10.275 1.00 50.71 O ATOM 320 H ASP A 35 44.132 25.021 7.831 1.00 0.00 H ATOM 321 N MET A 36 45.110 29.115 7.707 1.00 37.66 N ATOM 322 CA MET A 36 46.353 29.879 7.690 1.00 37.27 C ATOM 323 C MET A 36 46.758 30.339 9.085 1.00 46.21 C ATOM 324 O MET A 36 47.955 30.454 9.373 1.00 48.01 O ATOM 325 CB MET A 36 46.215 31.079 6.754 1.00 29.81 C ATOM 326 CG MET A 36 45.684 30.720 5.377 1.00 35.29 C ATOM 327 SD MET A 36 46.751 29.555 4.512 1.00 45.52 S ATOM 328 CE MET A 36 45.677 29.021 3.189 1.00 29.30 C ATOM 329 H MET A 36 44.252 29.514 7.276 1.00 0.00 H ATOM 330 N ALA A 37 45.786 30.601 9.960 1.00 45.40 N ATOM 331 CA ALA A 37 46.106 31.080 11.301 1.00 40.09 C ATOM 332 C ALA A 37 46.727 29.976 12.148 1.00 36.86 C ATOM 333 O ALA A 37 47.763 30.182 12.792 1.00 38.62 O ATOM 334 CB ALA A 37 44.850 31.636 11.972 1.00 39.28 C ATOM 335 H ALA A 37 44.793 30.463 9.685 1.00 0.00 H ATOM 336 N LYS A 38 46.108 28.798 12.162 1.00 39.23 N ATOM 337 CA LYS A 38 46.603 27.675 12.946 1.00 41.82 C ATOM 338 C LYS A 38 47.622 26.825 12.202 1.00 40.31 C ATOM 339 O LYS A 38 48.305 26.014 12.838 1.00 39.92 O ATOM 340 CB LYS A 38 45.437 26.784 13.389 1.00 46.13 C ATOM 341 CG LYS A 38 44.420 27.472 14.280 1.00 46.46 C ATOM 342 CD LYS A 38 43.220 26.572 14.526 1.00 47.12 C ATOM 343 CE LYS A 38 42.160 27.273 15.358 1.00 52.26 C ATOM 344 NZ LYS A 38 40.916 26.460 15.462 1.00 44.99 N ATOM 345 HZ1 LYS A 38 40.530 26.295 14.510 1.00 0.00 H ATOM 346 HZ2 LYS A 38 41.136 25.548 15.911 1.00 0.00 H ATOM 347 HZ3 LYS A 38 40.216 26.971 16.037 1.00 0.00 H ATOM 348 H LYS A 38 45.244 28.676 11.596 1.00 0.00 H ATOM 349 N LYS A 39 47.738 26.989 10.881 1.00 42.32 N ATOM 350 CA LYS A 39 48.639 26.183 10.056 1.00 30.38 C ATOM 351 C LYS A 39 48.310 24.696 10.195 1.00 38.05 C ATOM 352 O LYS A 39 49.188 23.852 10.385 1.00 35.68 O ATOM 353 CB LYS A 39 50.102 26.470 10.402 1.00 39.45 C ATOM 354 CG LYS A 39 50.438 27.955 10.415 1.00 44.31 C ATOM 355 CD LYS A 39 51.567 28.264 11.384 1.00 49.19 C ATOM 356 CE LYS A 39 51.635 29.752 11.697 1.00 51.27 C ATOM 357 NZ LYS A 39 52.655 30.456 10.874 1.00 51.42 N ATOM 358 HZ1 LYS A 39 53.592 30.044 11.059 1.00 0.00 H ATOM 359 HZ2 LYS A 39 52.420 30.349 9.867 1.00 0.00 H ATOM 360 HZ3 LYS A 39 52.663 31.466 11.124 1.00 0.00 H ATOM 361 H LYS A 39 47.163 27.722 10.419 1.00 0.00 H ATOM 362 N GLU A 40 47.019 24.384 10.100 1.00 41.23 N ATOM 363 CA GLU A 40 46.509 23.030 10.253 1.00 36.17 C ATOM 364 C GLU A 40 45.750 22.605 9.005 1.00 31.65 C ATOM 365 O GLU A 40 45.093 23.419 8.348 1.00 29.72 O ATOM 366 CB GLU A 40 45.566 22.913 11.458 1.00 44.87 C ATOM 367 CG GLU A 40 46.173 23.251 12.803 1.00 49.58 C ATOM 368 CD GLU A 40 45.122 23.316 13.896 1.00 65.18 C ATOM 369 OE1 GLU A 40 43.933 23.512 13.564 1.00 55.99 O ATOM 370 OE2 GLU A 40 45.480 23.170 15.083 1.00 73.20 O ATOM 371 H GLU A 40 46.340 25.148 9.906 1.00 0.00 H ATOM 372 N THR A 41 45.834 21.315 8.693 1.00 27.90 N ATOM 373 CA THR A 41 44.970 20.721 7.685 1.00 20.18 C ATOM 374 C THR A 41 43.593 20.480 8.291 1.00 25.20 C ATOM 375 O THR A 41 43.480 19.932 9.392 1.00 32.13 O ATOM 376 CB THR A 41 45.561 19.409 7.169 1.00 27.30 C ATOM 377 OG1 THR A 41 46.868 19.649 6.631 1.00 30.84 O ATOM 378 CG2 THR A 41 44.673 18.811 6.088 1.00 26.51 C ATOM 379 HG1 THR A 41 47.248 18.798 6.298 1.00 0.00 H ATOM 380 H THR A 41 46.532 20.718 9.180 1.00 0.00 H ATOM 381 N VAL A 42 42.550 20.899 7.582 1.00 22.79 N ATOM 382 CA VAL A 42 41.174 20.778 8.054 1.00 19.82 C ATOM 383 C VAL A 42 40.412 19.933 7.044 1.00 22.86 C ATOM 384 O VAL A 42 40.100 20.401 5.942 1.00 24.99 O ATOM 385 CB VAL A 42 40.505 22.145 8.243 1.00 21.75 C ATOM 386 CG1 VAL A 42 39.084 21.971 8.751 1.00 15.62 C ATOM 387 CG2 VAL A 42 41.318 23.006 9.199 1.00 21.65 C ATOM 388 H VAL A 42 42.721 21.331 6.652 1.00 0.00 H ATOM 389 N TRP A 43 40.105 18.694 7.417 1.00 22.93 N ATOM 390 CA TRP A 43 39.389 17.790 6.530 1.00 28.30 C ATOM 391 C TRP A 43 37.891 18.060 6.608 1.00 22.72 C ATOM 392 O TRP A 43 37.335 18.207 7.701 1.00 28.60 O ATOM 393 CB TRP A 43 39.699 16.338 6.893 1.00 25.58 C ATOM 394 CG TRP A 43 41.166 16.030 6.849 1.00 28.01 C ATOM 395 CD1 TRP A 43 42.043 16.060 7.894 1.00 30.65 C ATOM 396 CD2 TRP A 43 41.932 15.660 5.695 1.00 26.92 C ATOM 397 NE1 TRP A 43 43.305 15.726 7.465 1.00 27.38 N ATOM 398 CE2 TRP A 43 43.263 15.476 6.118 1.00 21.16 C ATOM 399 CE3 TRP A 43 41.620 15.462 4.346 1.00 23.92 C ATOM 400 CZ2 TRP A 43 44.281 15.104 5.242 1.00 21.12 C ATOM 401 CZ3 TRP A 43 42.632 15.094 3.478 1.00 25.14 C ATOM 402 CH2 TRP A 43 43.946 14.919 3.929 1.00 22.78 C ATOM 403 HE1 TRP A 43 44.153 15.672 8.064 1.00 0.00 H ATOM 404 H TRP A 43 40.383 18.364 8.363 1.00 0.00 H ATOM 405 N ARG A 44 37.244 18.134 5.441 1.00 23.98 N ATOM 406 CA ARG A 44 35.817 18.444 5.392 1.00 28.52 C ATOM 407 C ARG A 44 35.003 17.404 6.151 1.00 26.66 C ATOM 408 O ARG A 44 34.111 17.746 6.936 1.00 23.72 O ATOM 409 CB ARG A 44 35.357 18.541 3.938 1.00 22.02 C ATOM 410 CG ARG A 44 33.899 18.932 3.767 1.00 21.99 C ATOM 411 CD ARG A 44 33.625 20.309 4.348 1.00 18.82 C ATOM 412 NE ARG A 44 32.241 20.721 4.133 1.00 17.87 N ATOM 413 CZ ARG A 44 31.235 20.406 4.942 1.00 23.25 C ATOM 414 NH1 ARG A 44 31.457 19.672 6.023 1.00 21.19 N ATOM 415 NH2 ARG A 44 30.007 20.824 4.669 1.00 19.81 N ATOM 416 HE ARG A 44 32.029 21.297 3.294 1.00 0.00 H ATOM 417 HH12 ARG A 44 30.669 19.426 6.655 1.00 0.00 H ATOM 418 HH11 ARG A 44 32.419 19.342 6.239 1.00 0.00 H ATOM 419 HH22 ARG A 44 29.221 20.577 5.303 1.00 0.00 H ATOM 420 HH21 ARG A 44 29.830 21.399 3.821 1.00 0.00 H ATOM 421 H ARG A 44 37.763 17.969 4.555 1.00 0.00 H ATOM 422 N LEU A 45 35.292 16.127 5.922 1.00 27.97 N ATOM 423 CA LEU A 45 34.763 15.036 6.727 1.00 27.11 C ATOM 424 C LEU A 45 35.889 14.503 7.601 1.00 37.01 C ATOM 425 O LEU A 45 36.972 14.190 7.096 1.00 31.70 O ATOM 426 CB LEU A 45 34.188 13.923 5.847 1.00 24.68 C ATOM 427 CG LEU A 45 33.033 14.320 4.924 1.00 28.56 C ATOM 428 CD1 LEU A 45 32.472 13.100 4.207 1.00 27.05 C ATOM 429 CD2 LEU A 45 31.942 15.040 5.701 1.00 22.10 C ATOM 430 H LEU A 45 35.926 15.897 5.130 1.00 0.00 H ATOM 431 N GLU A 46 35.632 14.409 8.909 1.00 45.46 N ATOM 432 CA GLU A 46 36.692 14.054 9.849 1.00 41.53 C ATOM 433 C GLU A 46 37.292 12.688 9.542 1.00 40.36 C ATOM 434 O GLU A 46 38.459 12.436 9.868 1.00 34.58 O ATOM 435 CB GLU A 46 36.157 14.085 11.281 1.00 42.83 C ATOM 436 CG GLU A 46 37.245 14.116 12.342 1.00 50.62 C ATOM 437 CD GLU A 46 36.888 13.299 13.567 1.00 62.14 C ATOM 438 OE1 GLU A 46 36.610 12.091 13.415 1.00 60.40 O ATOM 439 OE2 GLU A 46 36.882 13.864 14.681 1.00 75.44 O ATOM 440 H GLU A 46 34.670 14.590 9.260 1.00 0.00 H ATOM 441 N GLU A 47 36.520 11.798 8.913 1.00 33.99 N ATOM 442 CA GLU A 47 37.039 10.486 8.547 1.00 35.87 C ATOM 443 C GLU A 47 38.161 10.571 7.521 1.00 36.87 C ATOM 444 O GLU A 47 38.946 9.624 7.398 1.00 35.84 O ATOM 445 CB GLU A 47 35.910 9.608 8.003 1.00 31.26 C ATOM 446 CG GLU A 47 35.515 9.930 6.570 1.00 41.22 C ATOM 447 CD GLU A 47 34.318 9.130 6.096 1.00 57.28 C ATOM 448 OE1 GLU A 47 34.438 8.437 5.064 1.00 53.01 O ATOM 449 OE2 GLU A 47 33.259 9.196 6.754 1.00 52.91 O ATOM 450 H GLU A 47 35.536 12.044 8.681 1.00 0.00 H ATOM 451 N PHE A 48 38.255 11.681 6.783 1.00 34.23 N ATOM 452 CA PHE A 48 39.296 11.809 5.768 1.00 30.86 C ATOM 453 C PHE A 48 40.683 11.818 6.399 1.00 33.68 C ATOM 454 O PHE A 48 41.637 11.279 5.826 1.00 30.35 O ATOM 455 CB PHE A 48 39.081 13.080 4.945 1.00 33.24 C ATOM 456 CG PHE A 48 37.869 13.041 4.053 1.00 28.71 C ATOM 457 CD1 PHE A 48 37.468 14.176 3.367 1.00 18.51 C ATOM 458 CD2 PHE A 48 37.134 11.877 3.897 1.00 31.80 C ATOM 459 CE1 PHE A 48 36.359 14.151 2.543 1.00 23.93 C ATOM 460 CE2 PHE A 48 36.022 11.846 3.075 1.00 24.29 C ATOM 461 CZ PHE A 48 35.635 12.985 2.397 1.00 20.12 C ATOM 462 H PHE A 48 37.582 12.459 6.933 1.00 0.00 H ATOM 463 N GLY A 49 40.813 12.423 7.582 1.00 32.02 N ATOM 464 CA GLY A 49 42.108 12.536 8.229 1.00 30.74 C ATOM 465 C GLY A 49 42.671 11.225 8.735 1.00 30.26 C ATOM 466 O GLY A 49 43.862 11.158 9.054 1.00 37.29 O ATOM 467 H GLY A 49 39.972 12.820 8.048 1.00 0.00 H ATOM 468 N ARG A 50 41.843 10.182 8.821 1.00 29.81 N ATOM 469 CA ARG A 50 42.324 8.881 9.269 1.00 33.39 C ATOM 470 C ARG A 50 43.033 8.109 8.167 1.00 34.51 C ATOM 471 O ARG A 50 43.846 7.230 8.469 1.00 38.95 O ATOM 472 CB ARG A 50 41.162 8.048 9.817 1.00 40.07 C ATOM 473 CG ARG A 50 40.323 8.765 10.860 1.00 44.85 C ATOM 474 CD ARG A 50 39.213 7.871 11.384 1.00 49.89 C ATOM 475 NE ARG A 50 37.896 8.474 11.198 1.00 54.49 N ATOM 476 CZ ARG A 50 37.349 9.349 12.035 1.00 52.64 C ATOM 477 NH1 ARG A 50 38.008 9.731 13.121 1.00 58.01 N ATOM 478 NH2 ARG A 50 36.145 9.844 11.786 1.00 45.08 N ATOM 479 HE ARG A 50 37.351 8.201 10.356 1.00 0.00 H ATOM 480 HH12 ARG A 50 37.579 10.416 13.776 1.00 0.00 H ATOM 481 HH11 ARG A 50 38.954 9.346 13.318 1.00 0.00 H ATOM 482 HH22 ARG A 50 35.718 10.529 12.442 1.00 0.00 H ATOM 483 HH21 ARG A 50 35.627 9.548 10.934 1.00 0.00 H ATOM 484 H ARG A 50 40.842 10.299 8.565 1.00 0.00 H ATOM 485 N PHE A 51 42.749 8.418 6.903 1.00 38.46 N ATOM 486 CA PHE A 51 43.382 7.744 5.776 1.00 36.56 C ATOM 487 C PHE A 51 44.488 8.565 5.133 1.00 31.29 C ATOM 488 O PHE A 51 45.471 7.991 4.654 1.00 37.25 O ATOM 489 CB PHE A 51 42.337 7.400 4.708 1.00 37.65 C ATOM 490 CG PHE A 51 41.120 6.703 5.248 1.00 46.57 C ATOM 491 CD1 PHE A 51 39.856 7.041 4.794 1.00 44.87 C ATOM 492 CD2 PHE A 51 41.239 5.704 6.201 1.00 51.19 C ATOM 493 CE1 PHE A 51 38.732 6.404 5.285 1.00 45.23 C ATOM 494 CE2 PHE A 51 40.118 5.063 6.697 1.00 48.53 C ATOM 495 CZ PHE A 51 38.863 5.413 6.237 1.00 44.46 C ATOM 496 H PHE A 51 42.052 9.166 6.713 1.00 0.00 H ATOM 497 N ALA A 52 44.355 9.889 5.113 1.00 31.38 N ATOM 498 CA ALA A 52 45.312 10.761 4.453 1.00 28.17 C ATOM 499 C ALA A 52 45.816 11.817 5.426 1.00 30.05 C ATOM 500 O ALA A 52 45.209 12.078 6.468 1.00 26.78 O ATOM 501 CB ALA A 52 44.697 11.438 3.219 1.00 27.78 C ATOM 502 H ALA A 52 43.534 10.316 5.588 1.00 0.00 H ATOM 503 N SER A 53 46.946 12.423 5.066 1.00 23.14 N ATOM 504 CA SER A 53 47.537 13.506 5.835 1.00 26.96 C ATOM 505 C SER A 53 48.070 14.555 4.870 1.00 27.36 C ATOM 506 O SER A 53 48.242 14.298 3.677 1.00 24.21 O ATOM 507 CB SER A 53 48.662 13.006 6.753 1.00 30.55 C ATOM 508 OG SER A 53 48.167 12.097 7.721 1.00 41.15 O ATOM 509 HG SER A 53 47.482 12.548 8.276 1.00 0.00 H ATOM 510 H SER A 53 47.426 12.108 4.199 1.00 0.00 H ATOM 511 N PHE A 54 48.328 15.750 5.398 1.00 27.37 N ATOM 512 CA PHE A 54 48.867 16.827 4.579 1.00 29.70 C ATOM 513 C PHE A 54 49.740 17.733 5.432 1.00 27.99 C ATOM 514 O PHE A 54 49.348 18.114 6.540 1.00 31.18 O ATOM 515 CB PHE A 54 47.747 17.640 3.921 1.00 27.77 C ATOM 516 CG PHE A 54 48.247 18.748 3.039 1.00 26.58 C ATOM 517 CD1 PHE A 54 48.875 18.463 1.838 1.00 20.06 C ATOM 518 CD2 PHE A 54 48.094 20.073 3.412 1.00 21.76 C ATOM 519 CE1 PHE A 54 49.341 19.478 1.025 1.00 19.46 C ATOM 520 CE2 PHE A 54 48.556 21.093 2.602 1.00 22.25 C ATOM 521 CZ PHE A 54 49.181 20.795 1.407 1.00 24.55 C ATOM 522 H PHE A 54 48.142 15.916 6.408 1.00 0.00 H ATOM 523 N GLU A 55 50.917 18.073 4.912 1.00 26.19 N ATOM 524 CA GLU A 55 51.807 19.027 5.566 1.00 33.92 C ATOM 525 C GLU A 55 51.327 20.438 5.245 1.00 31.17 C ATOM 526 O GLU A 55 51.443 20.896 4.103 1.00 30.53 O ATOM 527 CB GLU A 55 53.248 18.815 5.111 1.00 25.32 C ATOM 528 CG GLU A 55 54.196 19.920 5.543 1.00 39.31 C ATOM 529 CD GLU A 55 54.167 20.160 7.039 1.00 41.84 C ATOM 530 OE1 GLU A 55 54.423 19.203 7.801 1.00 47.59 O ATOM 531 OE2 GLU A 55 53.881 21.303 7.454 1.00 42.64 O ATOM 532 H GLU A 55 51.212 17.645 4.011 1.00 0.00 H ATOM 533 N ALA A 56 50.803 21.136 6.254 1.00 27.07 N ATOM 534 CA ALA A 56 50.156 22.421 6.036 1.00 26.06 C ATOM 535 C ALA A 56 51.129 23.537 5.670 1.00 27.72 C ATOM 536 O ALA A 56 50.674 24.600 5.228 1.00 28.98 O ATOM 537 CB ALA A 56 49.363 22.820 7.283 1.00 25.30 C ATOM 538 H ALA A 56 50.858 20.753 7.219 1.00 0.00 H ATOM 539 N GLN A 57 52.444 23.343 5.836 1.00 29.08 N ATOM 540 CA GLN A 57 53.372 24.434 5.535 1.00 34.46 C ATOM 541 C GLN A 57 53.606 24.579 4.040 1.00 29.13 C ATOM 542 O GLN A 57 53.902 25.683 3.571 1.00 35.09 O ATOM 543 CB GLN A 57 54.708 24.234 6.270 1.00 31.47 C ATOM 544 CG GLN A 57 55.675 25.397 6.120 1.00 35.19 C ATOM 545 CD GLN A 57 55.548 26.401 7.252 1.00 40.94 C ATOM 546 OE1 GLN A 57 55.429 26.018 8.421 1.00 57.64 O ATOM 547 NE2 GLN A 57 55.533 27.696 6.898 1.00 40.32 N ATOM 548 HE22 GLN A 57 55.637 27.963 5.898 1.00 0.00 H ATOM 549 HE21 GLN A 57 55.417 28.432 7.623 1.00 0.00 H ATOM 550 H GLN A 57 52.802 22.427 6.175 1.00 0.00 H ATOM 551 N GLY A 58 53.450 23.497 3.277 1.00 25.35 N ATOM 552 CA GLY A 58 53.512 23.624 1.834 1.00 25.10 C ATOM 553 C GLY A 58 52.451 24.559 1.284 1.00 31.24 C ATOM 554 O GLY A 58 52.663 25.216 0.260 1.00 28.50 O ATOM 555 H GLY A 58 53.285 22.568 3.714 1.00 0.00 H ATOM 556 N ALA A 59 51.300 24.639 1.958 1.00 29.01 N ATOM 557 CA ALA A 59 50.244 25.545 1.526 1.00 26.30 C ATOM 558 C ALA A 59 50.629 26.997 1.768 1.00 24.56 C ATOM 559 O ALA A 59 50.405 27.855 0.906 1.00 23.00 O ATOM 560 CB ALA A 59 48.942 25.212 2.253 1.00 19.68 C ATOM 561 H ALA A 59 51.156 24.047 2.801 1.00 0.00 H ATOM 562 N LEU A 60 51.197 27.294 2.942 1.00 26.27 N ATOM 563 CA LEU A 60 51.583 28.666 3.257 1.00 26.61 C ATOM 564 C LEU A 60 52.723 29.145 2.374 1.00 25.82 C ATOM 565 O LEU A 60 52.801 30.338 2.063 1.00 22.62 O ATOM 566 CB LEU A 60 51.978 28.778 4.729 1.00 30.93 C ATOM 567 CG LEU A 60 51.115 27.967 5.705 1.00 29.90 C ATOM 568 CD1 LEU A 60 51.842 27.774 7.026 1.00 39.54 C ATOM 569 CD2 LEU A 60 49.784 28.649 5.948 1.00 26.03 C ATOM 570 H LEU A 60 51.365 26.539 3.638 1.00 0.00 H ATOM 571 N ALA A 61 53.614 28.238 1.966 1.00 23.60 N ATOM 572 CA ALA A 61 54.651 28.606 1.010 1.00 24.31 C ATOM 573 C ALA A 61 54.053 28.978 -0.340 1.00 25.60 C ATOM 574 O ALA A 61 54.596 29.837 -1.046 1.00 20.65 O ATOM 575 CB ALA A 61 55.655 27.463 0.852 1.00 17.50 C ATOM 576 H ALA A 61 53.568 27.265 2.332 1.00 0.00 H ATOM 577 N ASN A 62 52.936 28.348 -0.712 1.00 21.71 N ATOM 578 CA ASN A 62 52.268 28.701 -1.960 1.00 24.27 C ATOM 579 C ASN A 62 51.569 30.050 -1.852 1.00 20.53 C ATOM 580 O ASN A 62 51.609 30.852 -2.792 1.00 20.63 O ATOM 581 CB ASN A 62 51.273 27.609 -2.350 1.00 21.18 C ATOM 582 CG ASN A 62 51.859 26.608 -3.324 1.00 22.69 C ATOM 583 OD1 ASN A 62 53.059 26.624 -3.599 1.00 26.39 O ATOM 584 ND2 ASN A 62 51.014 25.733 -3.854 1.00 22.73 N ATOM 585 HD22 ASN A 62 50.008 25.757 -3.592 1.00 0.00 H ATOM 586 HD21 ASN A 62 51.358 25.023 -4.532 1.00 0.00 H ATOM 587 H ASN A 62 52.539 27.600 -0.108 1.00 0.00 H ATOM 588 N ILE A 63 50.922 30.318 -0.714 1.00 21.08 N ATOM 589 CA ILE A 63 50.270 31.610 -0.517 1.00 20.52 C ATOM 590 C ILE A 63 51.299 32.731 -0.513 1.00 20.71 C ATOM 591 O ILE A 63 51.028 33.838 -0.998 1.00 29.03 O ATOM 592 CB ILE A 63 49.426 31.590 0.777 1.00 19.25 C ATOM 593 CG1 ILE A 63 47.987 31.152 0.481 1.00 25.63 C ATOM 594 CG2 ILE A 63 49.427 32.952 1.462 1.00 23.34 C ATOM 595 CD1 ILE A 63 47.845 29.709 0.043 1.00 27.06 C ATOM 596 H ILE A 63 50.882 29.601 0.038 1.00 0.00 H ATOM 597 N ALA A 64 52.500 32.462 0.007 1.00 19.33 N ATOM 598 CA ALA A 64 53.564 33.460 -0.029 1.00 21.99 C ATOM 599 C ALA A 64 53.940 33.815 -1.462 1.00 20.02 C ATOM 600 O ALA A 64 54.186 34.986 -1.776 1.00 20.40 O ATOM 601 CB ALA A 64 54.785 32.953 0.738 1.00 16.27 C ATOM 602 H ALA A 64 52.678 31.534 0.441 1.00 0.00 H ATOM 603 N VAL A 65 53.988 32.816 -2.347 1.00 17.68 N ATOM 604 CA VAL A 65 54.274 33.085 -3.753 1.00 16.90 C ATOM 605 C VAL A 65 53.084 33.766 -4.419 1.00 18.32 C ATOM 606 O VAL A 65 53.252 34.695 -5.220 1.00 16.97 O ATOM 607 CB VAL A 65 54.662 31.783 -4.478 1.00 19.76 C ATOM 608 CG1 VAL A 65 54.895 32.045 -5.958 1.00 19.80 C ATOM 609 CG2 VAL A 65 55.901 31.173 -3.842 1.00 20.68 C ATOM 610 H VAL A 65 53.820 31.839 -2.032 1.00 0.00 H ATOM 611 N ASP A 66 51.865 33.319 -4.101 1.00 14.56 N ATOM 612 CA ASP A 66 50.675 33.964 -4.648 1.00 17.70 C ATOM 613 C ASP A 66 50.584 35.417 -4.200 1.00 19.14 C ATOM 614 O ASP A 66 50.125 36.282 -4.956 1.00 16.62 O ATOM 615 CB ASP A 66 49.421 33.196 -4.230 1.00 18.22 C ATOM 616 CG ASP A 66 49.440 31.754 -4.692 1.00 22.77 C ATOM 617 OD1 ASP A 66 50.055 31.473 -5.742 1.00 23.40 O ATOM 618 OD2 ASP A 66 48.841 30.900 -4.004 1.00 25.98 O ATOM 619 H ASP A 66 51.764 32.506 -3.460 1.00 0.00 H ATOM 620 N LYS A 67 51.014 35.701 -2.969 1.00 15.34 N ATOM 621 CA LYS A 67 51.073 37.083 -2.505 1.00 19.10 C ATOM 622 C LYS A 67 52.041 37.902 -3.349 1.00 18.78 C ATOM 623 O LYS A 67 51.745 39.046 -3.714 1.00 16.45 O ATOM 624 CB LYS A 67 51.477 37.115 -1.030 1.00 21.05 C ATOM 625 CG LYS A 67 51.634 38.505 -0.439 1.00 25.54 C ATOM 626 CD LYS A 67 52.083 38.425 1.013 1.00 24.00 C ATOM 627 CE LYS A 67 52.336 39.804 1.598 1.00 23.83 C ATOM 628 NZ LYS A 67 51.100 40.632 1.621 1.00 40.06 N ATOM 629 HZ1 LYS A 67 50.745 40.749 0.651 1.00 0.00 H ATOM 630 HZ2 LYS A 67 50.378 40.159 2.201 1.00 0.00 H ATOM 631 HZ3 LYS A 67 51.316 41.565 2.027 1.00 0.00 H ATOM 632 H LYS A 67 51.309 34.931 -2.335 1.00 0.00 H ATOM 633 N ALA A 68 53.198 37.326 -3.682 1.00 17.06 N ATOM 634 CA ALA A 68 54.178 38.044 -4.489 1.00 13.13 C ATOM 635 C ALA A 68 53.717 38.176 -5.935 1.00 15.32 C ATOM 636 O ALA A 68 53.937 39.215 -6.569 1.00 22.57 O ATOM 637 CB ALA A 68 55.533 37.340 -4.421 1.00 15.46 C ATOM 638 H ALA A 68 53.402 36.357 -3.363 1.00 0.00 H ATOM 639 N ASN A 69 53.080 37.134 -6.476 1.00 16.93 N ATOM 640 CA ASN A 69 52.593 37.203 -7.850 1.00 21.36 C ATOM 641 C ASN A 69 51.493 38.247 -7.995 1.00 16.25 C ATOM 642 O ASN A 69 51.412 38.930 -9.022 1.00 18.49 O ATOM 643 CB ASN A 69 52.093 35.832 -8.307 1.00 16.76 C ATOM 644 CG ASN A 69 53.222 34.854 -8.568 1.00 21.05 C ATOM 645 OD1 ASN A 69 54.381 35.247 -8.705 1.00 26.93 O ATOM 646 ND2 ASN A 69 52.887 33.571 -8.648 1.00 15.01 N ATOM 647 HD22 ASN A 69 51.895 33.284 -8.526 1.00 0.00 H ATOM 648 HD21 ASN A 69 53.617 32.854 -8.833 1.00 0.00 H ATOM 649 H ASN A 69 52.931 36.270 -5.916 1.00 0.00 H ATOM 650 N LEU A 70 50.640 38.389 -6.977 1.00 13.18 N ATOM 651 CA LEU A 70 49.567 39.376 -7.047 1.00 18.39 C ATOM 652 C LEU A 70 50.123 40.790 -7.159 1.00 19.56 C ATOM 653 O LEU A 70 49.581 41.621 -7.896 1.00 22.45 O ATOM 654 CB LEU A 70 48.655 39.253 -5.827 1.00 14.00 C ATOM 655 CG LEU A 70 47.504 40.258 -5.757 1.00 16.72 C ATOM 656 CD1 LEU A 70 46.652 40.186 -7.016 1.00 16.82 C ATOM 657 CD2 LEU A 70 46.655 40.021 -4.518 1.00 21.33 C ATOM 658 H LEU A 70 50.741 37.793 -6.130 1.00 0.00 H ATOM 659 N GLU A 71 51.206 41.081 -6.434 1.00 20.82 N ATOM 660 CA GLU A 71 51.846 42.387 -6.561 1.00 22.35 C ATOM 661 C GLU A 71 52.399 42.589 -7.965 1.00 21.36 C ATOM 662 O GLU A 71 52.338 43.695 -8.514 1.00 25.82 O ATOM 663 CB GLU A 71 52.955 42.532 -5.520 1.00 23.62 C ATOM 664 H GLU A 71 51.595 40.375 -5.777 1.00 0.00 H ATOM 665 N ILE A 72 52.937 41.525 -8.564 1.00 18.56 N ATOM 666 CA ILE A 72 53.450 41.615 -9.926 1.00 19.80 C ATOM 667 C ILE A 72 52.311 41.827 -10.915 1.00 22.52 C ATOM 668 O ILE A 72 52.408 42.656 -11.828 1.00 22.38 O ATOM 669 CB ILE A 72 54.266 40.355 -10.265 1.00 20.50 C ATOM 670 CG1 ILE A 72 55.520 40.281 -9.391 1.00 18.75 C ATOM 671 CG2 ILE A 72 54.619 40.335 -11.741 1.00 19.31 C ATOM 672 CD1 ILE A 72 56.237 38.950 -9.457 1.00 21.73 C ATOM 673 H ILE A 72 52.991 40.621 -8.053 1.00 0.00 H ATOM 674 N MET A 73 51.211 41.087 -10.748 1.00 20.67 N ATOM 675 CA MET A 73 50.104 41.184 -11.692 1.00 18.49 C ATOM 676 C MET A 73 49.337 42.490 -11.532 1.00 19.02 C ATOM 677 O MET A 73 48.833 43.033 -12.522 1.00 17.44 O ATOM 678 CB MET A 73 49.164 39.991 -11.523 1.00 17.64 C ATOM 679 CG MET A 73 49.839 38.646 -11.722 1.00 17.56 C ATOM 680 SD MET A 73 50.770 38.568 -13.261 1.00 24.79 S ATOM 681 CE MET A 73 49.455 38.801 -14.453 1.00 18.81 C ATOM 682 H MET A 73 51.144 40.437 -9.939 1.00 0.00 H ATOM 683 N THR A 74 49.233 43.004 -10.304 1.00 17.42 N ATOM 684 CA THR A 74 48.576 44.291 -10.099 1.00 13.82 C ATOM 685 C THR A 74 49.318 45.405 -10.826 1.00 16.38 C ATOM 686 O THR A 74 48.697 46.249 -11.483 1.00 19.23 O ATOM 687 CB THR A 74 48.475 44.600 -8.605 1.00 14.84 C ATOM 688 OG1 THR A 74 47.854 43.500 -7.929 1.00 13.52 O ATOM 689 CG2 THR A 74 47.647 45.854 -8.378 1.00 14.09 C ATOM 690 HG1 THR A 74 48.398 42.683 -8.061 1.00 0.00 H ATOM 691 H THR A 74 49.622 42.485 -9.491 1.00 0.00 H ATOM 692 N LYS A 75 50.650 45.422 -10.721 1.00 20.02 N ATOM 693 CA LYS A 75 51.441 46.387 -11.478 1.00 19.48 C ATOM 694 C LYS A 75 51.283 46.173 -12.977 1.00 19.19 C ATOM 695 O LYS A 75 51.149 47.136 -13.741 1.00 21.41 O ATOM 696 CB LYS A 75 52.916 46.287 -11.088 1.00 21.41 C ATOM 697 CG LYS A 75 53.349 47.221 -9.975 1.00 27.80 C ATOM 698 CD LYS A 75 54.863 47.388 -9.969 1.00 34.02 C ATOM 699 CE LYS A 75 55.571 46.120 -9.522 1.00 43.96 C ATOM 700 NZ LYS A 75 55.429 45.897 -8.056 1.00 44.12 N ATOM 701 HZ1 LYS A 75 55.842 46.702 -7.543 1.00 0.00 H ATOM 702 HZ2 LYS A 75 54.421 45.812 -7.816 1.00 0.00 H ATOM 703 HZ3 LYS A 75 55.925 45.023 -7.790 1.00 0.00 H ATOM 704 H LYS A 75 51.127 44.742 -10.095 1.00 0.00 H ATOM 705 N ARG A 76 51.295 44.912 -13.414 1.00 17.97 N ATOM 706 CA ARG A 76 51.249 44.616 -14.841 1.00 20.48 C ATOM 707 C ARG A 76 49.927 45.046 -15.466 1.00 20.29 C ATOM 708 O ARG A 76 49.903 45.471 -16.627 1.00 24.72 O ATOM 709 CB ARG A 76 51.490 43.123 -15.063 1.00 22.13 C ATOM 710 CG ARG A 76 52.048 42.774 -16.428 1.00 25.56 C ATOM 711 CD ARG A 76 52.308 41.281 -16.541 1.00 26.12 C ATOM 712 NE ARG A 76 53.461 40.846 -15.758 1.00 21.86 N ATOM 713 CZ ARG A 76 53.802 39.574 -15.578 1.00 20.07 C ATOM 714 NH1 ARG A 76 53.074 38.608 -16.121 1.00 21.53 N ATOM 715 NH2 ARG A 76 54.869 39.265 -14.854 1.00 25.41 N ATOM 716 HE ARG A 76 54.052 41.577 -15.313 1.00 0.00 H ATOM 717 HH12 ARG A 76 53.342 37.613 -15.980 1.00 0.00 H ATOM 718 HH11 ARG A 76 52.235 38.845 -16.688 1.00 0.00 H ATOM 719 HH22 ARG A 76 55.133 38.269 -14.715 1.00 0.00 H ATOM 720 HH21 ARG A 76 55.442 40.019 -14.425 1.00 0.00 H ATOM 721 H ARG A 76 51.338 44.131 -12.728 1.00 0.00 H ATOM 722 N SER A 77 48.828 44.954 -14.721 1.00 19.45 N ATOM 723 CA SER A 77 47.519 45.370 -15.210 1.00 21.33 C ATOM 724 C SER A 77 47.261 46.859 -15.023 1.00 26.07 C ATOM 725 O SER A 77 46.116 47.295 -15.187 1.00 22.25 O ATOM 726 CB SER A 77 46.416 44.570 -14.512 1.00 18.55 C ATOM 727 OG SER A 77 46.255 44.996 -13.170 1.00 24.48 O ATOM 728 HG SER A 77 45.538 44.465 -12.740 1.00 0.00 H ATOM 729 H SER A 77 48.906 44.572 -13.757 1.00 0.00 H ATOM 730 N ASN A 78 48.292 47.637 -14.684 1.00 24.09 N ATOM 731 CA ASN A 78 48.152 49.069 -14.411 1.00 21.77 C ATOM 732 C ASN A 78 47.140 49.321 -13.295 1.00 18.78 C ATOM 733 O ASN A 78 46.348 50.264 -13.350 1.00 19.16 O ATOM 734 CB ASN A 78 47.779 49.843 -15.678 1.00 24.16 C ATOM 735 CG ASN A 78 48.845 49.746 -16.753 1.00 36.56 C ATOM 736 OD1 ASN A 78 50.039 49.693 -16.455 1.00 28.67 O ATOM 737 ND2 ASN A 78 48.419 49.718 -18.011 1.00 39.90 N ATOM 738 HD22 ASN A 78 47.401 49.765 -18.216 1.00 0.00 H ATOM 739 HD21 ASN A 78 49.104 49.649 -18.791 1.00 0.00 H ATOM 740 H ASN A 78 49.236 47.207 -14.611 1.00 0.00 H ATOM 741 N TYR A 79 47.169 48.459 -12.275 1.00 19.61 N ATOM 742 CA TYR A 79 46.308 48.576 -11.096 1.00 23.70 C ATOM 743 C TYR A 79 44.830 48.582 -11.485 1.00 18.10 C ATOM 744 O TYR A 79 44.050 49.434 -11.053 1.00 24.01 O ATOM 745 CB TYR A 79 46.671 49.815 -10.272 1.00 14.53 C ATOM 746 CG TYR A 79 48.062 49.756 -9.687 1.00 12.93 C ATOM 747 CD1 TYR A 79 49.170 50.119 -10.442 1.00 17.22 C ATOM 748 CD2 TYR A 79 48.270 49.332 -8.382 1.00 13.21 C ATOM 749 CE1 TYR A 79 50.445 50.062 -9.913 1.00 21.28 C ATOM 750 CE2 TYR A 79 49.541 49.271 -7.844 1.00 14.73 C ATOM 751 CZ TYR A 79 50.624 49.638 -8.614 1.00 20.86 C ATOM 752 OH TYR A 79 51.892 49.580 -8.083 1.00 23.55 O ATOM 753 HH TYR A 79 52.547 49.875 -8.764 1.00 0.00 H ATOM 754 H TYR A 79 47.838 47.664 -12.320 1.00 0.00 H ATOM 755 N THR A 80 44.447 47.611 -12.315 1.00 16.07 N ATOM 756 CA THR A 80 43.055 47.445 -12.708 1.00 20.10 C ATOM 757 C THR A 80 42.352 46.584 -11.667 1.00 22.26 C ATOM 758 O THR A 80 42.679 45.393 -11.541 1.00 18.79 O ATOM 759 CB THR A 80 42.955 46.805 -14.085 1.00 23.20 C ATOM 760 OG1 THR A 80 43.521 47.686 -15.063 1.00 20.18 O ATOM 761 CG2 THR A 80 41.500 46.530 -14.438 1.00 9.85 C ATOM 762 HG1 THR A 80 44.472 47.853 -14.844 1.00 0.00 H ATOM 763 H THR A 80 45.161 46.955 -12.691 1.00 0.00 H ATOM 764 N PRO A 81 41.404 47.122 -10.909 1.00 14.24 N ATOM 765 CA PRO A 81 40.783 46.352 -9.828 1.00 13.34 C ATOM 766 C PRO A 81 39.781 45.333 -10.356 1.00 16.50 C ATOM 767 O PRO A 81 39.456 45.284 -11.543 1.00 17.20 O ATOM 768 CB PRO A 81 40.086 47.427 -8.992 1.00 17.00 C ATOM 769 CG PRO A 81 39.768 48.502 -9.970 1.00 11.74 C ATOM 770 CD PRO A 81 40.896 48.504 -10.969 1.00 12.58 C ATOM 771 N ILE A 82 39.291 44.511 -9.433 1.00 16.69 N ATOM 772 CA ILE A 82 38.305 43.490 -9.759 1.00 17.29 C ATOM 773 C ILE A 82 36.920 44.124 -9.799 1.00 19.40 C ATOM 774 O ILE A 82 36.661 45.151 -9.160 1.00 17.84 O ATOM 775 CB ILE A 82 38.373 42.331 -8.743 1.00 20.71 C ATOM 776 CG1 ILE A 82 37.687 41.079 -9.296 1.00 18.17 C ATOM 777 CG2 ILE A 82 37.748 42.738 -7.414 1.00 15.41 C ATOM 778 CD1 ILE A 82 37.785 39.874 -8.382 1.00 14.45 C ATOM 779 H ILE A 82 39.621 44.600 -8.451 1.00 0.00 H ATOM 780 N THR A 83 36.025 43.518 -10.572 1.00 17.63 N ATOM 781 CA THR A 83 34.638 43.953 -10.660 1.00 15.20 C ATOM 782 C THR A 83 33.779 43.072 -9.764 1.00 18.11 C ATOM 783 O THR A 83 33.821 41.842 -9.872 1.00 19.59 O ATOM 784 CB THR A 83 34.132 43.894 -12.103 1.00 19.74 C ATOM 785 OG1 THR A 83 34.874 44.818 -12.910 1.00 22.20 O ATOM 786 CG2 THR A 83 32.653 44.248 -12.167 1.00 12.26 C ATOM 787 HG1 THR A 83 34.545 44.778 -13.843 1.00 0.00 H ATOM 788 H THR A 83 36.328 42.699 -11.137 1.00 0.00 H ATOM 789 N ASN A 84 33.010 43.702 -8.879 1.00 18.21 N ATOM 790 CA ASN A 84 32.150 42.957 -7.970 1.00 17.83 C ATOM 791 C ASN A 84 31.069 42.214 -8.742 1.00 17.99 C ATOM 792 O ASN A 84 30.346 42.804 -9.550 1.00 20.77 O ATOM 793 CB ASN A 84 31.508 43.902 -6.953 1.00 17.30 C ATOM 794 CG ASN A 84 32.528 44.603 -6.079 1.00 18.23 C ATOM 795 OD1 ASN A 84 33.534 44.016 -5.682 1.00 21.54 O ATOM 796 ND2 ASN A 84 32.269 45.868 -5.771 1.00 19.74 N ATOM 797 HD22 ASN A 84 31.406 46.324 -6.129 1.00 0.00 H ATOM 798 HD21 ASN A 84 32.929 46.403 -5.172 1.00 0.00 H ATOM 799 H ASN A 84 33.023 44.741 -8.836 1.00 0.00 H ATOM 800 N VAL A 85 30.964 40.913 -8.495 1.00 15.91 N ATOM 801 CA VAL A 85 29.892 40.081 -9.026 1.00 16.40 C ATOM 802 C VAL A 85 29.026 39.646 -7.846 1.00 16.44 C ATOM 803 O VAL A 85 29.478 38.851 -7.009 1.00 18.12 O ATOM 804 CB VAL A 85 30.437 38.872 -9.798 1.00 19.13 C ATOM 805 CG1 VAL A 85 29.293 37.976 -10.253 1.00 15.51 C ATOM 806 CG2 VAL A 85 31.263 39.332 -10.990 1.00 11.82 C ATOM 807 H VAL A 85 31.683 40.465 -7.892 1.00 0.00 H ATOM 808 N PRO A 86 27.798 40.142 -7.725 1.00 15.46 N ATOM 809 CA PRO A 86 26.965 39.806 -6.563 1.00 16.28 C ATOM 810 C PRO A 86 26.538 38.350 -6.595 1.00 19.38 C ATOM 811 O PRO A 86 26.486 37.730 -7.669 1.00 17.84 O ATOM 812 CB PRO A 86 25.760 40.747 -6.709 1.00 17.98 C ATOM 813 CG PRO A 86 25.700 41.053 -8.166 1.00 16.04 C ATOM 814 CD PRO A 86 27.125 41.082 -8.638 1.00 16.29 C ATOM 815 N PRO A 87 26.227 37.767 -5.441 1.00 18.03 N ATOM 816 CA PRO A 87 25.919 36.338 -5.379 1.00 17.78 C ATOM 817 C PRO A 87 24.441 36.020 -5.565 1.00 18.12 C ATOM 818 O PRO A 87 23.554 36.840 -5.321 1.00 16.91 O ATOM 819 CB PRO A 87 26.362 35.962 -3.960 1.00 17.70 C ATOM 820 CG PRO A 87 26.083 37.194 -3.170 1.00 13.81 C ATOM 821 CD PRO A 87 26.351 38.361 -4.097 1.00 14.98 C ATOM 822 N GLU A 88 24.199 34.788 -6.007 1.00 21.38 N ATOM 823 CA GLU A 88 22.884 34.173 -5.927 1.00 21.69 C ATOM 824 C GLU A 88 22.792 33.391 -4.624 1.00 22.33 C ATOM 825 O GLU A 88 23.733 32.690 -4.242 1.00 24.35 O ATOM 826 CB GLU A 88 22.637 33.244 -7.116 1.00 22.59 C ATOM 827 CG GLU A 88 22.641 33.935 -8.469 1.00 36.15 C ATOM 828 CD GLU A 88 22.592 32.951 -9.623 1.00 48.57 C ATOM 829 OE1 GLU A 88 22.104 31.819 -9.421 1.00 42.56 O ATOM 830 OE2 GLU A 88 23.044 33.309 -10.731 1.00 52.22 O ATOM 831 H GLU A 88 24.981 34.244 -6.426 1.00 0.00 H ATOM 832 N VAL A 89 21.660 33.520 -3.938 1.00 16.37 N ATOM 833 CA VAL A 89 21.472 32.932 -2.618 1.00 15.52 C ATOM 834 C VAL A 89 20.259 32.015 -2.658 1.00 19.00 C ATOM 835 O VAL A 89 19.190 32.410 -3.138 1.00 17.30 O ATOM 836 CB VAL A 89 21.308 34.013 -1.534 1.00 18.20 C ATOM 837 CG1 VAL A 89 21.002 33.377 -0.188 1.00 17.95 C ATOM 838 CG2 VAL A 89 22.563 34.866 -1.447 1.00 17.78 C ATOM 839 H VAL A 89 20.879 34.061 -4.360 1.00 0.00 H ATOM 840 N THR A 90 20.428 30.794 -2.154 1.00 19.40 N ATOM 841 CA THR A 90 19.352 29.821 -2.048 1.00 17.49 C ATOM 842 C THR A 90 19.335 29.249 -0.638 1.00 17.53 C ATOM 843 O THR A 90 20.387 28.918 -0.083 1.00 18.16 O ATOM 844 CB THR A 90 19.514 28.687 -3.071 1.00 16.24 C ATOM 845 OG1 THR A 90 19.587 29.237 -4.392 1.00 19.63 O ATOM 846 CG2 THR A 90 18.338 27.724 -2.996 1.00 16.18 C ATOM 847 HG1 THR A 90 20.364 29.848 -4.452 1.00 0.00 H ATOM 848 H THR A 90 21.375 30.523 -1.820 1.00 0.00 H ATOM 849 N VAL A 91 18.142 29.146 -0.060 1.00 18.64 N ATOM 850 CA VAL A 91 17.941 28.541 1.252 1.00 22.70 C ATOM 851 C VAL A 91 17.144 27.259 1.067 1.00 21.00 C ATOM 852 O VAL A 91 16.134 27.246 0.353 1.00 25.78 O ATOM 853 CB VAL A 91 17.225 29.500 2.220 1.00 19.79 C ATOM 854 CG1 VAL A 91 16.890 28.789 3.522 1.00 21.74 C ATOM 855 CG2 VAL A 91 18.091 30.708 2.494 1.00 18.25 C ATOM 856 H VAL A 91 17.312 29.514 -0.568 1.00 0.00 H ATOM 857 N LEU A 92 17.599 26.184 1.704 1.00 19.36 N ATOM 858 CA LEU A 92 16.932 24.895 1.596 1.00 20.59 C ATOM 859 C LEU A 92 17.306 24.053 2.807 1.00 20.60 C ATOM 860 O LEU A 92 18.219 24.388 3.565 1.00 23.83 O ATOM 861 CB LEU A 92 17.299 24.179 0.292 1.00 21.85 C ATOM 862 CG LEU A 92 18.711 23.608 0.148 1.00 22.44 C ATOM 863 CD1 LEU A 92 18.718 22.579 -0.959 1.00 28.31 C ATOM 864 CD2 LEU A 92 19.742 24.695 -0.136 1.00 22.91 C ATOM 865 H LEU A 92 18.452 26.266 2.293 1.00 0.00 H ATOM 866 N THR A 93 16.584 22.950 2.978 1.00 20.74 N ATOM 867 CA THR A 93 16.795 22.045 4.096 1.00 27.16 C ATOM 868 C THR A 93 17.499 20.779 3.625 1.00 22.14 C ATOM 869 O THR A 93 17.398 20.385 2.459 1.00 20.59 O ATOM 870 CB THR A 93 15.471 21.682 4.777 1.00 22.48 C ATOM 871 OG1 THR A 93 14.659 20.916 3.879 1.00 26.25 O ATOM 872 CG2 THR A 93 14.721 22.944 5.182 1.00 21.65 C ATOM 873 HG1 THR A 93 15.138 20.086 3.629 1.00 0.00 H ATOM 874 H THR A 93 15.840 22.726 2.286 1.00 0.00 H ATOM 875 N ASN A 94 18.219 20.144 4.554 1.00 30.22 N ATOM 876 CA ASN A 94 18.978 18.944 4.221 1.00 20.09 C ATOM 877 C ASN A 94 18.067 17.765 3.904 1.00 26.44 C ATOM 878 O ASN A 94 18.437 16.896 3.106 1.00 23.03 O ATOM 879 CB ASN A 94 19.920 18.594 5.374 1.00 20.26 C ATOM 880 CG ASN A 94 20.769 17.371 5.086 1.00 31.69 C ATOM 881 OD1 ASN A 94 20.328 16.236 5.270 1.00 42.47 O ATOM 882 ND2 ASN A 94 21.998 17.597 4.637 1.00 35.96 N ATOM 883 HD22 ASN A 94 22.329 18.573 4.496 1.00 0.00 H ATOM 884 HD21 ASN A 94 22.630 16.798 4.426 1.00 0.00 H ATOM 885 H ASN A 94 18.239 20.510 5.527 1.00 0.00 H ATOM 886 N SER A 95 16.884 17.718 4.504 1.00 25.64 N ATOM 887 CA SER A 95 15.972 16.595 4.350 1.00 28.32 C ATOM 888 C SER A 95 14.548 17.126 4.392 1.00 29.46 C ATOM 889 O SER A 95 14.323 18.270 4.806 1.00 26.23 O ATOM 890 CB SER A 95 16.194 15.548 5.450 1.00 34.58 C ATOM 891 OG SER A 95 15.997 16.109 6.736 1.00 37.64 O ATOM 892 HG SER A 95 16.637 16.852 6.872 1.00 0.00 H ATOM 893 H SER A 95 16.598 18.515 5.108 1.00 0.00 H ATOM 894 N PRO A 96 13.568 16.334 3.947 1.00 28.53 N ATOM 895 CA PRO A 96 12.169 16.769 4.052 1.00 28.34 C ATOM 896 C PRO A 96 11.804 17.133 5.484 1.00 29.27 C ATOM 897 O PRO A 96 12.241 16.491 6.442 1.00 31.69 O ATOM 898 CB PRO A 96 11.382 15.551 3.560 1.00 31.85 C ATOM 899 CG PRO A 96 12.308 14.880 2.617 1.00 25.88 C ATOM 900 CD PRO A 96 13.693 15.085 3.175 1.00 30.00 C ATOM 901 N VAL A 97 10.991 18.173 5.618 1.00 32.63 N ATOM 902 CA VAL A 97 10.726 18.797 6.907 1.00 32.37 C ATOM 903 C VAL A 97 9.566 18.087 7.592 1.00 36.93 C ATOM 904 O VAL A 97 8.490 17.918 7.006 1.00 37.61 O ATOM 905 CB VAL A 97 10.431 20.295 6.736 1.00 29.71 C ATOM 906 CG1 VAL A 97 10.321 20.966 8.087 1.00 31.64 C ATOM 907 CG2 VAL A 97 11.514 20.954 5.895 1.00 24.73 C ATOM 908 H VAL A 97 10.526 18.557 4.771 1.00 0.00 H ATOM 909 N GLU A 98 9.790 17.668 8.836 1.00 37.76 N ATOM 910 CA GLU A 98 8.756 17.114 9.698 1.00 36.45 C ATOM 911 C GLU A 98 8.787 17.866 11.019 1.00 38.74 C ATOM 912 O GLU A 98 9.863 18.203 11.521 1.00 33.01 O ATOM 913 CB GLU A 98 8.964 15.612 9.938 1.00 36.68 C ATOM 914 CG GLU A 98 9.375 14.823 8.701 1.00 47.18 C ATOM 915 CD GLU A 98 8.210 14.116 8.034 1.00 57.35 C ATOM 916 OE1 GLU A 98 8.396 13.591 6.915 1.00 59.63 O ATOM 917 OE2 GLU A 98 7.111 14.081 8.627 1.00 61.97 O ATOM 918 H GLU A 98 10.757 17.741 9.212 1.00 0.00 H ATOM 919 N LEU A 99 7.607 18.132 11.578 1.00 38.40 N ATOM 920 CA LEU A 99 7.519 18.942 12.787 1.00 35.84 C ATOM 921 C LEU A 99 8.252 18.277 13.946 1.00 34.78 C ATOM 922 O LEU A 99 8.038 17.097 14.241 1.00 39.29 O ATOM 923 CB LEU A 99 6.055 19.187 13.156 1.00 31.93 C ATOM 924 CG LEU A 99 5.285 20.154 12.253 1.00 39.73 C ATOM 925 CD1 LEU A 99 3.869 20.361 12.767 1.00 37.88 C ATOM 926 CD2 LEU A 99 6.017 21.484 12.141 1.00 38.00 C ATOM 927 H LEU A 99 6.738 17.757 11.147 1.00 0.00 H ATOM 928 N ARG A 100 9.132 19.045 14.591 1.00 34.25 N ATOM 929 CA ARG A 100 9.906 18.619 15.757 1.00 40.04 C ATOM 930 C ARG A 100 10.836 17.446 15.455 1.00 37.40 C ATOM 931 O ARG A 100 11.290 16.760 16.376 1.00 38.76 O ATOM 932 CB ARG A 100 8.993 18.280 16.940 1.00 43.81 C ATOM 933 CG ARG A 100 8.209 19.467 17.472 1.00 46.46 C ATOM 934 CD ARG A 100 7.175 19.019 18.485 1.00 53.22 C ATOM 935 NE ARG A 100 6.461 17.835 18.019 1.00 54.15 N ATOM 936 CZ ARG A 100 5.470 17.861 17.135 1.00 47.57 C ATOM 937 NH1 ARG A 100 5.072 19.015 16.617 1.00 41.56 N ATOM 938 NH2 ARG A 100 4.880 16.732 16.765 1.00 50.93 N ATOM 939 HE ARG A 100 6.746 16.912 18.404 1.00 0.00 H ATOM 940 HH12 ARG A 100 4.296 19.034 15.925 1.00 0.00 H ATOM 941 HH11 ARG A 100 5.536 19.901 16.903 1.00 0.00 H ATOM 942 HH22 ARG A 100 4.104 16.753 16.073 1.00 0.00 H ATOM 943 HH21 ARG A 100 5.193 15.826 17.167 1.00 0.00 H ATOM 944 H ARG A 100 9.278 20.013 14.241 1.00 0.00 H ATOM 945 N GLU A 101 11.133 17.199 14.180 1.00 42.35 N ATOM 946 CA GLU A 101 12.173 16.252 13.808 1.00 38.58 C ATOM 947 C GLU A 101 13.392 17.028 13.342 1.00 36.00 C ATOM 948 O GLU A 101 13.274 17.834 12.407 1.00 30.31 O ATOM 949 CB GLU A 101 11.689 15.312 12.710 1.00 32.92 C ATOM 950 CG GLU A 101 10.916 14.110 13.230 1.00 45.74 C ATOM 951 CD GLU A 101 10.330 13.263 12.118 1.00 66.36 C ATOM 952 OE1 GLU A 101 10.948 13.189 11.035 1.00 69.35 O ATOM 953 OE2 GLU A 101 9.251 12.669 12.328 1.00 67.32 O ATOM 954 H GLU A 101 10.608 17.696 13.432 1.00 0.00 H ATOM 955 N PRO A 102 14.565 16.821 13.945 1.00 33.42 N ATOM 956 CA PRO A 102 15.710 17.699 13.665 1.00 32.43 C ATOM 957 C PRO A 102 16.051 17.751 12.183 1.00 28.85 C ATOM 958 O PRO A 102 15.874 16.782 11.443 1.00 28.42 O ATOM 959 CB PRO A 102 16.847 17.067 14.477 1.00 32.97 C ATOM 960 CG PRO A 102 16.159 16.284 15.548 1.00 30.48 C ATOM 961 CD PRO A 102 14.895 15.773 14.924 1.00 28.84 C ATOM 962 N ASN A 103 16.539 18.914 11.756 1.00 26.13 N ATOM 963 CA ASN A 103 16.869 19.154 10.360 1.00 22.52 C ATOM 964 C ASN A 103 17.992 20.182 10.304 1.00 21.33 C ATOM 965 O ASN A 103 18.469 20.666 11.335 1.00 20.72 O ATOM 966 CB ASN A 103 15.634 19.615 9.580 1.00 20.92 C ATOM 967 CG ASN A 103 15.675 19.200 8.123 1.00 27.95 C ATOM 968 OD1 ASN A 103 16.736 19.179 7.500 1.00 28.41 O ATOM 969 ND2 ASN A 103 14.514 18.863 7.572 1.00 26.17 N ATOM 970 HD22 ASN A 103 13.641 18.896 8.137 1.00 0.00 H ATOM 971 HD21 ASN A 103 14.478 18.567 6.576 1.00 0.00 H ATOM 972 H ASN A 103 16.690 19.678 12.445 1.00 0.00 H ATOM 973 N VAL A 104 18.419 20.512 9.087 1.00 19.96 N ATOM 974 CA VAL A 104 19.500 21.464 8.860 1.00 22.04 C ATOM 975 C VAL A 104 19.063 22.447 7.784 1.00 20.62 C ATOM 976 O VAL A 104 18.596 22.037 6.717 1.00 19.34 O ATOM 977 CB VAL A 104 20.808 20.762 8.442 1.00 21.74 C ATOM 978 CG1 VAL A 104 21.894 21.788 8.155 1.00 15.46 C ATOM 979 CG2 VAL A 104 21.265 19.787 9.517 1.00 13.19 C ATOM 980 H VAL A 104 17.962 20.072 8.263 1.00 0.00 H ATOM 981 N LEU A 105 19.213 23.739 8.066 1.00 22.83 N ATOM 982 CA LEU A 105 19.011 24.776 7.064 1.00 20.02 C ATOM 983 C LEU A 105 20.314 25.014 6.316 1.00 19.03 C ATOM 984 O LEU A 105 21.369 25.188 6.934 1.00 22.88 O ATOM 985 CB LEU A 105 18.529 26.075 7.708 1.00 22.28 C ATOM 986 CG LEU A 105 17.029 26.197 7.967 1.00 23.56 C ATOM 987 CD1 LEU A 105 16.754 27.474 8.716 1.00 25.30 C ATOM 988 CD2 LEU A 105 16.256 26.171 6.660 1.00 20.80 C ATOM 989 H LEU A 105 19.483 24.016 9.031 1.00 0.00 H ATOM 990 N ILE A 106 20.237 25.020 4.988 1.00 18.09 N ATOM 991 CA ILE A 106 21.399 25.203 4.127 1.00 17.97 C ATOM 992 C ILE A 106 21.224 26.501 3.355 1.00 19.98 C ATOM 993 O ILE A 106 20.204 26.697 2.684 1.00 21.99 O ATOM 994 CB ILE A 106 21.583 24.018 3.163 1.00 16.92 C ATOM 995 CG1 ILE A 106 21.640 22.701 3.939 1.00 19.41 C ATOM 996 CG2 ILE A 106 22.839 24.205 2.327 1.00 15.79 C ATOM 997 CD1 ILE A 106 21.683 21.475 3.054 1.00 17.06 C ATOM 998 H ILE A 106 19.306 24.888 4.544 1.00 0.00 H ATOM 999 N CYS A 107 22.214 27.383 3.451 1.00 14.84 N ATOM 1000 CA CYS A 107 22.235 28.634 2.701 1.00 15.14 C ATOM 1001 C CYS A 107 23.350 28.545 1.668 1.00 17.90 C ATOM 1002 O CYS A 107 24.535 28.577 2.020 1.00 14.69 O ATOM 1003 CB CYS A 107 22.433 29.832 3.626 1.00 14.15 C ATOM 1004 SG CYS A 107 22.395 31.427 2.780 1.00 25.10 S ATOM 1005 H CYS A 107 23.008 27.172 4.089 1.00 0.00 H ATOM 1006 N PHE A 108 22.971 28.431 0.399 1.00 20.24 N ATOM 1007 CA PHE A 108 23.921 28.278 -0.694 1.00 17.81 C ATOM 1008 C PHE A 108 24.162 29.634 -1.346 1.00 17.76 C ATOM 1009 O PHE A 108 23.242 30.226 -1.921 1.00 18.31 O ATOM 1010 CB PHE A 108 23.414 27.265 -1.720 1.00 18.97 C ATOM 1011 CG PHE A 108 24.379 27.005 -2.841 1.00 20.27 C ATOM 1012 CD1 PHE A 108 25.730 26.833 -2.583 1.00 15.41 C ATOM 1013 CD2 PHE A 108 23.936 26.920 -4.151 1.00 19.53 C ATOM 1014 CE1 PHE A 108 26.621 26.590 -3.611 1.00 16.79 C ATOM 1015 CE2 PHE A 108 24.823 26.676 -5.183 1.00 23.43 C ATOM 1016 CZ PHE A 108 26.168 26.511 -4.912 1.00 20.15 C ATOM 1017 H PHE A 108 21.955 28.452 0.178 1.00 0.00 H ATOM 1018 N ILE A 109 25.396 30.118 -1.249 1.00 17.80 N ATOM 1019 CA ILE A 109 25.813 31.389 -1.828 1.00 16.85 C ATOM 1020 C ILE A 109 26.689 31.067 -3.029 1.00 18.10 C ATOM 1021 O ILE A 109 27.691 30.353 -2.897 1.00 16.62 O ATOM 1022 CB ILE A 109 26.560 32.247 -0.797 1.00 17.62 C ATOM 1023 CG1 ILE A 109 25.788 32.247 0.521 1.00 16.67 C ATOM 1024 CG2 ILE A 109 26.737 33.664 -1.302 1.00 13.84 C ATOM 1025 CD1 ILE A 109 26.616 32.644 1.702 1.00 17.98 C ATOM 1026 H ILE A 109 26.104 29.559 -0.731 1.00 0.00 H ATOM 1027 N ASP A 110 26.318 31.584 -4.199 1.00 14.34 N ATOM 1028 CA ASP A 110 26.874 31.081 -5.446 1.00 18.71 C ATOM 1029 C ASP A 110 27.141 32.216 -6.425 1.00 17.92 C ATOM 1030 O ASP A 110 26.461 33.246 -6.413 1.00 13.09 O ATOM 1031 CB ASP A 110 25.926 30.051 -6.078 1.00 17.37 C ATOM 1032 CG ASP A 110 26.596 29.218 -7.147 1.00 20.82 C ATOM 1033 OD1 ASP A 110 27.843 29.224 -7.214 1.00 22.00 O ATOM 1034 OD2 ASP A 110 25.874 28.550 -7.917 1.00 28.61 O ATOM 1035 H ASP A 110 25.622 32.357 -4.222 1.00 0.00 H ATOM 1036 N LYS A 111 28.151 32.005 -7.273 1.00 16.33 N ATOM 1037 CA LYS A 111 28.466 32.873 -8.410 1.00 18.36 C ATOM 1038 C LYS A 111 28.764 34.306 -7.961 1.00 17.88 C ATOM 1039 O LYS A 111 28.064 35.256 -8.319 1.00 23.30 O ATOM 1040 CB LYS A 111 27.334 32.852 -9.446 1.00 21.39 C ATOM 1041 CG LYS A 111 26.863 31.463 -9.850 1.00 23.82 C ATOM 1042 CD LYS A 111 26.080 31.512 -11.155 1.00 30.60 C ATOM 1043 CE LYS A 111 25.483 30.157 -11.508 1.00 35.23 C ATOM 1044 NZ LYS A 111 24.245 29.873 -10.731 1.00 39.62 N ATOM 1045 HZ1 LYS A 111 24.467 29.876 -9.715 1.00 0.00 H ATOM 1046 HZ2 LYS A 111 23.534 30.604 -10.934 1.00 0.00 H ATOM 1047 HZ3 LYS A 111 23.873 28.941 -11.003 1.00 0.00 H ATOM 1048 H LYS A 111 28.752 31.171 -7.116 1.00 0.00 H ATOM 1049 N PHE A 112 29.833 34.454 -7.181 1.00 14.13 N ATOM 1050 CA PHE A 112 30.190 35.773 -6.681 1.00 16.38 C ATOM 1051 C PHE A 112 31.702 35.919 -6.589 1.00 18.97 C ATOM 1052 O PHE A 112 32.445 34.936 -6.521 1.00 16.39 O ATOM 1053 CB PHE A 112 29.551 36.054 -5.315 1.00 15.06 C ATOM 1054 CG PHE A 112 30.062 35.179 -4.207 1.00 15.91 C ATOM 1055 CD1 PHE A 112 31.049 35.633 -3.347 1.00 15.71 C ATOM 1056 CD2 PHE A 112 29.548 33.908 -4.015 1.00 12.55 C ATOM 1057 CE1 PHE A 112 31.519 34.834 -2.324 1.00 11.15 C ATOM 1058 CE2 PHE A 112 30.014 33.103 -2.993 1.00 12.44 C ATOM 1059 CZ PHE A 112 31.000 33.567 -2.147 1.00 11.92 C ATOM 1060 H PHE A 112 30.412 33.628 -6.929 1.00 0.00 H ATOM 1061 N THR A 113 32.137 37.175 -6.587 1.00 15.58 N ATOM 1062 CA THR A 113 33.535 37.550 -6.417 1.00 14.32 C ATOM 1063 C THR A 113 33.559 39.051 -6.113 1.00 15.74 C ATOM 1064 O THR A 113 32.675 39.784 -6.561 1.00 14.70 O ATOM 1065 CB THR A 113 34.383 37.215 -7.672 1.00 14.72 C ATOM 1066 OG1 THR A 113 35.768 37.136 -7.316 1.00 19.37 O ATOM 1067 CG2 THR A 113 34.205 38.268 -8.757 1.00 19.25 C ATOM 1068 HG1 THR A 113 36.303 36.922 -8.121 1.00 0.00 H ATOM 1069 H THR A 113 31.439 37.935 -6.714 1.00 0.00 H ATOM 1070 N PRO A 114 34.541 39.520 -5.322 1.00 19.74 N ATOM 1071 CA PRO A 114 35.645 38.815 -4.658 1.00 17.68 C ATOM 1072 C PRO A 114 35.176 37.899 -3.526 1.00 19.16 C ATOM 1073 O PRO A 114 34.038 38.029 -3.074 1.00 20.89 O ATOM 1074 CB PRO A 114 36.505 39.960 -4.112 1.00 11.59 C ATOM 1075 CG PRO A 114 35.546 41.064 -3.893 1.00 18.54 C ATOM 1076 CD PRO A 114 34.563 40.962 -5.022 1.00 15.15 C ATOM 1077 N PRO A 115 36.040 36.980 -3.082 1.00 14.59 N ATOM 1078 CA PRO A 115 35.645 36.060 -2.006 1.00 15.56 C ATOM 1079 C PRO A 115 35.599 36.725 -0.638 1.00 18.61 C ATOM 1080 O PRO A 115 36.351 36.353 0.268 1.00 20.83 O ATOM 1081 CB PRO A 115 36.725 34.973 -2.066 1.00 14.52 C ATOM 1082 CG PRO A 115 37.911 35.670 -2.632 1.00 13.72 C ATOM 1083 CD PRO A 115 37.377 36.665 -3.615 1.00 11.51 C ATOM 1084 N VAL A 116 34.729 37.722 -0.486 1.00 18.70 N ATOM 1085 CA VAL A 116 34.429 38.337 0.801 1.00 19.01 C ATOM 1086 C VAL A 116 32.916 38.428 0.921 1.00 20.92 C ATOM 1087 O VAL A 116 32.247 38.906 -0.002 1.00 20.83 O ATOM 1088 CB VAL A 116 35.058 39.736 0.951 1.00 24.89 C ATOM 1089 CG1 VAL A 116 34.981 40.197 2.400 1.00 19.63 C ATOM 1090 CG2 VAL A 116 36.490 39.740 0.468 1.00 21.34 C ATOM 1091 H VAL A 116 34.238 38.080 -1.330 1.00 0.00 H ATOM 1092 N VAL A 117 32.377 37.977 2.052 1.00 22.82 N ATOM 1093 CA VAL A 117 30.933 37.936 2.237 1.00 18.23 C ATOM 1094 C VAL A 117 30.641 37.982 3.729 1.00 20.48 C ATOM 1095 O VAL A 117 31.448 37.536 4.549 1.00 23.13 O ATOM 1096 CB VAL A 117 30.325 36.679 1.561 1.00 17.21 C ATOM 1097 CG1 VAL A 117 30.582 35.431 2.395 1.00 16.17 C ATOM 1098 CG2 VAL A 117 28.845 36.869 1.307 1.00 20.09 C ATOM 1099 H VAL A 117 32.999 37.648 2.818 1.00 0.00 H ATOM 1100 N ASN A 118 29.489 38.548 4.080 1.00 25.21 N ATOM 1101 CA ASN A 118 28.991 38.565 5.450 1.00 21.92 C ATOM 1102 C ASN A 118 27.635 37.877 5.472 1.00 24.03 C ATOM 1103 O ASN A 118 26.683 38.352 4.843 1.00 20.55 O ATOM 1104 CB ASN A 118 28.883 39.992 5.991 1.00 22.28 C ATOM 1105 CG ASN A 118 30.208 40.524 6.492 1.00 32.60 C ATOM 1106 OD1 ASN A 118 31.092 39.759 6.877 1.00 30.68 O ATOM 1107 ND2 ASN A 118 30.352 41.844 6.496 1.00 35.33 N ATOM 1108 HD22 ASN A 118 29.578 42.453 6.161 1.00 0.00 H ATOM 1109 HD21 ASN A 118 31.239 42.269 6.834 1.00 0.00 H ATOM 1110 H ASN A 118 28.915 39.001 3.340 1.00 0.00 H ATOM 1111 N VAL A 119 27.554 36.763 6.189 1.00 24.46 N ATOM 1112 CA VAL A 119 26.364 35.926 6.221 1.00 21.41 C ATOM 1113 C VAL A 119 25.821 35.909 7.639 1.00 22.17 C ATOM 1114 O VAL A 119 26.580 35.778 8.606 1.00 25.97 O ATOM 1115 CB VAL A 119 26.668 34.496 5.735 1.00 18.71 C ATOM 1116 CG1 VAL A 119 25.379 33.728 5.483 1.00 17.48 C ATOM 1117 CG2 VAL A 119 27.531 34.546 4.490 1.00 13.25 C ATOM 1118 H VAL A 119 28.379 36.475 6.754 1.00 0.00 H ATOM 1119 N THR A 120 24.506 36.048 7.758 1.00 24.17 N ATOM 1120 CA THR A 120 23.845 36.023 9.051 1.00 21.68 C ATOM 1121 C THR A 120 22.586 35.187 8.941 1.00 24.13 C ATOM 1122 O THR A 120 21.760 35.412 8.050 1.00 21.97 O ATOM 1123 CB THR A 120 23.488 37.432 9.536 1.00 17.76 C ATOM 1124 OG1 THR A 120 24.678 38.226 9.623 1.00 27.24 O ATOM 1125 CG2 THR A 120 22.822 37.369 10.903 1.00 21.31 C ATOM 1126 HG1 THR A 120 25.102 38.282 8.730 1.00 0.00 H ATOM 1127 H THR A 120 23.933 36.179 6.900 1.00 0.00 H ATOM 1128 N TRP A 121 22.457 34.220 9.839 1.00 25.90 N ATOM 1129 CA TRP A 121 21.208 33.496 9.988 1.00 22.82 C ATOM 1130 C TRP A 121 20.278 34.278 10.910 1.00 22.20 C ATOM 1131 O TRP A 121 20.693 34.746 11.976 1.00 21.84 O ATOM 1132 CB TRP A 121 21.458 32.107 10.559 1.00 19.74 C ATOM 1133 CG TRP A 121 21.975 31.092 9.619 1.00 19.74 C ATOM 1134 CD1 TRP A 121 23.222 30.546 9.612 1.00 16.24 C ATOM 1135 CD2 TRP A 121 21.245 30.450 8.575 1.00 15.97 C ATOM 1136 NE1 TRP A 121 23.323 29.617 8.609 1.00 19.52 N ATOM 1137 CE2 TRP A 121 22.120 29.539 7.956 1.00 20.39 C ATOM 1138 CE3 TRP A 121 19.937 30.567 8.093 1.00 19.20 C ATOM 1139 CZ2 TRP A 121 21.732 28.748 6.880 1.00 17.35 C ATOM 1140 CZ3 TRP A 121 19.551 29.779 7.021 1.00 18.27 C ATOM 1141 CH2 TRP A 121 20.447 28.882 6.426 1.00 24.81 C ATOM 1142 HE1 TRP A 121 24.173 29.062 8.381 1.00 0.00 H ATOM 1143 H TRP A 121 23.265 33.976 10.447 1.00 0.00 H ATOM 1144 N LEU A 122 19.020 34.414 10.505 1.00 21.75 N ATOM 1145 CA LEU A 122 18.016 35.127 11.281 1.00 21.56 C ATOM 1146 C LEU A 122 16.834 34.208 11.541 1.00 28.88 C ATOM 1147 O LEU A 122 16.329 33.569 10.613 1.00 26.75 O ATOM 1148 CB LEU A 122 17.542 36.386 10.549 1.00 19.03 C ATOM 1149 CG LEU A 122 18.569 37.463 10.200 1.00 19.71 C ATOM 1150 CD1 LEU A 122 17.947 38.495 9.269 1.00 20.45 C ATOM 1151 CD2 LEU A 122 19.095 38.125 11.460 1.00 21.88 C ATOM 1152 H LEU A 122 18.741 33.994 9.596 1.00 0.00 H ATOM 1153 N ARG A 123 16.396 34.141 12.795 1.00 27.95 N ATOM 1154 CA ARG A 123 15.169 33.444 13.161 1.00 27.85 C ATOM 1155 C ARG A 123 14.234 34.446 13.817 1.00 25.29 C ATOM 1156 O ARG A 123 14.573 35.031 14.852 1.00 27.78 O ATOM 1157 CB ARG A 123 15.446 32.267 14.096 1.00 28.63 C ATOM 1158 CG ARG A 123 14.302 31.265 14.163 1.00 38.41 C ATOM 1159 CD ARG A 123 13.479 31.417 15.421 1.00 40.88 C ATOM 1160 NE ARG A 123 14.320 31.391 16.608 1.00 38.50 N ATOM 1161 CZ ARG A 123 15.047 30.346 16.985 1.00 44.95 C ATOM 1162 NH1 ARG A 123 15.044 29.237 16.259 1.00 46.67 N ATOM 1163 NH2 ARG A 123 15.784 30.414 18.083 1.00 63.82 N ATOM 1164 HE ARG A 123 14.354 32.246 17.199 1.00 0.00 H ATOM 1165 HH12 ARG A 123 15.614 28.420 16.556 1.00 0.00 H ATOM 1166 HH11 ARG A 123 14.471 29.184 15.392 1.00 0.00 H ATOM 1167 HH22 ARG A 123 16.354 29.596 18.378 1.00 0.00 H ATOM 1168 HH21 ARG A 123 15.793 31.286 18.650 1.00 0.00 H ATOM 1169 H ARG A 123 16.950 34.604 13.543 1.00 0.00 H ATOM 1170 N ASN A 124 13.062 34.640 13.212 1.00 21.61 N ATOM 1171 CA ASN A 124 12.113 35.664 13.642 1.00 26.36 C ATOM 1172 C ASN A 124 12.779 37.038 13.670 1.00 26.18 C ATOM 1173 O ASN A 124 12.513 37.868 14.541 1.00 29.10 O ATOM 1174 CB ASN A 124 11.499 35.314 15.000 1.00 30.79 C ATOM 1175 CG ASN A 124 10.758 33.989 14.979 1.00 29.77 C ATOM 1176 OD1 ASN A 124 10.154 33.617 13.973 1.00 27.07 O ATOM 1177 ND2 ASN A 124 10.804 33.268 16.093 1.00 25.79 N ATOM 1178 HD22 ASN A 124 11.327 33.621 16.920 1.00 0.00 H ATOM 1179 HD21 ASN A 124 10.317 32.350 16.139 1.00 0.00 H ATOM 1180 H ASN A 124 12.813 34.038 12.401 1.00 0.00 H ATOM 1181 N GLY A 125 13.666 37.271 12.704 1.00 20.84 N ATOM 1182 CA GLY A 125 14.343 38.544 12.569 1.00 19.21 C ATOM 1183 C GLY A 125 15.489 38.783 13.524 1.00 20.35 C ATOM 1184 O GLY A 125 15.930 39.931 13.656 1.00 23.69 O ATOM 1185 H GLY A 125 13.879 36.514 12.024 1.00 0.00 H ATOM 1186 N LYS A 126 15.995 37.744 14.189 1.00 21.66 N ATOM 1187 CA LYS A 126 17.058 37.923 15.162 1.00 24.47 C ATOM 1188 C LYS A 126 18.279 37.088 14.794 1.00 21.49 C ATOM 1189 O LYS A 126 18.135 35.944 14.348 1.00 21.02 O ATOM 1190 CB LYS A 126 16.582 37.541 16.572 1.00 22.03 C ATOM 1191 CG LYS A 126 15.419 38.377 17.081 1.00 27.76 C ATOM 1192 CD LYS A 126 15.043 37.987 18.500 1.00 33.62 C ATOM 1193 CE LYS A 126 13.889 38.827 19.018 1.00 33.57 C ATOM 1194 NZ LYS A 126 13.546 38.480 20.424 1.00 41.33 N ATOM 1195 HZ1 LYS A 126 13.272 37.478 20.476 1.00 0.00 H ATOM 1196 HZ2 LYS A 126 14.373 38.647 21.032 1.00 0.00 H ATOM 1197 HZ3 LYS A 126 12.754 39.074 20.743 1.00 0.00 H ATOM 1198 H LYS A 126 15.622 36.790 14.008 1.00 0.00 H ATOM 1199 N PRO A 127 19.484 37.631 14.963 1.00 16.44 N ATOM 1200 CA PRO A 127 20.696 36.871 14.628 1.00 20.67 C ATOM 1201 C PRO A 127 20.814 35.617 15.479 1.00 22.70 C ATOM 1202 O PRO A 127 20.654 35.656 16.699 1.00 24.38 O ATOM 1203 CB PRO A 127 21.828 37.861 14.930 1.00 13.90 C ATOM 1204 CG PRO A 127 21.186 39.210 14.855 1.00 20.31 C ATOM 1205 CD PRO A 127 19.787 39.015 15.359 1.00 22.05 C ATOM 1206 N VAL A 128 21.095 34.493 14.828 1.00 22.39 N ATOM 1207 CA VAL A 128 21.291 33.227 15.520 1.00 30.08 C ATOM 1208 C VAL A 128 22.742 32.804 15.332 1.00 35.27 C ATOM 1209 O VAL A 128 23.289 32.897 14.227 1.00 42.80 O ATOM 1210 CB VAL A 128 20.299 32.150 15.040 1.00 19.89 C ATOM 1211 CG1 VAL A 128 18.879 32.687 15.110 1.00 29.07 C ATOM 1212 CG2 VAL A 128 20.633 31.640 13.659 1.00 36.03 C ATOM 1213 H VAL A 128 21.178 34.518 13.792 1.00 0.00 H ATOM 1214 N THR A 129 23.380 32.400 16.430 1.00 44.14 N ATOM 1215 CA THR A 129 24.760 31.939 16.409 1.00 45.56 C ATOM 1216 C THR A 129 24.911 30.494 16.859 1.00 43.69 C ATOM 1217 O THR A 129 25.901 29.850 16.496 1.00 49.13 O ATOM 1218 CB THR A 129 25.639 32.832 17.304 1.00 40.97 C ATOM 1219 OG1 THR A 129 25.259 34.202 17.141 1.00 40.73 O ATOM 1220 CG2 THR A 129 27.116 32.687 16.945 1.00 44.15 C ATOM 1221 HG1 THR A 129 25.827 34.772 17.718 1.00 0.00 H ATOM 1222 H THR A 129 22.872 32.415 17.337 1.00 0.00 H ATOM 1223 N THR A 130 23.950 29.969 17.615 1.00 44.44 N ATOM 1224 CA THR A 130 24.072 28.641 18.199 1.00 46.38 C ATOM 1225 C THR A 130 24.096 27.573 17.112 1.00 38.54 C ATOM 1226 O THR A 130 23.166 27.471 16.305 1.00 46.34 O ATOM 1227 CB THR A 130 22.918 28.387 19.166 1.00 50.12 C ATOM 1228 OG1 THR A 130 23.027 29.274 20.286 1.00 43.88 O ATOM 1229 CG2 THR A 130 22.949 26.948 19.659 1.00 42.31 C ATOM 1230 HG1 THR A 130 22.278 29.108 20.911 1.00 0.00 H ATOM 1231 H THR A 130 23.088 30.523 17.794 1.00 0.00 H ATOM 1232 N GLY A 131 25.166 26.783 17.093 1.00 37.92 N ATOM 1233 CA GLY A 131 25.240 25.603 16.261 1.00 29.21 C ATOM 1234 C GLY A 131 25.516 25.838 14.794 1.00 32.10 C ATOM 1235 O GLY A 131 25.514 24.872 14.023 1.00 34.31 O ATOM 1236 H GLY A 131 25.978 27.023 17.698 1.00 0.00 H ATOM 1237 N VAL A 132 25.761 27.075 14.379 1.00 29.57 N ATOM 1238 CA VAL A 132 25.976 27.359 12.965 1.00 30.40 C ATOM 1239 C VAL A 132 27.365 26.891 12.551 1.00 28.15 C ATOM 1240 O VAL A 132 28.298 26.826 13.361 1.00 34.79 O ATOM 1241 CB VAL A 132 25.776 28.858 12.667 1.00 27.39 C ATOM 1242 CG1 VAL A 132 24.385 29.302 13.091 1.00 26.22 C ATOM 1243 CG2 VAL A 132 26.846 29.690 13.355 1.00 21.27 C ATOM 1244 H VAL A 132 25.800 27.851 15.071 1.00 0.00 H ATOM 1245 N SER A 133 27.498 26.550 11.273 1.00 25.61 N ATOM 1246 CA SER A 133 28.780 26.182 10.693 1.00 24.90 C ATOM 1247 C SER A 133 28.793 26.642 9.243 1.00 28.76 C ATOM 1248 O SER A 133 27.763 27.024 8.683 1.00 24.23 O ATOM 1249 CB SER A 133 29.041 24.675 10.802 1.00 22.86 C ATOM 1250 OG SER A 133 28.034 23.931 10.139 1.00 24.43 O ATOM 1251 HG SER A 133 27.155 24.130 10.548 1.00 0.00 H ATOM 1252 H SER A 133 26.654 26.546 10.665 1.00 0.00 H ATOM 1253 N GLU A 134 29.975 26.600 8.635 1.00 24.45 N ATOM 1254 CA GLU A 134 30.138 27.109 7.283 1.00 21.06 C ATOM 1255 C GLU A 134 31.311 26.408 6.615 1.00 25.64 C ATOM 1256 O GLU A 134 32.071 25.673 7.250 1.00 27.66 O ATOM 1257 CB GLU A 134 30.352 28.626 7.285 1.00 22.17 C ATOM 1258 CG GLU A 134 31.710 29.049 7.822 1.00 22.80 C ATOM 1259 CD GLU A 134 31.781 30.530 8.129 1.00 24.41 C ATOM 1260 OE1 GLU A 134 30.867 31.042 8.809 1.00 23.95 O ATOM 1261 OE2 GLU A 134 32.748 31.184 7.687 1.00 38.89 O ATOM 1262 H GLU A 134 30.794 26.197 9.134 1.00 0.00 H ATOM 1263 N THR A 135 31.445 26.647 5.316 1.00 18.92 N ATOM 1264 CA THR A 135 32.574 26.178 4.529 1.00 21.78 C ATOM 1265 C THR A 135 33.457 27.359 4.150 1.00 20.06 C ATOM 1266 O THR A 135 33.079 28.524 4.294 1.00 17.41 O ATOM 1267 CB THR A 135 32.103 25.448 3.265 1.00 17.27 C ATOM 1268 OG1 THR A 135 31.388 26.361 2.422 1.00 17.89 O ATOM 1269 CG2 THR A 135 31.197 24.283 3.626 1.00 20.88 C ATOM 1270 HG1 THR A 135 31.984 27.110 2.168 1.00 0.00 H ATOM 1271 H THR A 135 30.704 27.198 4.837 1.00 0.00 H ATOM 1272 N VAL A 136 34.653 27.042 3.658 1.00 21.81 N ATOM 1273 CA VAL A 136 35.530 28.061 3.096 1.00 21.30 C ATOM 1274 C VAL A 136 35.001 28.419 1.715 1.00 21.32 C ATOM 1275 O VAL A 136 34.044 27.807 1.228 1.00 18.44 O ATOM 1276 CB VAL A 136 36.993 27.584 3.028 1.00 17.83 C ATOM 1277 CG1 VAL A 136 37.525 27.307 4.424 1.00 18.70 C ATOM 1278 CG2 VAL A 136 37.109 26.348 2.149 1.00 18.78 C ATOM 1279 H VAL A 136 34.966 26.051 3.675 1.00 0.00 H ATOM 1280 N PHE A 137 35.610 29.413 1.077 1.00 20.65 N ATOM 1281 CA PHE A 137 35.197 29.797 -0.265 1.00 20.92 C ATOM 1282 C PHE A 137 35.580 28.699 -1.250 1.00 20.57 C ATOM 1283 O PHE A 137 36.752 28.320 -1.345 1.00 24.70 O ATOM 1284 CB PHE A 137 35.831 31.129 -0.653 1.00 18.71 C ATOM 1285 CG PHE A 137 35.353 32.285 0.177 1.00 15.85 C ATOM 1286 CD1 PHE A 137 36.053 32.684 1.303 1.00 14.47 C ATOM 1287 CD2 PHE A 137 34.196 32.967 -0.163 1.00 14.23 C ATOM 1288 CE1 PHE A 137 35.613 33.745 2.071 1.00 14.56 C ATOM 1289 CE2 PHE A 137 33.751 34.030 0.601 1.00 20.81 C ATOM 1290 CZ PHE A 137 34.460 34.418 1.720 1.00 16.77 C ATOM 1291 H PHE A 137 36.389 29.922 1.541 1.00 0.00 H ATOM 1292 N LEU A 138 34.595 28.186 -1.969 1.00 19.19 N ATOM 1293 CA LEU A 138 34.837 27.076 -2.876 1.00 18.03 C ATOM 1294 C LEU A 138 34.919 27.567 -4.316 1.00 18.10 C ATOM 1295 O LEU A 138 34.203 28.499 -4.697 1.00 16.43 O ATOM 1296 CB LEU A 138 33.726 26.033 -2.751 1.00 17.15 C ATOM 1297 CG LEU A 138 33.436 25.567 -1.322 1.00 14.30 C ATOM 1298 CD1 LEU A 138 32.196 24.690 -1.281 1.00 23.53 C ATOM 1299 CD2 LEU A 138 34.635 24.833 -0.740 1.00 17.07 C ATOM 1300 H LEU A 138 33.637 28.581 -1.884 1.00 0.00 H ATOM 1301 N PRO A 139 35.777 26.963 -5.133 1.00 20.54 N ATOM 1302 CA PRO A 139 35.990 27.473 -6.489 1.00 16.87 C ATOM 1303 C PRO A 139 34.940 26.981 -7.472 1.00 20.38 C ATOM 1304 O PRO A 139 34.372 25.895 -7.333 1.00 25.06 O ATOM 1305 CB PRO A 139 37.373 26.921 -6.848 1.00 19.98 C ATOM 1306 CG PRO A 139 37.430 25.619 -6.114 1.00 16.45 C ATOM 1307 CD PRO A 139 36.662 25.824 -4.827 1.00 19.97 C ATOM 1308 N ARG A 140 34.694 27.809 -8.482 1.00 15.58 N ATOM 1309 CA ARG A 140 33.836 27.469 -9.606 1.00 18.79 C ATOM 1310 C ARG A 140 34.668 27.390 -10.879 1.00 17.24 C ATOM 1311 O ARG A 140 35.776 27.927 -10.959 1.00 20.95 O ATOM 1312 CB ARG A 140 32.714 28.498 -9.777 1.00 18.97 C ATOM 1313 CG ARG A 140 31.654 28.467 -8.691 1.00 15.20 C ATOM 1314 CD ARG A 140 30.698 29.639 -8.841 1.00 19.31 C ATOM 1315 NE ARG A 140 30.292 29.831 -10.230 1.00 19.22 N ATOM 1316 CZ ARG A 140 29.291 29.180 -10.813 1.00 23.12 C ATOM 1317 NH1 ARG A 140 28.588 28.289 -10.126 1.00 23.70 N ATOM 1318 NH2 ARG A 140 28.993 29.418 -12.082 1.00 21.39 N ATOM 1319 HE ARG A 140 30.820 30.522 -10.800 1.00 0.00 H ATOM 1320 HH12 ARG A 140 27.805 27.780 -10.583 1.00 0.00 H ATOM 1321 HH11 ARG A 140 28.820 28.099 -9.130 1.00 0.00 H ATOM 1322 HH22 ARG A 140 28.209 28.908 -12.537 1.00 0.00 H ATOM 1323 HH21 ARG A 140 29.543 30.115 -12.623 1.00 0.00 H ATOM 1324 H ARG A 140 35.138 28.749 -8.468 1.00 0.00 H ATOM 1325 N GLU A 141 34.118 26.710 -11.887 1.00 18.35 N ATOM 1326 CA GLU A 141 34.836 26.545 -13.144 1.00 14.61 C ATOM 1327 C GLU A 141 34.842 27.812 -13.989 1.00 13.33 C ATOM 1328 O GLU A 141 35.678 27.932 -14.892 1.00 12.85 O ATOM 1329 CB GLU A 141 34.249 25.376 -13.937 1.00 17.93 C ATOM 1330 CG GLU A 141 34.423 24.037 -13.233 1.00 32.83 C ATOM 1331 CD GLU A 141 33.893 22.869 -14.039 1.00 44.54 C ATOM 1332 OE1 GLU A 141 34.504 22.535 -15.076 1.00 45.16 O ATOM 1333 OE2 GLU A 141 32.866 22.285 -13.634 1.00 48.45 O ATOM 1334 H GLU A 141 33.171 26.295 -11.775 1.00 0.00 H ATOM 1335 N ASP A 142 33.939 28.755 -13.726 1.00 16.80 N ATOM 1336 CA ASP A 142 34.047 30.095 -14.287 1.00 14.59 C ATOM 1337 C ASP A 142 34.893 31.012 -13.414 1.00 15.54 C ATOM 1338 O ASP A 142 34.958 32.218 -13.679 1.00 12.07 O ATOM 1339 CB ASP A 142 32.657 30.704 -14.512 1.00 14.35 C ATOM 1340 CG ASP A 142 31.797 30.708 -13.258 1.00 20.93 C ATOM 1341 OD1 ASP A 142 32.341 30.576 -12.143 1.00 18.28 O ATOM 1342 OD2 ASP A 142 30.564 30.854 -13.393 1.00 29.50 O ATOM 1343 H ASP A 142 33.136 28.529 -13.104 1.00 0.00 H ATOM 1344 N HIS A 143 35.517 30.461 -12.371 1.00 13.70 N ATOM 1345 CA HIS A 143 36.481 31.143 -11.513 1.00 15.28 C ATOM 1346 C HIS A 143 35.842 32.215 -10.640 1.00 18.44 C ATOM 1347 O HIS A 143 36.525 33.140 -10.187 1.00 15.14 O ATOM 1348 CB HIS A 143 37.634 31.711 -12.345 1.00 10.60 C ATOM 1349 CG HIS A 143 38.126 30.754 -13.385 1.00 16.38 C ATOM 1350 ND1 HIS A 143 38.534 29.474 -13.077 1.00 11.32 N ATOM 1351 CD2 HIS A 143 38.235 30.871 -14.729 1.00 13.54 C ATOM 1352 CE1 HIS A 143 38.890 28.849 -14.185 1.00 13.45 C ATOM 1353 NE2 HIS A 143 38.720 29.675 -15.202 1.00 13.76 N ATOM 1354 H HIS A 143 35.299 29.468 -12.152 1.00 0.00 H ATOM 1355 N LEU A 144 34.539 32.100 -10.398 1.00 13.58 N ATOM 1356 CA LEU A 144 33.877 32.800 -9.308 1.00 15.54 C ATOM 1357 C LEU A 144 33.967 31.914 -8.063 1.00 18.16 C ATOM 1358 O LEU A 144 34.792 30.999 -8.004 1.00 17.88 O ATOM 1359 CB LEU A 144 32.438 33.147 -9.703 1.00 14.32 C ATOM 1360 CG LEU A 144 32.271 34.045 -10.930 1.00 18.42 C ATOM 1361 CD1 LEU A 144 30.809 34.138 -11.332 1.00 10.92 C ATOM 1362 CD2 LEU A 144 32.844 35.428 -10.663 1.00 15.34 C ATOM 1363 H LEU A 144 33.970 31.484 -11.013 1.00 0.00 H ATOM 1364 N PHE A 145 33.120 32.149 -7.064 1.00 18.42 N ATOM 1365 CA PHE A 145 33.197 31.389 -5.826 1.00 14.06 C ATOM 1366 C PHE A 145 31.806 30.968 -5.374 1.00 18.03 C ATOM 1367 O PHE A 145 30.790 31.522 -5.802 1.00 15.41 O ATOM 1368 CB PHE A 145 33.896 32.191 -4.720 1.00 13.17 C ATOM 1369 CG PHE A 145 35.319 32.548 -5.042 1.00 15.48 C ATOM 1370 CD1 PHE A 145 35.625 33.762 -5.637 1.00 18.17 C ATOM 1371 CD2 PHE A 145 36.350 31.668 -4.757 1.00 13.30 C ATOM 1372 CE1 PHE A 145 36.933 34.092 -5.938 1.00 13.81 C ATOM 1373 CE2 PHE A 145 37.661 31.993 -5.056 1.00 13.86 C ATOM 1374 CZ PHE A 145 37.952 33.207 -5.647 1.00 13.30 C ATOM 1375 H PHE A 145 32.393 32.886 -7.170 1.00 0.00 H ATOM 1376 N ARG A 146 31.781 29.964 -4.499 1.00 14.34 N ATOM 1377 CA ARG A 146 30.559 29.468 -3.886 1.00 15.06 C ATOM 1378 C ARG A 146 30.844 29.158 -2.423 1.00 14.12 C ATOM 1379 O ARG A 146 31.981 28.861 -2.049 1.00 20.48 O ATOM 1380 CB ARG A 146 30.025 28.222 -4.610 1.00 17.36 C ATOM 1381 CG ARG A 146 31.062 27.130 -4.795 1.00 21.13 C ATOM 1382 CD ARG A 146 30.600 26.054 -5.764 1.00 15.21 C ATOM 1383 NE ARG A 146 31.694 25.151 -6.113 1.00 33.78 N ATOM 1384 CZ ARG A 146 31.880 23.952 -5.570 1.00 33.38 C ATOM 1385 NH1 ARG A 146 31.037 23.499 -4.652 1.00 37.50 N ATOM 1386 NH2 ARG A 146 32.907 23.203 -5.949 1.00 33.37 N ATOM 1387 HE ARG A 146 32.373 25.467 -6.835 1.00 0.00 H ATOM 1388 HH12 ARG A 146 31.184 22.561 -4.228 1.00 0.00 H ATOM 1389 HH11 ARG A 146 30.228 24.082 -4.356 1.00 0.00 H ATOM 1390 HH22 ARG A 146 33.052 22.265 -5.524 1.00 0.00 H ATOM 1391 HH21 ARG A 146 33.568 23.554 -6.672 1.00 0.00 H ATOM 1392 H ARG A 146 32.681 29.512 -4.241 1.00 0.00 H ATOM 1393 N LYS A 147 29.802 29.235 -1.597 1.00 17.05 N ATOM 1394 CA LYS A 147 29.972 29.103 -0.157 1.00 13.46 C ATOM 1395 C LYS A 147 28.733 28.454 0.443 1.00 18.83 C ATOM 1396 O LYS A 147 27.631 28.564 -0.103 1.00 18.39 O ATOM 1397 CB LYS A 147 30.230 30.469 0.489 1.00 15.66 C ATOM 1398 CG LYS A 147 31.017 30.428 1.788 1.00 13.88 C ATOM 1399 CD LYS A 147 31.453 31.832 2.184 1.00 15.31 C ATOM 1400 CE LYS A 147 32.475 31.816 3.308 1.00 16.30 C ATOM 1401 NZ LYS A 147 31.872 31.431 4.611 1.00 23.82 N ATOM 1402 HZ1 LYS A 147 31.127 32.112 4.861 1.00 0.00 H ATOM 1403 HZ2 LYS A 147 31.461 30.479 4.534 1.00 0.00 H ATOM 1404 HZ3 LYS A 147 32.607 31.434 5.346 1.00 0.00 H ATOM 1405 H LYS A 147 28.851 29.392 -1.987 1.00 0.00 H ATOM 1406 N PHE A 148 28.925 27.777 1.575 1.00 17.10 N ATOM 1407 CA PHE A 148 27.848 27.097 2.280 1.00 15.08 C ATOM 1408 C PHE A 148 27.810 27.543 3.734 1.00 18.97 C ATOM 1409 O PHE A 148 28.854 27.674 4.380 1.00 18.93 O ATOM 1410 CB PHE A 148 28.009 25.574 2.225 1.00 16.23 C ATOM 1411 CG PHE A 148 27.768 24.983 0.868 1.00 14.42 C ATOM 1412 CD1 PHE A 148 28.806 24.848 -0.037 1.00 17.47 C ATOM 1413 CD2 PHE A 148 26.504 24.551 0.503 1.00 15.76 C ATOM 1414 CE1 PHE A 148 28.587 24.298 -1.286 1.00 19.34 C ATOM 1415 CE2 PHE A 148 26.279 24.001 -0.744 1.00 17.96 C ATOM 1416 CZ PHE A 148 27.322 23.874 -1.639 1.00 20.85 C ATOM 1417 H PHE A 148 29.885 27.733 1.972 1.00 0.00 H ATOM 1418 N HIS A 149 26.601 27.771 4.242 1.00 19.47 N ATOM 1419 CA HIS A 149 26.369 28.059 5.650 1.00 18.55 C ATOM 1420 C HIS A 149 25.247 27.164 6.153 1.00 17.35 C ATOM 1421 O HIS A 149 24.258 26.940 5.448 1.00 18.28 O ATOM 1422 CB HIS A 149 26.021 29.535 5.875 1.00 17.31 C ATOM 1423 CG HIS A 149 27.211 30.443 5.860 1.00 19.14 C ATOM 1424 ND1 HIS A 149 27.656 31.105 6.984 1.00 22.78 N ATOM 1425 CD2 HIS A 149 28.055 30.791 4.861 1.00 22.58 C ATOM 1426 CE1 HIS A 149 28.719 31.826 6.677 1.00 19.55 C ATOM 1427 NE2 HIS A 149 28.983 31.653 5.394 1.00 21.05 N ATOM 1428 H HIS A 149 25.782 27.742 3.602 1.00 0.00 H ATOM 1429 N TYR A 150 25.405 26.649 7.370 1.00 20.52 N ATOM 1430 CA TYR A 150 24.494 25.655 7.916 1.00 20.90 C ATOM 1431 C TYR A 150 23.910 26.127 9.240 1.00 19.91 C ATOM 1432 O TYR A 150 24.543 26.881 9.986 1.00 24.78 O ATOM 1433 CB TYR A 150 25.203 24.310 8.117 1.00 21.74 C ATOM 1434 CG TYR A 150 25.880 23.787 6.870 1.00 21.95 C ATOM 1435 CD1 TYR A 150 27.247 23.946 6.680 1.00 17.68 C ATOM 1436 CD2 TYR A 150 25.151 23.139 5.881 1.00 17.59 C ATOM 1437 CE1 TYR A 150 27.869 23.471 5.542 1.00 16.53 C ATOM 1438 CE2 TYR A 150 25.764 22.661 4.740 1.00 14.57 C ATOM 1439 CZ TYR A 150 27.123 22.830 4.575 1.00 18.40 C ATOM 1440 OH TYR A 150 27.737 22.355 3.439 1.00 21.05 O ATOM 1441 HH TYR A 150 27.340 22.791 2.644 1.00 0.00 H ATOM 1442 H TYR A 150 26.207 26.968 7.950 1.00 0.00 H ATOM 1443 N LEU A 151 22.693 25.670 9.523 1.00 24.03 N ATOM 1444 CA LEU A 151 22.015 25.973 10.784 1.00 24.70 C ATOM 1445 C LEU A 151 21.096 24.809 11.123 1.00 23.43 C ATOM 1446 O LEU A 151 20.020 24.656 10.523 1.00 24.11 O ATOM 1447 CB LEU A 151 21.230 27.280 10.710 1.00 22.61 C ATOM 1448 CG LEU A 151 20.292 27.554 11.890 1.00 29.08 C ATOM 1449 CD1 LEU A 151 21.069 27.657 13.195 1.00 25.52 C ATOM 1450 CD2 LEU A 151 19.463 28.808 11.650 1.00 26.43 C ATOM 1451 H LEU A 151 22.206 25.076 8.822 1.00 0.00 H ATOM 1452 N PRO A 152 21.487 23.957 12.069 1.00 22.82 N ATOM 1453 CA PRO A 152 20.565 22.921 12.546 1.00 19.35 C ATOM 1454 C PRO A 152 19.436 23.549 13.347 1.00 21.10 C ATOM 1455 O PRO A 152 19.647 24.485 14.121 1.00 27.11 O ATOM 1456 CB PRO A 152 21.449 22.027 13.426 1.00 25.22 C ATOM 1457 CG PRO A 152 22.867 22.402 13.080 1.00 23.05 C ATOM 1458 CD PRO A 152 22.815 23.842 12.689 1.00 27.04 C ATOM 1459 N PHE A 153 18.226 23.029 13.152 1.00 20.28 N ATOM 1460 CA PHE A 153 17.054 23.617 13.782 1.00 24.41 C ATOM 1461 C PHE A 153 15.994 22.546 13.988 1.00 26.43 C ATOM 1462 O PHE A 153 16.056 21.455 13.416 1.00 21.91 O ATOM 1463 CB PHE A 153 16.494 24.773 12.946 1.00 18.00 C ATOM 1464 CG PHE A 153 15.683 24.328 11.762 1.00 18.50 C ATOM 1465 CD1 PHE A 153 14.315 24.540 11.725 1.00 25.98 C ATOM 1466 CD2 PHE A 153 16.286 23.693 10.688 1.00 19.90 C ATOM 1467 CE1 PHE A 153 13.564 24.133 10.637 1.00 20.30 C ATOM 1468 CE2 PHE A 153 15.540 23.282 9.599 1.00 18.29 C ATOM 1469 CZ PHE A 153 14.177 23.503 9.574 1.00 18.94 C ATOM 1470 H PHE A 153 18.117 22.193 12.543 1.00 0.00 H ATOM 1471 N LEU A 154 15.012 22.879 14.824 1.00 27.15 N ATOM 1472 CA LEU A 154 13.850 22.035 15.051 1.00 26.71 C ATOM 1473 C LEU A 154 12.643 22.668 14.379 1.00 27.12 C ATOM 1474 O LEU A 154 12.233 23.772 14.768 1.00 25.94 O ATOM 1475 CB LEU A 154 13.594 21.845 16.545 1.00 25.14 C ATOM 1476 CG LEU A 154 14.171 20.577 17.181 1.00 34.96 C ATOM 1477 CD1 LEU A 154 13.462 19.345 16.646 1.00 31.34 C ATOM 1478 CD2 LEU A 154 15.672 20.473 16.947 1.00 31.93 C ATOM 1479 H LEU A 154 15.079 23.781 15.336 1.00 0.00 H ATOM 1480 N PRO A 155 12.062 22.024 13.369 1.00 28.72 N ATOM 1481 CA PRO A 155 10.940 22.633 12.642 1.00 29.42 C ATOM 1482 C PRO A 155 9.755 22.915 13.554 1.00 31.85 C ATOM 1483 O PRO A 155 9.264 22.031 14.259 1.00 32.04 O ATOM 1484 CB PRO A 155 10.598 21.582 11.582 1.00 28.59 C ATOM 1485 CG PRO A 155 11.866 20.823 11.386 1.00 25.33 C ATOM 1486 CD PRO A 155 12.519 20.778 12.735 1.00 27.87 C ATOM 1487 N SER A 156 9.300 24.164 13.530 1.00 30.14 N ATOM 1488 CA SER A 156 8.116 24.583 14.262 1.00 36.48 C ATOM 1489 C SER A 156 7.303 25.519 13.381 1.00 37.40 C ATOM 1490 O SER A 156 7.852 26.238 12.542 1.00 44.41 O ATOM 1491 CB SER A 156 8.476 25.277 15.581 1.00 35.93 C ATOM 1492 OG SER A 156 9.163 26.493 15.345 1.00 42.82 O ATOM 1493 HG SER A 156 9.383 26.920 16.211 1.00 0.00 H ATOM 1494 H SER A 156 9.812 24.870 12.964 1.00 0.00 H ATOM 1495 N THR A 157 5.985 25.502 13.578 1.00 37.09 N ATOM 1496 CA THR A 157 5.102 26.352 12.791 1.00 39.34 C ATOM 1497 C THR A 157 5.199 27.823 13.173 1.00 40.00 C ATOM 1498 O THR A 157 4.680 28.669 12.436 1.00 41.60 O ATOM 1499 CB THR A 157 3.652 25.885 12.934 1.00 36.05 C ATOM 1500 OG1 THR A 157 3.250 25.985 14.305 1.00 45.68 O ATOM 1501 CG2 THR A 157 3.510 24.441 12.474 1.00 33.08 C ATOM 1502 HG1 THR A 157 2.312 25.682 14.395 1.00 0.00 H ATOM 1503 H THR A 157 5.582 24.874 14.303 1.00 0.00 H ATOM 1504 N GLU A 158 5.849 28.151 14.289 1.00 39.46 N ATOM 1505 CA GLU A 158 5.923 29.523 14.770 1.00 41.06 C ATOM 1506 C GLU A 158 7.270 30.184 14.504 1.00 44.73 C ATOM 1507 O GLU A 158 7.480 31.321 14.938 1.00 48.05 O ATOM 1508 CB GLU A 158 5.617 29.575 16.273 1.00 43.16 C ATOM 1509 CG GLU A 158 6.764 29.129 17.173 1.00 47.95 C ATOM 1510 CD GLU A 158 6.771 27.634 17.427 1.00 55.70 C ATOM 1511 OE1 GLU A 158 5.810 26.952 17.013 1.00 61.04 O ATOM 1512 OE2 GLU A 158 7.740 27.140 18.043 1.00 59.81 O ATOM 1513 H GLU A 158 6.319 27.401 14.835 1.00 0.00 H ATOM 1514 N ASP A 159 8.182 29.515 13.804 1.00 39.02 N ATOM 1515 CA ASP A 159 9.514 30.045 13.546 1.00 36.37 C ATOM 1516 C ASP A 159 9.735 30.203 12.050 1.00 30.83 C ATOM 1517 O ASP A 159 9.520 29.260 11.281 1.00 36.68 O ATOM 1518 CB ASP A 159 10.595 29.140 14.143 1.00 36.24 C ATOM 1519 CG ASP A 159 10.660 29.229 15.653 1.00 40.09 C ATOM 1520 OD1 ASP A 159 10.232 30.264 16.208 1.00 36.86 O ATOM 1521 OD2 ASP A 159 11.144 28.267 16.285 1.00 45.98 O ATOM 1522 H ASP A 159 7.935 28.578 13.427 1.00 0.00 H ATOM 1523 N VAL A 160 10.164 31.396 11.645 1.00 25.60 N ATOM 1524 CA VAL A 160 10.581 31.670 10.277 1.00 24.97 C ATOM 1525 C VAL A 160 12.065 32.003 10.295 1.00 23.99 C ATOM 1526 O VAL A 160 12.605 32.467 11.305 1.00 25.26 O ATOM 1527 CB VAL A 160 9.766 32.814 9.636 1.00 24.20 C ATOM 1528 CG1 VAL A 160 8.280 32.492 9.672 1.00 28.92 C ATOM 1529 CG2 VAL A 160 10.050 34.133 10.336 1.00 27.01 C ATOM 1530 H VAL A 160 10.203 32.170 12.339 1.00 0.00 H ATOM 1531 N TYR A 161 12.731 31.757 9.170 1.00 21.50 N ATOM 1532 CA TYR A 161 14.168 31.949 9.069 1.00 20.81 C ATOM 1533 C TYR A 161 14.508 32.772 7.834 1.00 26.64 C ATOM 1534 O TYR A 161 13.737 32.845 6.874 1.00 25.96 O ATOM 1535 CB TYR A 161 14.917 30.610 9.011 1.00 21.34 C ATOM 1536 CG TYR A 161 14.860 29.795 10.285 1.00 27.65 C ATOM 1537 CD1 TYR A 161 13.735 29.044 10.603 1.00 25.78 C ATOM 1538 CD2 TYR A 161 15.941 29.758 11.158 1.00 24.43 C ATOM 1539 CE1 TYR A 161 13.683 28.290 11.760 1.00 22.24 C ATOM 1540 CE2 TYR A 161 15.901 29.001 12.313 1.00 24.33 C ATOM 1541 CZ TYR A 161 14.768 28.273 12.612 1.00 25.52 C ATOM 1542 OH TYR A 161 14.721 27.525 13.765 1.00 29.26 O ATOM 1543 HH TYR A 161 13.844 27.069 13.826 1.00 0.00 H ATOM 1544 H TYR A 161 12.208 31.417 8.338 1.00 0.00 H ATOM 1545 N ASP A 162 15.685 33.393 7.878 1.00 25.56 N ATOM 1546 CA ASP A 162 16.225 34.133 6.748 1.00 21.96 C ATOM 1547 C ASP A 162 17.738 33.982 6.743 1.00 29.05 C ATOM 1548 O ASP A 162 18.372 33.994 7.802 1.00 23.32 O ATOM 1549 CB ASP A 162 15.862 35.622 6.804 1.00 22.60 C ATOM 1550 CG ASP A 162 14.375 35.870 6.662 1.00 30.81 C ATOM 1551 OD1 ASP A 162 13.860 35.770 5.529 1.00 27.80 O ATOM 1552 OD2 ASP A 162 13.725 36.179 7.683 1.00 32.44 O ATOM 1553 H ASP A 162 16.241 33.347 8.756 1.00 0.00 H ATOM 1554 N CYS A 163 18.308 33.838 5.551 1.00 25.87 N ATOM 1555 CA CYS A 163 19.751 33.910 5.359 1.00 21.44 C ATOM 1556 C CYS A 163 20.065 35.277 4.766 1.00 22.69 C ATOM 1557 O CYS A 163 19.699 35.564 3.622 1.00 23.88 O ATOM 1558 CB CYS A 163 20.256 32.787 4.456 1.00 18.86 C ATOM 1559 SG CYS A 163 22.057 32.756 4.276 1.00 35.57 S ATOM 1560 H CYS A 163 17.701 33.667 4.724 1.00 0.00 H ATOM 1561 N ARG A 164 20.728 36.121 5.549 1.00 22.19 N ATOM 1562 CA ARG A 164 21.060 37.478 5.136 1.00 22.51 C ATOM 1563 C ARG A 164 22.509 37.513 4.669 1.00 20.65 C ATOM 1564 O ARG A 164 23.418 37.148 5.423 1.00 19.09 O ATOM 1565 CB ARG A 164 20.834 38.463 6.281 1.00 19.66 C ATOM 1566 CG ARG A 164 20.996 39.917 5.887 1.00 24.14 C ATOM 1567 CD ARG A 164 20.871 40.807 7.104 1.00 24.08 C ATOM 1568 NE ARG A 164 21.943 40.559 8.062 1.00 24.34 N ATOM 1569 CZ ARG A 164 21.897 40.917 9.340 1.00 27.94 C ATOM 1570 NH1 ARG A 164 20.823 41.527 9.820 1.00 28.63 N ATOM 1571 NH2 ARG A 164 22.920 40.656 10.142 1.00 26.95 N ATOM 1572 HE ARG A 164 22.797 40.071 7.723 1.00 0.00 H ATOM 1573 HH12 ARG A 164 20.788 41.807 10.821 1.00 0.00 H ATOM 1574 HH11 ARG A 164 20.015 41.726 9.196 1.00 0.00 H ATOM 1575 HH22 ARG A 164 22.881 40.937 11.142 1.00 0.00 H ATOM 1576 HH21 ARG A 164 23.761 40.170 9.771 1.00 0.00 H ATOM 1577 H ARG A 164 21.021 35.800 6.494 1.00 0.00 H ATOM 1578 N VAL A 165 22.721 37.957 3.434 1.00 19.07 N ATOM 1579 CA VAL A 165 24.029 37.932 2.793 1.00 19.43 C ATOM 1580 C VAL A 165 24.391 39.347 2.365 1.00 17.79 C ATOM 1581 O VAL A 165 23.599 40.022 1.697 1.00 21.22 O ATOM 1582 CB VAL A 165 24.045 36.973 1.589 1.00 21.67 C ATOM 1583 CG1 VAL A 165 25.346 37.102 0.820 1.00 23.22 C ATOM 1584 CG2 VAL A 165 23.837 35.538 2.055 1.00 17.88 C ATOM 1585 H VAL A 165 21.915 38.340 2.900 1.00 0.00 H ATOM 1586 N GLU A 166 25.585 39.792 2.749 1.00 14.87 N ATOM 1587 CA GLU A 166 26.118 41.086 2.350 1.00 19.10 C ATOM 1588 C GLU A 166 27.285 40.884 1.395 1.00 22.47 C ATOM 1589 O GLU A 166 28.111 39.987 1.590 1.00 20.21 O ATOM 1590 CB GLU A 166 26.580 41.894 3.565 1.00 25.09 C ATOM 1591 CG GLU A 166 25.492 42.169 4.585 1.00 35.40 C ATOM 1592 CD GLU A 166 26.051 42.643 5.911 1.00 43.59 C ATOM 1593 OE1 GLU A 166 27.124 43.284 5.911 1.00 48.14 O ATOM 1594 OE2 GLU A 166 25.421 42.371 6.954 1.00 52.54 O ATOM 1595 H GLU A 166 26.165 39.186 3.364 1.00 0.00 H ATOM 1596 N HIS A 167 27.352 41.724 0.366 1.00 18.84 N ATOM 1597 CA HIS A 167 28.424 41.643 -0.615 1.00 17.86 C ATOM 1598 C HIS A 167 28.577 43.007 -1.272 1.00 18.23 C ATOM 1599 O HIS A 167 27.585 43.702 -1.505 1.00 18.58 O ATOM 1600 CB HIS A 167 28.138 40.564 -1.666 1.00 15.72 C ATOM 1601 CG HIS A 167 29.309 40.243 -2.542 1.00 16.81 C ATOM 1602 ND1 HIS A 167 29.550 40.896 -3.732 1.00 18.37 N ATOM 1603 CD2 HIS A 167 30.304 39.336 -2.402 1.00 14.49 C ATOM 1604 CE1 HIS A 167 30.644 40.406 -4.286 1.00 18.07 C ATOM 1605 NE2 HIS A 167 31.122 39.458 -3.499 1.00 18.76 N ATOM 1606 H HIS A 167 26.621 42.456 0.260 1.00 0.00 H ATOM 1607 N TRP A 168 29.824 43.380 -1.568 1.00 17.43 N ATOM 1608 CA TRP A 168 30.105 44.690 -2.144 1.00 18.70 C ATOM 1609 C TRP A 168 29.461 44.887 -3.510 1.00 19.37 C ATOM 1610 O TRP A 168 29.374 46.028 -3.975 1.00 22.70 O ATOM 1611 CB TRP A 168 31.618 44.900 -2.231 1.00 17.49 C ATOM 1612 CG TRP A 168 32.278 44.909 -0.886 1.00 23.38 C ATOM 1613 CD1 TRP A 168 31.795 45.475 0.258 1.00 19.46 C ATOM 1614 CD2 TRP A 168 33.529 44.304 -0.537 1.00 19.74 C ATOM 1615 NE1 TRP A 168 32.673 45.271 1.295 1.00 26.91 N ATOM 1616 CE2 TRP A 168 33.745 44.554 0.833 1.00 19.21 C ATOM 1617 CE3 TRP A 168 34.490 43.581 -1.250 1.00 17.46 C ATOM 1618 CZ2 TRP A 168 34.881 44.106 1.503 1.00 24.26 C ATOM 1619 CZ3 TRP A 168 35.616 43.136 -0.582 1.00 21.26 C ATOM 1620 CH2 TRP A 168 35.802 43.400 0.780 1.00 22.86 C ATOM 1621 HE1 TRP A 168 32.545 45.606 2.271 1.00 0.00 H ATOM 1622 H TRP A 168 30.610 42.724 -1.384 1.00 0.00 H ATOM 1623 N GLY A 169 29.011 43.815 -4.161 1.00 16.50 N ATOM 1624 CA GLY A 169 28.213 43.948 -5.363 1.00 16.85 C ATOM 1625 C GLY A 169 26.736 44.164 -5.123 1.00 18.84 C ATOM 1626 O GLY A 169 26.001 44.452 -6.072 1.00 18.12 O ATOM 1627 H GLY A 169 29.237 42.866 -3.800 1.00 0.00 H ATOM 1628 N LEU A 170 26.287 44.031 -3.878 1.00 16.84 N ATOM 1629 CA LEU A 170 24.894 44.242 -3.510 1.00 22.78 C ATOM 1630 C LEU A 170 24.713 45.638 -2.931 1.00 27.37 C ATOM 1631 O LEU A 170 25.512 46.088 -2.103 1.00 27.52 O ATOM 1632 CB LEU A 170 24.434 43.202 -2.486 1.00 16.48 C ATOM 1633 CG LEU A 170 24.436 41.728 -2.891 1.00 20.17 C ATOM 1634 CD1 LEU A 170 24.214 40.846 -1.672 1.00 15.17 C ATOM 1635 CD2 LEU A 170 23.372 41.463 -3.943 1.00 14.38 C ATOM 1636 H LEU A 170 26.962 43.764 -3.133 1.00 0.00 H ATOM 1637 N ASP A 171 23.658 46.324 -3.372 1.00 33.20 N ATOM 1638 CA ASP A 171 23.305 47.598 -2.755 1.00 38.51 C ATOM 1639 C ASP A 171 22.721 47.381 -1.365 1.00 37.42 C ATOM 1640 O ASP A 171 23.165 47.997 -0.389 1.00 39.97 O ATOM 1641 CB ASP A 171 22.323 48.363 -3.643 1.00 47.52 C ATOM 1642 CG ASP A 171 23.002 49.036 -4.820 1.00 60.37 C ATOM 1643 OD1 ASP A 171 24.064 48.546 -5.257 1.00 56.77 O ATOM 1644 OD2 ASP A 171 22.473 50.058 -5.307 1.00 61.45 O ATOM 1645 H ASP A 171 23.086 45.951 -4.156 1.00 0.00 H ATOM 1646 N GLU A 172 21.726 46.499 -1.256 1.00 36.52 N ATOM 1647 CA GLU A 172 21.123 46.122 0.010 1.00 37.36 C ATOM 1648 C GLU A 172 21.437 44.664 0.331 1.00 33.67 C ATOM 1649 O GLU A 172 21.657 43.858 -0.578 1.00 29.17 O ATOM 1650 CB GLU A 172 19.601 46.317 -0.018 1.00 37.33 C ATOM 1651 CG GLU A 172 19.145 47.767 -0.079 1.00 56.47 C ATOM 1652 CD GLU A 172 19.414 48.530 1.213 1.00 62.37 C ATOM 1653 OE1 GLU A 172 19.775 47.892 2.236 1.00 61.70 O ATOM 1654 OE2 GLU A 172 19.269 49.779 1.212 1.00 53.63 O ATOM 1655 H GLU A 172 21.363 46.058 -2.125 1.00 0.00 H ATOM 1656 N PRO A 173 21.482 44.298 1.612 1.00 38.57 N ATOM 1657 CA PRO A 173 21.710 42.893 1.968 1.00 27.18 C ATOM 1658 C PRO A 173 20.624 41.998 1.393 1.00 27.26 C ATOM 1659 O PRO A 173 19.447 42.364 1.350 1.00 33.74 O ATOM 1660 CB PRO A 173 21.679 42.905 3.500 1.00 25.68 C ATOM 1661 CG PRO A 173 22.057 44.298 3.869 1.00 30.11 C ATOM 1662 CD PRO A 173 21.466 45.170 2.798 1.00 38.91 C ATOM 1663 N LEU A 174 21.034 40.817 0.941 1.00 26.82 N ATOM 1664 CA LEU A 174 20.130 39.867 0.307 1.00 18.59 C ATOM 1665 C LEU A 174 19.560 38.934 1.368 1.00 21.54 C ATOM 1666 O LEU A 174 20.312 38.232 2.054 1.00 26.44 O ATOM 1667 CB LEU A 174 20.864 39.078 -0.777 1.00 18.50 C ATOM 1668 CG LEU A 174 20.019 38.368 -1.834 1.00 23.11 C ATOM 1669 CD1 LEU A 174 19.017 39.331 -2.447 1.00 22.14 C ATOM 1670 CD2 LEU A 174 20.914 37.776 -2.911 1.00 20.68 C ATOM 1671 H LEU A 174 22.037 40.562 1.044 1.00 0.00 H ATOM 1672 N LEU A 175 18.237 38.933 1.508 1.00 18.46 N ATOM 1673 CA LEU A 175 17.539 38.074 2.456 1.00 22.35 C ATOM 1674 C LEU A 175 16.796 36.992 1.686 1.00 18.27 C ATOM 1675 O LEU A 175 15.993 37.297 0.797 1.00 27.87 O ATOM 1676 CB LEU A 175 16.563 38.872 3.321 1.00 22.53 C ATOM 1677 CG LEU A 175 17.114 39.580 4.560 1.00 27.64 C ATOM 1678 CD1 LEU A 175 17.874 40.842 4.183 1.00 32.43 C ATOM 1679 CD2 LEU A 175 15.985 39.894 5.530 1.00 27.80 C ATOM 1680 H LEU A 175 17.675 39.575 0.913 1.00 0.00 H ATOM 1681 N LYS A 176 17.065 35.735 2.026 1.00 23.13 N ATOM 1682 CA LYS A 176 16.383 34.592 1.433 1.00 18.37 C ATOM 1683 C LYS A 176 15.634 33.865 2.540 1.00 22.16 C ATOM 1684 O LYS A 176 16.241 33.430 3.524 1.00 26.40 O ATOM 1685 CB LYS A 176 17.372 33.664 0.728 1.00 24.21 C ATOM 1686 CG LYS A 176 17.006 33.360 -0.715 1.00 31.09 C ATOM 1687 CD LYS A 176 16.981 34.629 -1.555 1.00 24.94 C ATOM 1688 CE LYS A 176 16.537 34.339 -2.981 1.00 27.64 C ATOM 1689 NZ LYS A 176 16.622 35.546 -3.851 1.00 24.33 N ATOM 1690 HZ1 LYS A 176 16.010 36.293 -3.466 1.00 0.00 H ATOM 1691 HZ2 LYS A 176 17.606 35.883 -3.879 1.00 0.00 H ATOM 1692 HZ3 LYS A 176 16.310 35.301 -4.812 1.00 0.00 H ATOM 1693 H LYS A 176 17.794 35.560 2.747 1.00 0.00 H ATOM 1694 N HIS A 177 14.323 33.732 2.374 1.00 24.38 N ATOM 1695 CA HIS A 177 13.429 33.323 3.445 1.00 26.28 C ATOM 1696 C HIS A 177 13.181 31.817 3.428 1.00 23.39 C ATOM 1697 O HIS A 177 13.313 31.148 2.400 1.00 25.33 O ATOM 1698 CB HIS A 177 12.100 34.073 3.326 1.00 22.46 C ATOM 1699 CG HIS A 177 11.211 33.933 4.522 1.00 32.45 C ATOM 1700 ND1 HIS A 177 11.460 34.577 5.714 1.00 27.71 N ATOM 1701 CD2 HIS A 177 10.070 33.227 4.707 1.00 28.34 C ATOM 1702 CE1 HIS A 177 10.513 34.273 6.583 1.00 31.02 C ATOM 1703 NE2 HIS A 177 9.657 33.455 5.997 1.00 32.08 N ATOM 1704 H HIS A 177 13.918 33.929 1.437 1.00 0.00 H ATOM 1705 N TRP A 178 12.824 31.289 4.597 1.00 22.78 N ATOM 1706 CA TRP A 178 12.307 29.934 4.716 1.00 26.64 C ATOM 1707 C TRP A 178 11.342 29.876 5.889 1.00 31.23 C ATOM 1708 O TRP A 178 11.589 30.481 6.936 1.00 27.23 O ATOM 1709 CB TRP A 178 13.414 28.890 4.916 1.00 21.96 C ATOM 1710 CG TRP A 178 12.864 27.489 5.006 1.00 25.66 C ATOM 1711 CD1 TRP A 178 12.700 26.608 3.977 1.00 28.03 C ATOM 1712 CD2 TRP A 178 12.380 26.824 6.183 1.00 25.90 C ATOM 1713 NE1 TRP A 178 12.156 25.434 4.440 1.00 25.69 N ATOM 1714 CE2 TRP A 178 11.949 25.541 5.790 1.00 26.05 C ATOM 1715 CE3 TRP A 178 12.277 27.186 7.530 1.00 26.58 C ATOM 1716 CZ2 TRP A 178 11.423 24.620 6.694 1.00 23.53 C ATOM 1717 CZ3 TRP A 178 11.752 26.270 8.426 1.00 29.15 C ATOM 1718 CH2 TRP A 178 11.333 25.003 8.004 1.00 27.78 C ATOM 1719 HE1 TRP A 178 11.937 24.599 3.859 1.00 0.00 H ATOM 1720 H TRP A 178 12.918 31.866 5.457 1.00 0.00 H ATOM 1721 N GLU A 179 10.248 29.140 5.706 1.00 25.20 N ATOM 1722 CA GLU A 179 9.310 28.873 6.785 1.00 33.31 C ATOM 1723 C GLU A 179 8.621 27.546 6.508 1.00 35.89 C ATOM 1724 O GLU A 179 8.604 27.057 5.375 1.00 31.78 O ATOM 1725 CB GLU A 179 8.278 29.996 6.938 1.00 29.11 C ATOM 1726 CG GLU A 179 7.197 30.000 5.874 1.00 36.58 C ATOM 1727 CD GLU A 179 6.115 31.023 6.152 1.00 50.82 C ATOM 1728 OE1 GLU A 179 6.459 32.179 6.480 1.00 45.51 O ATOM 1729 OE2 GLU A 179 4.921 30.670 6.051 1.00 50.72 O ATOM 1730 H GLU A 179 10.058 28.744 4.763 1.00 0.00 H ATOM 1731 N PHE A 180 8.057 26.962 7.561 1.00 32.51 N ATOM 1732 CA PHE A 180 7.361 25.692 7.423 1.00 35.78 C ATOM 1733 C PHE A 180 6.024 25.889 6.717 1.00 38.81 C ATOM 1734 O PHE A 180 5.390 26.943 6.816 1.00 50.61 O ATOM 1735 CB PHE A 180 7.143 25.051 8.794 1.00 35.98 C ATOM 1736 CG PHE A 180 6.490 23.698 8.737 1.00 41.20 C ATOM 1737 CD1 PHE A 180 5.125 23.562 8.934 1.00 48.64 C ATOM 1738 CD2 PHE A 180 7.240 22.563 8.484 1.00 34.60 C ATOM 1739 CE1 PHE A 180 4.523 22.318 8.881 1.00 44.80 C ATOM 1740 CE2 PHE A 180 6.645 21.317 8.430 1.00 32.73 C ATOM 1741 CZ PHE A 180 5.285 21.194 8.628 1.00 37.62 C ATOM 1742 H PHE A 180 8.114 27.418 8.494 1.00 0.00 H ATOM 1743 N ASP A 181 5.600 24.859 5.992 1.00 42.49 N ATOM 1744 CA ASP A 181 4.310 24.882 5.312 1.00 55.23 C ATOM 1745 C ASP A 181 3.165 24.782 6.315 1.00 54.80 C ATOM 1746 O ASP A 181 2.006 25.019 5.975 1.00 54.12 O ATOM 1747 CB ASP A 181 4.218 23.744 4.293 1.00 53.86 C ATOM 1748 CG ASP A 181 5.199 23.907 3.149 1.00 66.58 C ATOM 1749 OD1 ASP A 181 6.205 24.625 3.326 1.00 55.19 O ATOM 1750 OD2 ASP A 181 4.964 23.316 2.074 1.00 61.90 O ATOM 1751 H ASP A 181 6.203 24.016 5.907 1.00 0.00 H TER 1752 ASP A 181 ATOM 1753 N ASP B 2 33.154 48.523 2.799 1.00 53.41 N ATOM 1754 CA ASP B 2 34.439 49.046 2.350 1.00 51.23 C ATOM 1755 C ASP B 2 34.391 49.372 0.858 1.00 49.39 C ATOM 1756 O ASP B 2 33.907 48.578 0.051 1.00 40.01 O ATOM 1757 CB ASP B 2 35.559 48.043 2.646 1.00 46.67 C ATOM 1758 CG ASP B 2 36.943 48.672 2.591 1.00 38.52 C ATOM 1759 OD1 ASP B 2 37.176 49.547 1.731 1.00 42.26 O ATOM 1760 OD2 ASP B 2 37.801 48.288 3.413 1.00 37.52 O ATOM 1761 HN3 ASP B 2 32.930 47.656 2.270 1.00 0.00 H ATOM 1762 HN2 ASP B 2 32.414 49.234 2.631 1.00 0.00 H ATOM 1763 HN1 ASP B 2 33.205 48.307 3.815 1.00 0.00 H ATOM 1764 N THR B 3 34.903 50.552 0.506 1.00 46.81 N ATOM 1765 CA THR B 3 34.898 51.037 -0.868 1.00 39.59 C ATOM 1766 C THR B 3 36.200 50.749 -1.608 1.00 38.06 C ATOM 1767 O THR B 3 36.186 50.658 -2.842 1.00 33.39 O ATOM 1768 CB THR B 3 34.603 52.550 -0.873 1.00 45.64 C ATOM 1769 OG1 THR B 3 33.251 52.771 -0.450 1.00 51.37 O ATOM 1770 CG2 THR B 3 34.792 53.174 -2.253 1.00 41.54 C ATOM 1771 HG1 THR B 3 33.060 53.742 -0.453 1.00 0.00 H ATOM 1772 H THR B 3 35.324 51.152 1.244 1.00 0.00 H ATOM 1773 N ARG B 4 37.301 50.554 -0.884 1.00 34.06 N ATOM 1774 CA ARG B 4 38.604 50.380 -1.513 1.00 33.42 C ATOM 1775 C ARG B 4 38.571 49.241 -2.531 1.00 31.99 C ATOM 1776 O ARG B 4 37.932 48.209 -2.293 1.00 34.77 O ATOM 1777 CB ARG B 4 39.673 50.092 -0.460 1.00 29.24 C ATOM 1778 CG ARG B 4 40.085 51.293 0.367 1.00 27.93 C ATOM 1779 CD ARG B 4 41.076 50.867 1.427 1.00 32.77 C ATOM 1780 NE ARG B 4 40.525 49.804 2.261 1.00 30.41 N ATOM 1781 CZ ARG B 4 41.250 49.022 3.053 1.00 28.93 C ATOM 1782 NH1 ARG B 4 42.565 49.176 3.116 1.00 30.19 N ATOM 1783 NH2 ARG B 4 40.659 48.081 3.777 1.00 24.42 N ATOM 1784 HE ARG B 4 39.497 49.648 2.234 1.00 0.00 H ATOM 1785 HH12 ARG B 4 43.131 48.563 3.737 1.00 0.00 H ATOM 1786 HH11 ARG B 4 43.031 49.910 2.545 1.00 0.00 H ATOM 1787 HH22 ARG B 4 41.227 47.469 4.397 1.00 0.00 H ATOM 1788 HH21 ARG B 4 39.628 47.955 3.725 1.00 0.00 H ATOM 1789 H ARG B 4 37.229 50.525 0.153 1.00 0.00 H ATOM 1790 N PRO B 5 39.248 49.392 -3.666 1.00 24.81 N ATOM 1791 CA PRO B 5 39.221 48.342 -4.687 1.00 21.69 C ATOM 1792 C PRO B 5 40.012 47.117 -4.259 1.00 23.72 C ATOM 1793 O PRO B 5 40.973 47.201 -3.491 1.00 24.66 O ATOM 1794 CB PRO B 5 39.861 49.020 -5.903 1.00 20.67 C ATOM 1795 CG PRO B 5 40.757 50.057 -5.315 1.00 20.86 C ATOM 1796 CD PRO B 5 40.053 50.554 -4.083 1.00 19.27 C ATOM 1797 N ARG B 6 39.594 45.965 -4.774 1.00 20.15 N ATOM 1798 CA ARG B 6 40.221 44.690 -4.466 1.00 19.82 C ATOM 1799 C ARG B 6 41.013 44.181 -5.663 1.00 16.41 C ATOM 1800 O ARG B 6 40.719 44.515 -6.815 1.00 20.65 O ATOM 1801 CB ARG B 6 39.179 43.644 -4.052 1.00 17.45 C ATOM 1802 CG ARG B 6 39.029 43.474 -2.548 1.00 20.01 C ATOM 1803 CD ARG B 6 38.649 44.781 -1.873 1.00 24.44 C ATOM 1804 NE ARG B 6 38.571 44.649 -0.422 1.00 18.57 N ATOM 1805 CZ ARG B 6 38.235 45.638 0.400 1.00 18.01 C ATOM 1806 NH1 ARG B 6 37.944 46.836 -0.088 1.00 22.48 N ATOM 1807 NH2 ARG B 6 38.188 45.430 1.708 1.00 21.59 N ATOM 1808 HE ARG B 6 38.792 43.723 -0.005 1.00 0.00 H ATOM 1809 HH12 ARG B 6 37.681 47.610 0.555 1.00 0.00 H ATOM 1810 HH11 ARG B 6 37.979 47.002 -1.114 1.00 0.00 H ATOM 1811 HH22 ARG B 6 37.925 46.206 2.349 1.00 0.00 H ATOM 1812 HH21 ARG B 6 38.414 44.491 2.094 1.00 0.00 H ATOM 1813 H ARG B 6 38.783 45.976 -5.425 1.00 0.00 H ATOM 1814 N PHE B 7 42.025 43.367 -5.374 1.00 13.83 N ATOM 1815 CA PHE B 7 42.861 42.750 -6.398 1.00 17.41 C ATOM 1816 C PHE B 7 43.060 41.292 -6.019 1.00 18.52 C ATOM 1817 O PHE B 7 43.530 40.997 -4.916 1.00 21.74 O ATOM 1818 CB PHE B 7 44.207 43.472 -6.526 1.00 14.24 C ATOM 1819 CG PHE B 7 44.080 44.947 -6.800 1.00 15.32 C ATOM 1820 CD1 PHE B 7 43.979 45.854 -5.756 1.00 16.80 C ATOM 1821 CD2 PHE B 7 44.062 45.426 -8.099 1.00 14.06 C ATOM 1822 CE1 PHE B 7 43.861 47.210 -6.003 1.00 14.51 C ATOM 1823 CE2 PHE B 7 43.947 46.781 -8.352 1.00 17.52 C ATOM 1824 CZ PHE B 7 43.845 47.674 -7.303 1.00 16.96 C ATOM 1825 H PHE B 7 42.229 43.162 -4.375 1.00 0.00 H ATOM 1826 N LEU B 8 42.699 40.385 -6.924 1.00 19.11 N ATOM 1827 CA LEU B 8 42.630 38.960 -6.626 1.00 14.69 C ATOM 1828 C LEU B 8 43.571 38.180 -7.532 1.00 19.45 C ATOM 1829 O LEU B 8 43.617 38.418 -8.743 1.00 18.21 O ATOM 1830 CB LEU B 8 41.197 38.443 -6.788 1.00 13.17 C ATOM 1831 CG LEU B 8 40.979 36.945 -6.571 1.00 16.58 C ATOM 1832 CD1 LEU B 8 41.253 36.567 -5.124 1.00 14.75 C ATOM 1833 CD2 LEU B 8 39.570 36.544 -6.980 1.00 14.32 C ATOM 1834 H LEU B 8 42.456 40.706 -7.883 1.00 0.00 H ATOM 1835 N GLU B 9 44.311 37.247 -6.938 1.00 17.20 N ATOM 1836 CA GLU B 9 45.161 36.308 -7.659 1.00 13.93 C ATOM 1837 C GLU B 9 44.699 34.896 -7.333 1.00 14.56 C ATOM 1838 O GLU B 9 44.444 34.582 -6.168 1.00 14.86 O ATOM 1839 CB GLU B 9 46.633 36.489 -7.273 1.00 16.81 C ATOM 1840 CG GLU B 9 47.563 35.404 -7.798 1.00 13.73 C ATOM 1841 CD GLU B 9 48.022 35.661 -9.218 1.00 19.64 C ATOM 1842 OE1 GLU B 9 47.805 36.783 -9.722 1.00 14.94 O ATOM 1843 OE2 GLU B 9 48.603 34.740 -9.830 1.00 22.45 O ATOM 1844 H GLU B 9 44.281 37.184 -5.900 1.00 0.00 H ATOM 1845 N GLN B 10 44.580 34.053 -8.357 1.00 14.41 N ATOM 1846 CA GLN B 10 44.165 32.668 -8.179 1.00 13.47 C ATOM 1847 C GLN B 10 45.096 31.744 -8.948 1.00 13.95 C ATOM 1848 O GLN B 10 45.563 32.085 -10.038 1.00 13.64 O ATOM 1849 CB GLN B 10 42.724 32.431 -8.655 1.00 12.77 C ATOM 1850 CG GLN B 10 41.677 33.341 -8.044 1.00 10.82 C ATOM 1851 CD GLN B 10 40.270 32.944 -8.450 1.00 14.72 C ATOM 1852 OE1 GLN B 10 39.832 31.821 -8.197 1.00 11.20 O ATOM 1853 NE2 GLN B 10 39.559 33.859 -9.097 1.00 12.87 N ATOM 1854 HE22 GLN B 10 39.969 34.795 -9.290 1.00 0.00 H ATOM 1855 HE21 GLN B 10 38.592 33.640 -9.411 1.00 0.00 H ATOM 1856 H GLN B 10 44.790 34.395 -9.316 1.00 0.00 H ATOM 1857 N VAL B 11 45.359 30.573 -8.372 1.00 11.80 N ATOM 1858 CA VAL B 11 46.090 29.503 -9.037 1.00 14.33 C ATOM 1859 C VAL B 11 45.297 28.217 -8.862 1.00 16.17 C ATOM 1860 O VAL B 11 44.753 27.956 -7.783 1.00 16.67 O ATOM 1861 CB VAL B 11 47.522 29.337 -8.482 1.00 12.15 C ATOM 1862 CG1 VAL B 11 48.316 28.363 -9.341 1.00 9.56 C ATOM 1863 CG2 VAL B 11 48.230 30.680 -8.403 1.00 15.45 C ATOM 1864 H VAL B 11 45.026 30.414 -7.400 1.00 0.00 H ATOM 1865 N LYS B 12 45.223 27.416 -9.922 1.00 14.56 N ATOM 1866 CA LYS B 12 44.489 26.154 -9.893 1.00 17.59 C ATOM 1867 C LYS B 12 45.348 25.063 -10.515 1.00 16.15 C ATOM 1868 O LYS B 12 45.652 25.109 -11.711 1.00 16.92 O ATOM 1869 CB LYS B 12 43.147 26.280 -10.616 1.00 14.78 C ATOM 1870 CG LYS B 12 42.122 27.088 -9.836 1.00 15.70 C ATOM 1871 CD LYS B 12 40.799 27.199 -10.572 1.00 19.71 C ATOM 1872 CE LYS B 12 39.844 28.118 -9.824 1.00 16.98 C ATOM 1873 NZ LYS B 12 38.515 28.216 -10.489 1.00 15.42 N ATOM 1874 HZ1 LYS B 12 38.637 28.592 -11.451 1.00 0.00 H ATOM 1875 HZ2 LYS B 12 38.082 27.272 -10.537 1.00 0.00 H ATOM 1876 HZ3 LYS B 12 37.901 28.853 -9.942 1.00 0.00 H ATOM 1877 H LYS B 12 45.704 27.698 -10.800 1.00 0.00 H ATOM 1878 N HIS B 13 45.742 24.090 -9.697 1.00 17.00 N ATOM 1879 CA HIS B 13 46.487 22.921 -10.147 1.00 15.35 C ATOM 1880 C HIS B 13 45.482 21.792 -10.342 1.00 13.96 C ATOM 1881 O HIS B 13 44.932 21.269 -9.368 1.00 13.39 O ATOM 1882 CB HIS B 13 47.567 22.538 -9.136 1.00 14.05 C ATOM 1883 CG HIS B 13 48.337 23.705 -8.599 1.00 19.92 C ATOM 1884 ND1 HIS B 13 49.653 23.947 -8.933 1.00 24.10 N ATOM 1885 CD2 HIS B 13 47.980 24.694 -7.745 1.00 19.68 C ATOM 1886 CE1 HIS B 13 50.071 25.035 -8.312 1.00 19.63 C ATOM 1887 NE2 HIS B 13 49.075 25.508 -7.585 1.00 15.46 N ATOM 1888 H HIS B 13 45.507 24.168 -8.687 1.00 0.00 H ATOM 1889 N GLU B 14 45.239 21.421 -11.595 1.00 13.04 N ATOM 1890 CA GLU B 14 44.162 20.507 -11.945 1.00 12.83 C ATOM 1891 C GLU B 14 44.715 19.160 -12.388 1.00 17.38 C ATOM 1892 O GLU B 14 45.720 19.091 -13.102 1.00 21.15 O ATOM 1893 CB GLU B 14 43.288 21.101 -13.051 1.00 12.77 C ATOM 1894 CG GLU B 14 42.702 22.457 -12.702 1.00 12.04 C ATOM 1895 CD GLU B 14 41.750 22.969 -13.761 1.00 21.70 C ATOM 1896 OE1 GLU B 14 41.402 22.193 -14.676 1.00 23.22 O ATOM 1897 OE2 GLU B 14 41.348 24.149 -13.679 1.00 24.15 O ATOM 1898 H GLU B 14 45.841 21.798 -12.354 1.00 0.00 H ATOM 1899 N CYS B 15 44.042 18.091 -11.962 1.00 20.56 N ATOM 1900 CA CYS B 15 44.387 16.722 -12.335 1.00 18.45 C ATOM 1901 C CYS B 15 43.140 16.061 -12.906 1.00 19.63 C ATOM 1902 O CYS B 15 42.178 15.808 -12.173 1.00 20.77 O ATOM 1903 CB CYS B 15 44.917 15.937 -11.135 1.00 16.73 C ATOM 1904 SG CYS B 15 46.555 16.435 -10.559 1.00 22.69 S ATOM 1905 H CYS B 15 43.229 18.240 -11.331 1.00 0.00 H ATOM 1906 N HIS B 16 43.156 15.780 -14.206 1.00 17.81 N ATOM 1907 CA HIS B 16 42.030 15.170 -14.903 1.00 18.96 C ATOM 1908 C HIS B 16 42.367 13.712 -15.189 1.00 21.52 C ATOM 1909 O HIS B 16 43.386 13.422 -15.825 1.00 30.96 O ATOM 1910 CB HIS B 16 41.717 15.923 -16.197 1.00 16.91 C ATOM 1911 CG HIS B 16 41.378 17.368 -15.990 1.00 21.89 C ATOM 1912 ND1 HIS B 16 40.197 17.926 -16.431 1.00 26.88 N ATOM 1913 CD2 HIS B 16 42.064 18.369 -15.388 1.00 20.88 C ATOM 1914 CE1 HIS B 16 40.171 19.207 -16.111 1.00 23.87 C ATOM 1915 NE2 HIS B 16 41.291 19.502 -15.477 1.00 17.61 N ATOM 1916 H HIS B 16 44.012 16.006 -14.751 1.00 0.00 H ATOM 1917 N PHE B 17 41.515 12.801 -14.724 1.00 18.92 N ATOM 1918 CA PHE B 17 41.767 11.368 -14.804 1.00 20.73 C ATOM 1919 C PHE B 17 40.774 10.697 -15.748 1.00 27.56 C ATOM 1920 O PHE B 17 39.576 10.993 -15.714 1.00 33.99 O ATOM 1921 CB PHE B 17 41.677 10.726 -13.416 1.00 19.65 C ATOM 1922 CG PHE B 17 42.656 11.287 -12.423 1.00 21.39 C ATOM 1923 CD1 PHE B 17 42.289 12.317 -11.572 1.00 22.95 C ATOM 1924 CD2 PHE B 17 43.944 10.784 -12.342 1.00 24.02 C ATOM 1925 CE1 PHE B 17 43.189 12.834 -10.659 1.00 20.30 C ATOM 1926 CE2 PHE B 17 44.849 11.297 -11.432 1.00 21.96 C ATOM 1927 CZ PHE B 17 44.471 12.324 -10.589 1.00 22.45 C ATOM 1928 H PHE B 17 40.631 13.126 -14.284 1.00 0.00 H ATOM 1929 N PHE B 18 41.273 9.775 -16.575 1.00 30.06 N ATOM 1930 CA PHE B 18 40.460 9.052 -17.551 1.00 36.59 C ATOM 1931 C PHE B 18 40.651 7.550 -17.345 1.00 37.14 C ATOM 1932 O PHE B 18 41.784 7.067 -17.427 1.00 39.21 O ATOM 1933 CB PHE B 18 40.852 9.456 -18.985 1.00 36.06 C ATOM 1934 CG PHE B 18 40.903 10.955 -19.221 1.00 35.96 C ATOM 1935 CD1 PHE B 18 42.041 11.690 -18.915 1.00 34.76 C ATOM 1936 CD2 PHE B 18 39.819 11.619 -19.772 1.00 41.76 C ATOM 1937 CE1 PHE B 18 42.087 13.058 -19.136 1.00 23.63 C ATOM 1938 CE2 PHE B 18 39.861 12.987 -19.996 1.00 44.20 C ATOM 1939 CZ PHE B 18 40.996 13.705 -19.677 1.00 30.92 C ATOM 1940 H PHE B 18 42.289 9.561 -16.522 1.00 0.00 H ATOM 1941 N ASN B 19 39.550 6.809 -17.097 1.00 36.86 N ATOM 1942 CA ASN B 19 39.612 5.366 -16.818 1.00 38.33 C ATOM 1943 C ASN B 19 40.642 5.147 -15.710 1.00 36.85 C ATOM 1944 O ASN B 19 41.786 4.777 -15.979 1.00 40.48 O ATOM 1945 CB ASN B 19 39.925 4.588 -18.120 1.00 46.64 C ATOM 1946 CG ASN B 19 40.484 3.163 -17.906 1.00 49.75 C ATOM 1947 OD1 ASN B 19 41.670 3.019 -17.703 1.00 64.27 O ATOM 1948 ND2 ASN B 19 39.684 2.126 -18.196 1.00 59.85 N ATOM 1949 HD22 ASN B 19 38.670 2.283 -18.365 1.00 0.00 H ATOM 1950 HD21 ASN B 19 40.078 1.165 -18.252 1.00 0.00 H ATOM 1951 H ASN B 19 38.621 7.277 -17.103 1.00 0.00 H ATOM 1952 N GLY B 20 40.282 5.439 -14.461 1.00 36.28 N ATOM 1953 CA GLY B 20 41.280 5.351 -13.397 1.00 33.57 C ATOM 1954 C GLY B 20 42.426 6.317 -13.645 1.00 32.26 C ATOM 1955 O GLY B 20 42.222 7.482 -14.003 1.00 30.39 O ATOM 1956 H GLY B 20 39.305 5.725 -14.246 1.00 0.00 H ATOM 1957 N THR B 21 43.652 5.830 -13.456 1.00 28.24 N ATOM 1958 CA THR B 21 44.861 6.601 -13.725 1.00 28.11 C ATOM 1959 C THR B 21 45.547 6.163 -15.015 1.00 34.39 C ATOM 1960 O THR B 21 46.774 6.262 -15.133 1.00 25.17 O ATOM 1961 CB THR B 21 45.834 6.497 -12.551 1.00 31.41 C ATOM 1962 OG1 THR B 21 46.235 5.132 -12.383 1.00 41.23 O ATOM 1963 CG2 THR B 21 45.171 6.982 -11.277 1.00 28.25 C ATOM 1964 HG1 THR B 21 46.679 4.816 -13.209 1.00 0.00 H ATOM 1965 H THR B 21 43.751 4.857 -13.101 1.00 0.00 H ATOM 1966 N GLU B 22 44.776 5.676 -15.989 1.00 35.11 N ATOM 1967 CA GLU B 22 45.367 5.252 -17.253 1.00 33.65 C ATOM 1968 C GLU B 22 45.860 6.451 -18.052 1.00 31.09 C ATOM 1969 O GLU B 22 47.029 6.507 -18.452 1.00 35.32 O ATOM 1970 CB GLU B 22 44.355 4.444 -18.063 1.00 37.52 C ATOM 1971 CG GLU B 22 44.989 3.446 -19.011 1.00 46.70 C ATOM 1972 CD GLU B 22 45.641 2.290 -18.278 1.00 64.95 C ATOM 1973 OE1 GLU B 22 44.991 1.235 -18.137 1.00 70.87 O ATOM 1974 OE2 GLU B 22 46.798 2.440 -17.833 1.00 66.18 O ATOM 1975 H GLU B 22 43.749 5.598 -15.846 1.00 0.00 H ATOM 1976 N ARG B 23 44.981 7.419 -18.295 1.00 28.24 N ATOM 1977 CA ARG B 23 45.339 8.675 -18.938 1.00 29.60 C ATOM 1978 C ARG B 23 45.087 9.808 -17.955 1.00 23.81 C ATOM 1979 O ARG B 23 44.002 9.896 -17.371 1.00 28.08 O ATOM 1980 CB ARG B 23 44.539 8.890 -20.225 1.00 20.60 C ATOM 1981 H ARG B 23 43.991 7.272 -18.012 1.00 0.00 H ATOM 1982 N VAL B 24 46.090 10.662 -17.762 1.00 18.86 N ATOM 1983 CA VAL B 24 46.021 11.751 -16.796 1.00 22.70 C ATOM 1984 C VAL B 24 46.478 13.039 -17.467 1.00 22.40 C ATOM 1985 O VAL B 24 47.474 13.050 -18.200 1.00 18.96 O ATOM 1986 CB VAL B 24 46.875 11.457 -15.543 1.00 21.54 C ATOM 1987 CG1 VAL B 24 46.777 12.602 -14.552 1.00 21.40 C ATOM 1988 CG2 VAL B 24 46.439 10.152 -14.891 1.00 22.14 C ATOM 1989 H VAL B 24 46.958 10.547 -18.323 1.00 0.00 H ATOM 1990 N ARG B 25 45.748 14.123 -17.215 1.00 19.91 N ATOM 1991 CA ARG B 25 46.064 15.443 -17.745 1.00 19.28 C ATOM 1992 C ARG B 25 46.268 16.404 -16.582 1.00 22.11 C ATOM 1993 O ARG B 25 45.459 16.434 -15.649 1.00 26.61 O ATOM 1994 CB ARG B 25 44.947 15.940 -18.668 1.00 24.10 C ATOM 1995 CG ARG B 25 45.289 17.177 -19.483 1.00 22.84 C ATOM 1996 CD ARG B 25 44.232 17.413 -20.553 1.00 22.98 C ATOM 1997 NE ARG B 25 44.616 18.446 -21.510 1.00 31.33 N ATOM 1998 CZ ARG B 25 44.037 19.640 -21.595 1.00 32.08 C ATOM 1999 NH1 ARG B 25 43.039 19.956 -20.781 1.00 33.53 N ATOM 2000 NH2 ARG B 25 44.451 20.516 -22.500 1.00 26.79 N ATOM 2001 HE ARG B 25 45.393 18.234 -22.168 1.00 0.00 H ATOM 2002 HH12 ARG B 25 42.588 20.891 -20.850 1.00 0.00 H ATOM 2003 HH11 ARG B 25 42.707 19.269 -20.074 1.00 0.00 H ATOM 2004 HH22 ARG B 25 43.997 21.450 -22.566 1.00 0.00 H ATOM 2005 HH21 ARG B 25 45.229 20.270 -23.144 1.00 0.00 H ATOM 2006 H ARG B 25 44.909 14.023 -16.609 1.00 0.00 H ATOM 2007 N PHE B 26 47.348 17.180 -16.636 1.00 23.58 N ATOM 2008 CA PHE B 26 47.703 18.114 -15.576 1.00 16.54 C ATOM 2009 C PHE B 26 47.709 19.533 -16.123 1.00 21.84 C ATOM 2010 O PHE B 26 48.344 19.807 -17.147 1.00 24.12 O ATOM 2011 CB PHE B 26 49.070 17.774 -14.974 1.00 17.03 C ATOM 2012 CG PHE B 26 49.615 18.840 -14.067 1.00 15.69 C ATOM 2013 CD1 PHE B 26 49.115 19.004 -12.786 1.00 20.26 C ATOM 2014 CD2 PHE B 26 50.635 19.676 -14.494 1.00 16.88 C ATOM 2015 CE1 PHE B 26 49.617 19.984 -11.949 1.00 21.11 C ATOM 2016 CE2 PHE B 26 51.141 20.657 -13.662 1.00 22.69 C ATOM 2017 CZ PHE B 26 50.632 20.811 -12.388 1.00 20.55 C ATOM 2018 H PHE B 26 47.965 17.117 -17.471 1.00 0.00 H ATOM 2019 N LEU B 27 47.006 20.428 -15.435 1.00 19.50 N ATOM 2020 CA LEU B 27 46.937 21.838 -15.789 1.00 16.01 C ATOM 2021 C LEU B 27 47.437 22.676 -14.621 1.00 16.16 C ATOM 2022 O LEU B 27 47.074 22.426 -13.467 1.00 13.78 O ATOM 2023 CB LEU B 27 45.503 22.261 -16.151 1.00 20.40 C ATOM 2024 CG LEU B 27 44.902 21.926 -17.523 1.00 23.54 C ATOM 2025 CD1 LEU B 27 45.707 22.568 -18.643 1.00 26.33 C ATOM 2026 CD2 LEU B 27 44.764 20.426 -17.744 1.00 24.70 C ATOM 2027 H LEU B 27 46.478 20.103 -14.600 1.00 0.00 H ATOM 2028 N ASP B 28 48.273 23.666 -14.923 1.00 19.75 N ATOM 2029 CA ASP B 28 48.767 24.623 -13.934 1.00 15.50 C ATOM 2030 C ASP B 28 48.322 26.006 -14.397 1.00 18.87 C ATOM 2031 O ASP B 28 48.964 26.616 -15.256 1.00 20.20 O ATOM 2032 CB ASP B 28 50.284 24.539 -13.786 1.00 14.13 C ATOM 2033 CG ASP B 28 50.788 25.236 -12.537 1.00 19.55 C ATOM 2034 OD1 ASP B 28 50.078 25.202 -11.511 1.00 23.86 O ATOM 2035 OD2 ASP B 28 51.893 25.817 -12.579 1.00 20.81 O ATOM 2036 H ASP B 28 48.590 23.764 -15.909 1.00 0.00 H ATOM 2037 N ARG B 29 47.227 26.500 -13.827 1.00 12.95 N ATOM 2038 CA ARG B 29 46.543 27.683 -14.327 1.00 13.27 C ATOM 2039 C ARG B 29 46.664 28.833 -13.336 1.00 14.10 C ATOM 2040 O ARG B 29 46.538 28.638 -12.124 1.00 17.88 O ATOM 2041 CB ARG B 29 45.071 27.370 -14.592 1.00 15.14 C ATOM 2042 CG ARG B 29 44.852 26.013 -15.242 1.00 12.69 C ATOM 2043 CD ARG B 29 43.377 25.683 -15.340 1.00 11.22 C ATOM 2044 NE ARG B 29 42.675 26.605 -16.224 1.00 15.30 N ATOM 2045 CZ ARG B 29 41.355 26.650 -16.357 1.00 13.38 C ATOM 2046 NH1 ARG B 29 40.589 25.825 -15.657 1.00 8.99 N ATOM 2047 NH2 ARG B 29 40.800 27.522 -17.187 1.00 16.00 N ATOM 2048 HE ARG B 29 43.244 27.270 -16.786 1.00 0.00 H ATOM 2049 HH12 ARG B 29 39.555 25.861 -15.762 1.00 0.00 H ATOM 2050 HH11 ARG B 29 41.022 25.142 -15.003 1.00 0.00 H ATOM 2051 HH22 ARG B 29 39.766 27.556 -17.290 1.00 0.00 H ATOM 2052 HH21 ARG B 29 41.399 28.172 -17.735 1.00 0.00 H ATOM 2053 H ARG B 29 46.843 26.020 -12.988 1.00 0.00 H ATOM 2054 N TYR B 30 46.897 30.034 -13.862 1.00 13.42 N ATOM 2055 CA TYR B 30 47.079 31.235 -13.061 1.00 11.99 C ATOM 2056 C TYR B 30 46.076 32.294 -13.499 1.00 13.60 C ATOM 2057 O TYR B 30 45.855 32.493 -14.698 1.00 13.03 O ATOM 2058 CB TYR B 30 48.512 31.770 -13.187 1.00 13.64 C ATOM 2059 CG TYR B 30 49.560 30.822 -12.644 1.00 13.12 C ATOM 2060 CD1 TYR B 30 49.953 29.702 -13.367 1.00 9.87 C ATOM 2061 CD2 TYR B 30 50.153 31.045 -11.409 1.00 15.74 C ATOM 2062 CE1 TYR B 30 50.904 28.831 -12.874 1.00 14.05 C ATOM 2063 CE2 TYR B 30 51.107 30.180 -10.907 1.00 12.84 C ATOM 2064 CZ TYR B 30 51.478 29.075 -11.645 1.00 15.73 C ATOM 2065 OH TYR B 30 52.426 28.209 -11.153 1.00 17.86 O ATOM 2066 HH TYR B 30 52.572 27.477 -11.804 1.00 0.00 H ATOM 2067 H TYR B 30 46.952 30.118 -14.897 1.00 0.00 H ATOM 2068 N PHE B 31 45.474 32.972 -12.524 1.00 11.81 N ATOM 2069 CA PHE B 31 44.374 33.891 -12.779 1.00 14.63 C ATOM 2070 C PHE B 31 44.613 35.220 -12.078 1.00 15.86 C ATOM 2071 O PHE B 31 45.015 35.256 -10.911 1.00 16.55 O ATOM 2072 CB PHE B 31 43.035 33.310 -12.300 1.00 11.61 C ATOM 2073 CG PHE B 31 42.758 31.922 -12.801 1.00 13.68 C ATOM 2074 CD1 PHE B 31 43.264 30.816 -12.137 1.00 8.66 C ATOM 2075 CD2 PHE B 31 41.976 31.722 -13.925 1.00 17.24 C ATOM 2076 CE1 PHE B 31 43.006 29.539 -12.593 1.00 13.35 C ATOM 2077 CE2 PHE B 31 41.716 30.447 -14.386 1.00 14.44 C ATOM 2078 CZ PHE B 31 42.229 29.354 -13.719 1.00 16.08 C ATOM 2079 H PHE B 31 45.801 32.840 -11.546 1.00 0.00 H ATOM 2080 N TYR B 32 44.360 36.309 -12.797 1.00 12.85 N ATOM 2081 CA TYR B 32 44.259 37.639 -12.213 1.00 17.32 C ATOM 2082 C TYR B 32 42.786 38.018 -12.199 1.00 16.35 C ATOM 2083 O TYR B 32 42.168 38.147 -13.262 1.00 19.13 O ATOM 2084 CB TYR B 32 45.083 38.662 -12.995 1.00 12.29 C ATOM 2085 CG TYR B 32 45.064 40.046 -12.386 1.00 17.92 C ATOM 2086 CD1 TYR B 32 45.680 40.298 -11.168 1.00 17.68 C ATOM 2087 CD2 TYR B 32 44.431 41.101 -13.031 1.00 17.56 C ATOM 2088 CE1 TYR B 32 45.666 41.562 -10.606 1.00 19.82 C ATOM 2089 CE2 TYR B 32 44.412 42.369 -12.478 1.00 17.86 C ATOM 2090 CZ TYR B 32 45.031 42.593 -11.266 1.00 19.29 C ATOM 2091 OH TYR B 32 45.013 43.853 -10.713 1.00 16.13 O ATOM 2092 HH TYR B 32 45.452 44.490 -11.331 1.00 0.00 H ATOM 2093 H TYR B 32 44.228 36.206 -13.823 1.00 0.00 H ATOM 2094 N HIS B 33 42.231 38.184 -10.996 1.00 15.94 N ATOM 2095 CA HIS B 33 40.789 38.290 -10.796 1.00 18.08 C ATOM 2096 C HIS B 33 40.100 37.039 -11.326 1.00 19.32 C ATOM 2097 O HIS B 33 40.265 35.946 -10.773 1.00 16.50 O ATOM 2098 CB HIS B 33 40.214 39.539 -11.474 1.00 16.79 C ATOM 2099 CG HIS B 33 40.859 40.818 -11.041 1.00 21.71 C ATOM 2100 ND1 HIS B 33 41.475 40.965 -9.817 1.00 15.89 N ATOM 2101 CD2 HIS B 33 40.985 42.009 -11.672 1.00 18.55 C ATOM 2102 CE1 HIS B 33 41.952 42.193 -9.712 1.00 20.81 C ATOM 2103 NE2 HIS B 33 41.668 42.847 -10.824 1.00 18.49 N ATOM 2104 H HIS B 33 42.854 38.240 -10.165 1.00 0.00 H ATOM 2105 N GLN B 34 39.342 37.189 -12.409 1.00 18.63 N ATOM 2106 CA GLN B 34 38.586 36.097 -13.007 1.00 18.59 C ATOM 2107 C GLN B 34 39.185 35.632 -14.330 1.00 17.37 C ATOM 2108 O GLN B 34 38.596 34.777 -15.002 1.00 21.33 O ATOM 2109 CB GLN B 34 37.133 36.533 -13.209 1.00 20.70 C ATOM 2110 CG GLN B 34 36.113 35.411 -13.223 1.00 19.99 C ATOM 2111 CD GLN B 34 34.724 35.909 -13.577 1.00 33.87 C ATOM 2112 OE1 GLN B 34 34.464 37.114 -13.575 1.00 25.17 O ATOM 2113 NE2 GLN B 34 33.824 34.983 -13.886 1.00 27.90 N ATOM 2114 HE22 GLN B 34 34.088 33.977 -13.875 1.00 0.00 H ATOM 2115 HE21 GLN B 34 32.855 35.264 -14.139 1.00 0.00 H ATOM 2116 H GLN B 34 39.287 38.130 -12.849 1.00 0.00 H ATOM 2117 N GLU B 35 40.347 36.158 -14.709 1.00 18.16 N ATOM 2118 CA GLU B 35 40.902 35.985 -16.047 1.00 19.18 C ATOM 2119 C GLU B 35 42.184 35.165 -15.987 1.00 17.63 C ATOM 2120 O GLU B 35 43.150 35.560 -15.323 1.00 19.41 O ATOM 2121 CB GLU B 35 41.171 37.345 -16.687 1.00 16.74 C ATOM 2122 CG GLU B 35 42.102 37.310 -17.871 1.00 25.61 C ATOM 2123 CD GLU B 35 43.025 38.518 -17.912 1.00 38.26 C ATOM 2124 OE1 GLU B 35 42.701 39.541 -17.259 1.00 39.88 O ATOM 2125 OE2 GLU B 35 44.086 38.453 -18.583 1.00 36.30 O ATOM 2126 H GLU B 35 40.885 36.719 -14.018 1.00 0.00 H ATOM 2127 N GLU B 36 42.189 34.031 -16.683 1.00 15.48 N ATOM 2128 CA GLU B 36 43.391 33.216 -16.801 1.00 22.41 C ATOM 2129 C GLU B 36 44.386 33.892 -17.736 1.00 18.01 C ATOM 2130 O GLU B 36 44.033 34.277 -18.855 1.00 20.09 O ATOM 2131 CB GLU B 36 43.026 31.826 -17.324 1.00 17.51 C ATOM 2132 CG GLU B 36 44.180 30.840 -17.404 1.00 15.47 C ATOM 2133 CD GLU B 36 43.735 29.472 -17.896 1.00 20.94 C ATOM 2134 OE1 GLU B 36 42.689 29.395 -18.575 1.00 23.75 O ATOM 2135 OE2 GLU B 36 44.426 28.474 -17.600 1.00 16.34 O ATOM 2136 H GLU B 36 41.315 33.719 -17.153 1.00 0.00 H ATOM 2137 N TYR B 37 45.635 34.044 -17.283 1.00 17.17 N ATOM 2138 CA TYR B 37 46.644 34.720 -18.087 1.00 18.11 C ATOM 2139 C TYR B 37 47.810 33.842 -18.523 1.00 16.29 C ATOM 2140 O TYR B 37 48.510 34.217 -19.469 1.00 19.98 O ATOM 2141 CB TYR B 37 47.192 35.958 -17.353 1.00 18.07 C ATOM 2142 CG TYR B 37 47.847 35.713 -16.008 1.00 18.05 C ATOM 2143 CD1 TYR B 37 49.205 35.433 -15.915 1.00 16.80 C ATOM 2144 CD2 TYR B 37 47.116 35.807 -14.829 1.00 14.23 C ATOM 2145 CE1 TYR B 37 49.811 35.227 -14.688 1.00 16.95 C ATOM 2146 CE2 TYR B 37 47.715 35.603 -13.597 1.00 14.82 C ATOM 2147 CZ TYR B 37 49.062 35.314 -13.533 1.00 18.10 C ATOM 2148 OH TYR B 37 49.664 35.110 -12.312 1.00 15.18 O ATOM 2149 HH TYR B 37 50.625 34.915 -12.448 1.00 0.00 H ATOM 2150 H TYR B 37 45.889 33.675 -16.345 1.00 0.00 H ATOM 2151 N VAL B 38 48.034 32.693 -17.886 1.00 14.61 N ATOM 2152 CA VAL B 38 49.064 31.760 -18.333 1.00 15.88 C ATOM 2153 C VAL B 38 48.725 30.389 -17.771 1.00 16.48 C ATOM 2154 O VAL B 38 48.109 30.274 -16.707 1.00 17.96 O ATOM 2155 CB VAL B 38 50.480 32.230 -17.908 1.00 14.36 C ATOM 2156 CG1 VAL B 38 50.655 32.132 -16.401 1.00 14.66 C ATOM 2157 CG2 VAL B 38 51.556 31.436 -18.638 1.00 13.69 C ATOM 2158 H VAL B 38 47.462 32.455 -17.051 1.00 0.00 H ATOM 2159 N ARG B 39 49.114 29.342 -18.497 1.00 12.50 N ATOM 2160 CA ARG B 39 48.829 27.985 -18.059 1.00 15.28 C ATOM 2161 C ARG B 39 49.911 27.034 -18.548 1.00 17.81 C ATOM 2162 O ARG B 39 50.504 27.230 -19.612 1.00 17.57 O ATOM 2163 CB ARG B 39 47.460 27.500 -18.553 1.00 17.23 C ATOM 2164 CG ARG B 39 47.400 27.216 -20.047 1.00 25.58 C ATOM 2165 CD ARG B 39 46.277 26.247 -20.388 1.00 26.67 C ATOM 2166 NE ARG B 39 44.962 26.785 -20.055 1.00 26.63 N ATOM 2167 CZ ARG B 39 43.817 26.148 -20.280 1.00 26.41 C ATOM 2168 NH1 ARG B 39 43.823 24.946 -20.840 1.00 30.52 N ATOM 2169 NH2 ARG B 39 42.666 26.714 -19.945 1.00 28.01 N ATOM 2170 HE ARG B 39 44.918 27.726 -19.614 1.00 0.00 H ATOM 2171 HH12 ARG B 39 42.926 24.449 -21.015 1.00 0.00 H ATOM 2172 HH11 ARG B 39 44.725 24.500 -21.104 1.00 0.00 H ATOM 2173 HH22 ARG B 39 41.771 26.215 -20.121 1.00 0.00 H ATOM 2174 HH21 ARG B 39 42.658 27.657 -19.506 1.00 0.00 H ATOM 2175 H ARG B 39 49.628 29.497 -19.388 1.00 0.00 H ATOM 2176 N PHE B 40 50.166 26.007 -17.744 1.00 20.48 N ATOM 2177 CA PHE B 40 50.922 24.837 -18.162 1.00 15.33 C ATOM 2178 C PHE B 40 49.945 23.702 -18.427 1.00 22.28 C ATOM 2179 O PHE B 40 49.016 23.476 -17.646 1.00 18.83 O ATOM 2180 CB PHE B 40 51.939 24.418 -17.094 1.00 17.93 C ATOM 2181 CG PHE B 40 52.732 23.186 -17.453 1.00 18.72 C ATOM 2182 CD1 PHE B 40 53.961 23.297 -18.081 1.00 20.14 C ATOM 2183 CD2 PHE B 40 52.252 21.919 -17.153 1.00 17.17 C ATOM 2184 CE1 PHE B 40 54.693 22.169 -18.409 1.00 14.05 C ATOM 2185 CE2 PHE B 40 52.978 20.789 -17.482 1.00 18.94 C ATOM 2186 CZ PHE B 40 54.200 20.914 -18.111 1.00 16.24 C ATOM 2187 H PHE B 40 49.807 26.042 -16.768 1.00 0.00 H ATOM 2188 N ASP B 41 50.153 22.993 -19.532 1.00 22.27 N ATOM 2189 CA ASP B 41 49.316 21.856 -19.891 1.00 18.11 C ATOM 2190 C ASP B 41 50.219 20.687 -20.247 1.00 23.20 C ATOM 2191 O ASP B 41 51.056 20.800 -21.149 1.00 22.85 O ATOM 2192 CB ASP B 41 48.384 22.199 -21.057 1.00 23.52 C ATOM 2193 CG ASP B 41 47.422 21.075 -21.383 1.00 29.17 C ATOM 2194 OD1 ASP B 41 46.720 21.172 -22.411 1.00 29.29 O ATOM 2195 OD2 ASP B 41 47.370 20.091 -20.614 1.00 33.10 O ATOM 2196 H ASP B 41 50.938 23.258 -20.160 1.00 0.00 H ATOM 2197 N SER B 42 50.045 19.566 -19.540 1.00 22.19 N ATOM 2198 CA SER B 42 50.874 18.389 -19.773 1.00 19.60 C ATOM 2199 C SER B 42 50.783 17.888 -21.208 1.00 23.95 C ATOM 2200 O SER B 42 51.689 17.182 -21.665 1.00 22.98 O ATOM 2201 CB SER B 42 50.484 17.273 -18.801 1.00 20.21 C ATOM 2202 OG SER B 42 49.103 16.971 -18.897 1.00 20.96 O ATOM 2203 HG SER B 42 48.894 16.676 -19.819 1.00 0.00 H ATOM 2204 H SER B 42 49.305 19.533 -18.810 1.00 0.00 H ATOM 2205 N ASP B 43 49.716 18.237 -21.930 1.00 19.83 N ATOM 2206 CA ASP B 43 49.635 17.913 -23.349 1.00 19.88 C ATOM 2207 C ASP B 43 50.650 18.688 -24.178 1.00 19.81 C ATOM 2208 O ASP B 43 50.928 18.298 -25.316 1.00 20.50 O ATOM 2209 CB ASP B 43 48.224 18.187 -23.874 1.00 20.25 C ATOM 2210 CG ASP B 43 47.211 17.168 -23.389 1.00 28.97 C ATOM 2211 OD1 ASP B 43 47.554 16.355 -22.504 1.00 28.92 O ATOM 2212 OD2 ASP B 43 46.068 17.184 -23.892 1.00 25.66 O ATOM 2213 H ASP B 43 48.932 18.747 -21.474 1.00 0.00 H ATOM 2214 N VAL B 44 51.205 19.770 -23.640 1.00 18.07 N ATOM 2215 CA VAL B 44 52.156 20.616 -24.350 1.00 18.83 C ATOM 2216 C VAL B 44 53.567 20.453 -23.795 1.00 19.08 C ATOM 2217 O VAL B 44 54.527 20.303 -24.551 1.00 19.45 O ATOM 2218 CB VAL B 44 51.713 22.097 -24.311 1.00 20.45 C ATOM 2219 CG1 VAL B 44 52.798 22.994 -24.887 1.00 17.10 C ATOM 2220 CG2 VAL B 44 50.408 22.280 -25.068 1.00 18.19 C ATOM 2221 H VAL B 44 50.948 20.025 -22.665 1.00 0.00 H ATOM 2222 N GLY B 45 53.709 20.476 -22.472 1.00 19.58 N ATOM 2223 CA GLY B 45 55.007 20.381 -21.841 1.00 16.97 C ATOM 2224 C GLY B 45 55.670 21.706 -21.538 1.00 19.72 C ATOM 2225 O GLY B 45 56.807 21.712 -21.050 1.00 22.65 O ATOM 2226 H GLY B 45 52.862 20.565 -21.875 1.00 0.00 H ATOM 2227 N GLU B 46 55.001 22.825 -21.810 1.00 17.00 N ATOM 2228 CA GLU B 46 55.535 24.146 -21.519 1.00 16.20 C ATOM 2229 C GLU B 46 54.389 25.059 -21.108 1.00 16.49 C ATOM 2230 O GLU B 46 53.212 24.726 -21.268 1.00 14.42 O ATOM 2231 CB GLU B 46 56.279 24.736 -22.723 1.00 21.22 C ATOM 2232 CG GLU B 46 57.660 24.155 -22.972 1.00 25.20 C ATOM 2233 CD GLU B 46 58.340 24.779 -24.176 1.00 36.53 C ATOM 2234 OE1 GLU B 46 57.675 25.549 -24.902 1.00 27.09 O ATOM 2235 OE2 GLU B 46 59.538 24.503 -24.396 1.00 43.55 O ATOM 2236 H GLU B 46 54.060 22.751 -22.247 1.00 0.00 H ATOM 2237 N TYR B 47 54.749 26.224 -20.575 1.00 19.79 N ATOM 2238 CA TYR B 47 53.762 27.244 -20.255 1.00 14.79 C ATOM 2239 C TYR B 47 53.380 28.020 -21.508 1.00 15.95 C ATOM 2240 O TYR B 47 54.224 28.301 -22.364 1.00 20.78 O ATOM 2241 CB TYR B 47 54.302 28.205 -19.195 1.00 16.36 C ATOM 2242 CG TYR B 47 54.266 27.662 -17.784 1.00 13.70 C ATOM 2243 CD1 TYR B 47 55.343 26.958 -17.262 1.00 15.90 C ATOM 2244 CD2 TYR B 47 53.157 27.860 -16.973 1.00 14.17 C ATOM 2245 CE1 TYR B 47 55.315 26.464 -15.971 1.00 16.35 C ATOM 2246 CE2 TYR B 47 53.119 27.371 -15.681 1.00 15.09 C ATOM 2247 CZ TYR B 47 54.201 26.673 -15.186 1.00 17.00 C ATOM 2248 OH TYR B 47 54.167 26.183 -13.901 1.00 15.96 O ATOM 2249 HH TYR B 47 53.409 25.552 -13.809 1.00 0.00 H ATOM 2250 H TYR B 47 55.754 26.409 -20.384 1.00 0.00 H ATOM 2251 N ARG B 48 52.099 28.361 -21.613 1.00 19.89 N ATOM 2252 CA ARG B 48 51.580 29.141 -22.728 1.00 14.65 C ATOM 2253 C ARG B 48 50.731 30.276 -22.182 1.00 17.11 C ATOM 2254 O ARG B 48 49.852 30.050 -21.344 1.00 21.63 O ATOM 2255 CB ARG B 48 50.757 28.272 -23.686 1.00 12.51 C ATOM 2256 CG ARG B 48 51.577 27.246 -24.446 1.00 22.60 C ATOM 2257 CD ARG B 48 52.495 27.916 -25.454 1.00 23.83 C ATOM 2258 NE ARG B 48 53.717 27.148 -25.676 1.00 35.65 N ATOM 2259 CZ ARG B 48 53.839 26.177 -26.574 1.00 37.07 C ATOM 2260 NH1 ARG B 48 52.809 25.846 -27.342 1.00 39.27 N ATOM 2261 NH2 ARG B 48 54.992 25.534 -26.703 1.00 30.48 N ATOM 2262 HE ARG B 48 54.547 27.376 -25.092 1.00 0.00 H ATOM 2263 HH12 ARG B 48 52.907 25.085 -28.044 1.00 0.00 H ATOM 2264 HH11 ARG B 48 51.903 26.347 -27.242 1.00 0.00 H ATOM 2265 HH22 ARG B 48 55.088 24.774 -27.406 1.00 0.00 H ATOM 2266 HH21 ARG B 48 55.800 25.790 -26.101 1.00 0.00 H ATOM 2267 H ARG B 48 51.440 28.058 -20.868 1.00 0.00 H ATOM 2268 N ALA B 49 50.998 31.491 -22.651 1.00 18.79 N ATOM 2269 CA ALA B 49 50.226 32.644 -22.215 1.00 17.91 C ATOM 2270 C ALA B 49 48.808 32.565 -22.765 1.00 18.11 C ATOM 2271 O ALA B 49 48.606 32.411 -23.974 1.00 21.01 O ATOM 2272 CB ALA B 49 50.900 33.937 -22.669 1.00 14.51 C ATOM 2273 H ALA B 49 51.768 31.619 -23.338 1.00 0.00 H ATOM 2274 N VAL B 50 47.823 32.662 -21.873 1.00 20.72 N ATOM 2275 CA VAL B 50 46.431 32.669 -22.307 1.00 18.07 C ATOM 2276 C VAL B 50 46.033 34.054 -22.800 1.00 20.67 C ATOM 2277 O VAL B 50 45.340 34.191 -23.814 1.00 23.57 O ATOM 2278 CB VAL B 50 45.519 32.180 -21.167 1.00 17.88 C ATOM 2279 CG1 VAL B 50 44.058 32.251 -21.584 1.00 17.54 C ATOM 2280 CG2 VAL B 50 45.894 30.761 -20.766 1.00 12.78 C ATOM 2281 H VAL B 50 48.049 32.733 -20.860 1.00 0.00 H ATOM 2282 N THR B 51 46.465 35.098 -22.099 1.00 21.61 N ATOM 2283 CA THR B 51 46.289 36.476 -22.527 1.00 17.96 C ATOM 2284 C THR B 51 47.650 37.157 -22.592 1.00 23.34 C ATOM 2285 O THR B 51 48.661 36.624 -22.126 1.00 21.50 O ATOM 2286 CB THR B 51 45.354 37.243 -21.581 1.00 20.83 C ATOM 2287 OG1 THR B 51 45.920 37.273 -20.265 1.00 28.55 O ATOM 2288 CG2 THR B 51 43.984 36.580 -21.525 1.00 14.84 C ATOM 2289 HG1 THR B 51 45.315 37.768 -19.658 1.00 0.00 H ATOM 2290 H THR B 51 46.954 34.920 -21.199 1.00 0.00 H ATOM 2291 N GLU B 52 47.668 38.356 -23.180 1.00 20.13 N ATOM 2292 CA GLU B 52 48.907 39.120 -23.275 1.00 21.63 C ATOM 2293 C GLU B 52 49.474 39.466 -21.905 1.00 24.60 C ATOM 2294 O GLU B 52 50.673 39.746 -21.793 1.00 22.53 O ATOM 2295 CB GLU B 52 48.677 40.399 -24.081 1.00 23.08 C ATOM 2296 H GLU B 52 46.790 38.749 -23.574 1.00 0.00 H ATOM 2297 N LEU B 53 48.640 39.446 -20.863 1.00 19.09 N ATOM 2298 CA LEU B 53 49.114 39.747 -19.518 1.00 15.30 C ATOM 2299 C LEU B 53 50.105 38.701 -19.022 1.00 20.24 C ATOM 2300 O LEU B 53 51.008 39.023 -18.243 1.00 20.27 O ATOM 2301 CB LEU B 53 47.923 39.849 -18.565 1.00 16.32 C ATOM 2302 CG LEU B 53 48.098 40.638 -17.268 1.00 24.42 C ATOM 2303 CD1 LEU B 53 48.397 42.099 -17.564 1.00 29.05 C ATOM 2304 CD2 LEU B 53 46.856 40.507 -16.399 1.00 21.32 C ATOM 2305 H LEU B 53 47.638 39.212 -21.013 1.00 0.00 H ATOM 2306 N GLY B 54 49.962 37.454 -19.461 1.00 19.60 N ATOM 2307 CA GLY B 54 50.790 36.365 -18.986 1.00 15.90 C ATOM 2308 C GLY B 54 51.951 35.974 -19.873 1.00 17.96 C ATOM 2309 O GLY B 54 52.552 34.918 -19.642 1.00 18.46 O ATOM 2310 H GLY B 54 49.229 37.254 -20.171 1.00 0.00 H ATOM 2311 N ARG B 55 52.292 36.780 -20.877 1.00 24.45 N ATOM 2312 CA ARG B 55 53.412 36.459 -21.754 1.00 20.51 C ATOM 2313 C ARG B 55 54.766 36.546 -21.050 1.00 23.01 C ATOM 2314 O ARG B 55 55.626 35.691 -21.297 1.00 33.82 O ATOM 2315 CB ARG B 55 53.405 37.358 -22.994 1.00 21.14 C ATOM 2316 CG ARG B 55 52.288 37.033 -23.971 1.00 32.30 C ATOM 2317 CD ARG B 55 52.674 37.361 -25.404 1.00 31.74 C ATOM 2318 NE ARG B 55 51.832 38.409 -25.968 1.00 32.60 N ATOM 2319 CZ ARG B 55 50.632 38.196 -26.498 1.00 39.99 C ATOM 2320 NH1 ARG B 55 50.128 36.969 -26.533 1.00 34.66 N ATOM 2321 NH2 ARG B 55 49.933 39.210 -26.990 1.00 36.78 N ATOM 2322 HE ARG B 55 52.193 39.384 -25.955 1.00 0.00 H ATOM 2323 HH12 ARG B 55 49.189 36.804 -26.948 1.00 0.00 H ATOM 2324 HH11 ARG B 55 50.672 36.172 -26.145 1.00 0.00 H ATOM 2325 HH22 ARG B 55 48.994 39.042 -27.404 1.00 0.00 H ATOM 2326 HH21 ARG B 55 50.324 40.173 -26.961 1.00 0.00 H ATOM 2327 H ARG B 55 51.750 37.653 -21.038 1.00 0.00 H ATOM 2328 N PRO B 56 55.021 37.545 -20.189 1.00 24.70 N ATOM 2329 CA PRO B 56 56.305 37.540 -19.466 1.00 17.97 C ATOM 2330 C PRO B 56 56.514 36.295 -18.622 1.00 20.76 C ATOM 2331 O PRO B 56 57.633 35.770 -18.565 1.00 25.36 O ATOM 2332 CB PRO B 56 56.227 38.806 -18.602 1.00 21.44 C ATOM 2333 CG PRO B 56 55.297 39.696 -19.331 1.00 21.15 C ATOM 2334 CD PRO B 56 54.269 38.789 -19.932 1.00 19.20 C ATOM 2335 N ASP B 57 55.461 35.799 -17.968 1.00 20.73 N ATOM 2336 CA ASP B 57 55.607 34.612 -17.133 1.00 20.38 C ATOM 2337 C ASP B 57 55.816 33.357 -17.968 1.00 22.34 C ATOM 2338 O ASP B 57 56.508 32.432 -17.527 1.00 20.15 O ATOM 2339 CB ASP B 57 54.385 34.451 -16.230 1.00 20.91 C ATOM 2340 CG ASP B 57 54.154 35.659 -15.343 1.00 26.55 C ATOM 2341 OD1 ASP B 57 55.148 36.288 -14.920 1.00 22.98 O ATOM 2342 OD2 ASP B 57 52.978 35.982 -15.073 1.00 27.68 O ATOM 2343 H ASP B 57 54.533 36.261 -18.054 1.00 0.00 H ATOM 2344 N ALA B 58 55.232 33.302 -19.166 1.00 20.48 N ATOM 2345 CA ALA B 58 55.418 32.137 -20.025 1.00 19.66 C ATOM 2346 C ALA B 58 56.871 32.009 -20.466 1.00 18.49 C ATOM 2347 O ALA B 58 57.473 30.936 -20.353 1.00 17.60 O ATOM 2348 CB ALA B 58 54.491 32.224 -21.237 1.00 20.81 C ATOM 2349 H ALA B 58 54.641 34.094 -19.490 1.00 0.00 H ATOM 2350 N GLU B 59 57.455 33.102 -20.963 1.00 21.91 N ATOM 2351 CA GLU B 59 58.843 33.062 -21.410 1.00 19.30 C ATOM 2352 C GLU B 59 59.805 32.919 -20.235 1.00 17.47 C ATOM 2353 O GLU B 59 60.822 32.226 -20.343 1.00 20.49 O ATOM 2354 CB GLU B 59 59.165 34.316 -22.220 1.00 29.40 C ATOM 2355 CG GLU B 59 58.470 34.364 -23.566 1.00 47.60 C ATOM 2356 CD GLU B 59 58.009 35.762 -23.945 1.00 52.97 C ATOM 2357 OE1 GLU B 59 57.616 35.969 -25.117 1.00 48.04 O ATOM 2358 OE2 GLU B 59 58.039 36.665 -23.070 1.00 50.78 O ATOM 2359 H GLU B 59 56.916 33.989 -21.032 1.00 0.00 H ATOM 2360 N TYR B 60 59.493 33.549 -19.100 1.00 19.73 N ATOM 2361 CA TYR B 60 60.357 33.436 -17.928 1.00 16.27 C ATOM 2362 C TYR B 60 60.366 32.011 -17.388 1.00 21.24 C ATOM 2363 O TYR B 60 61.430 31.453 -17.095 1.00 23.74 O ATOM 2364 CB TYR B 60 59.906 34.423 -16.852 1.00 16.72 C ATOM 2365 CG TYR B 60 60.723 34.382 -15.580 1.00 21.20 C ATOM 2366 CD1 TYR B 60 62.088 34.633 -15.599 1.00 21.54 C ATOM 2367 CD2 TYR B 60 60.124 34.110 -14.356 1.00 18.23 C ATOM 2368 CE1 TYR B 60 62.838 34.602 -14.438 1.00 14.48 C ATOM 2369 CE2 TYR B 60 60.864 34.078 -13.188 1.00 21.52 C ATOM 2370 CZ TYR B 60 62.221 34.324 -13.235 1.00 24.23 C ATOM 2371 OH TYR B 60 62.961 34.292 -12.075 1.00 21.04 O ATOM 2372 HH TYR B 60 63.909 34.488 -12.284 1.00 0.00 H ATOM 2373 H TYR B 60 58.628 34.125 -19.050 1.00 0.00 H ATOM 2374 N TRP B 61 59.186 31.400 -17.257 1.00 19.11 N ATOM 2375 CA TRP B 61 59.112 30.057 -16.694 1.00 14.01 C ATOM 2376 C TRP B 61 59.606 29.002 -17.675 1.00 15.35 C ATOM 2377 O TRP B 61 60.211 28.008 -17.257 1.00 20.66 O ATOM 2378 CB TRP B 61 57.682 29.752 -16.251 1.00 15.74 C ATOM 2379 CG TRP B 61 57.218 30.627 -15.127 1.00 19.24 C ATOM 2380 CD1 TRP B 61 58.001 31.359 -14.282 1.00 19.60 C ATOM 2381 CD2 TRP B 61 55.863 30.871 -14.730 1.00 16.85 C ATOM 2382 NE1 TRP B 61 57.218 32.038 -13.380 1.00 17.57 N ATOM 2383 CE2 TRP B 61 55.902 31.757 -13.635 1.00 20.41 C ATOM 2384 CE3 TRP B 61 54.621 30.426 -15.194 1.00 17.45 C ATOM 2385 CZ2 TRP B 61 54.747 32.205 -12.995 1.00 16.75 C ATOM 2386 CZ3 TRP B 61 53.476 30.871 -14.557 1.00 15.21 C ATOM 2387 CH2 TRP B 61 53.547 31.751 -13.470 1.00 16.33 C ATOM 2388 HE1 TRP B 61 57.568 32.664 -12.626 1.00 0.00 H ATOM 2389 H TRP B 61 58.316 31.884 -17.558 1.00 0.00 H ATOM 2390 N ASN B 62 59.369 29.194 -18.975 1.00 18.35 N ATOM 2391 CA ASN B 62 59.861 28.239 -19.962 1.00 18.30 C ATOM 2392 C ASN B 62 61.376 28.276 -20.111 1.00 22.41 C ATOM 2393 O ASN B 62 61.942 27.357 -20.713 1.00 24.85 O ATOM 2394 CB ASN B 62 59.201 28.484 -21.321 1.00 16.98 C ATOM 2395 CG ASN B 62 57.745 28.057 -21.347 1.00 19.80 C ATOM 2396 OD1 ASN B 62 57.307 27.252 -20.526 1.00 19.08 O ATOM 2397 ND2 ASN B 62 56.988 28.593 -22.297 1.00 16.96 N ATOM 2398 HD22 ASN B 62 57.400 29.270 -22.970 1.00 0.00 H ATOM 2399 HD21 ASN B 62 55.983 28.336 -22.368 1.00 0.00 H ATOM 2400 H ASN B 62 58.831 30.028 -19.285 1.00 0.00 H ATOM 2401 N SER B 63 62.043 29.306 -19.588 1.00 18.84 N ATOM 2402 CA SER B 63 63.499 29.342 -19.582 1.00 19.73 C ATOM 2403 C SER B 63 64.100 28.584 -18.407 1.00 23.50 C ATOM 2404 O SER B 63 65.318 28.378 -18.380 1.00 22.26 O ATOM 2405 CB SER B 63 63.993 30.792 -19.561 1.00 20.25 C ATOM 2406 OG SER B 63 63.804 31.379 -18.285 1.00 23.64 O ATOM 2407 HG SER B 63 62.840 31.370 -18.058 1.00 0.00 H ATOM 2408 H SER B 63 61.512 30.100 -19.176 1.00 0.00 H ATOM 2409 N GLN B 64 63.282 28.167 -17.442 1.00 23.70 N ATOM 2410 CA GLN B 64 63.742 27.417 -16.276 1.00 21.37 C ATOM 2411 C GLN B 64 63.402 25.949 -16.505 1.00 24.59 C ATOM 2412 O GLN B 64 62.258 25.527 -16.317 1.00 27.85 O ATOM 2413 CB GLN B 64 63.098 27.953 -15.002 1.00 17.12 C ATOM 2414 CG GLN B 64 63.253 29.453 -14.825 1.00 19.15 C ATOM 2415 CD GLN B 64 62.401 29.999 -13.699 1.00 24.37 C ATOM 2416 OE1 GLN B 64 62.315 29.405 -12.624 1.00 20.54 O ATOM 2417 NE2 GLN B 64 61.758 31.134 -13.943 1.00 28.84 N ATOM 2418 HE22 GLN B 64 61.860 31.601 -14.866 1.00 0.00 H ATOM 2419 HE21 GLN B 64 61.152 31.556 -13.211 1.00 0.00 H ATOM 2420 H GLN B 64 62.268 28.386 -17.522 1.00 0.00 H ATOM 2421 N LYS B 65 64.405 25.169 -16.916 1.00 26.13 N ATOM 2422 CA LYS B 65 64.165 23.768 -17.249 1.00 26.83 C ATOM 2423 C LYS B 65 63.860 22.933 -16.013 1.00 25.14 C ATOM 2424 O LYS B 65 63.082 21.976 -16.094 1.00 22.59 O ATOM 2425 CB LYS B 65 65.367 23.195 -17.995 1.00 29.11 C ATOM 2426 CG LYS B 65 65.622 23.867 -19.330 1.00 42.59 C ATOM 2427 CD LYS B 65 64.532 23.537 -20.331 1.00 38.68 C ATOM 2428 CE LYS B 65 64.078 24.781 -21.074 1.00 35.80 C ATOM 2429 NZ LYS B 65 63.138 24.447 -22.178 1.00 48.73 N ATOM 2430 HZ1 LYS B 65 63.611 23.814 -22.854 1.00 0.00 H ATOM 2431 HZ2 LYS B 65 62.299 23.973 -21.786 1.00 0.00 H ATOM 2432 HZ3 LYS B 65 62.850 25.321 -22.662 1.00 0.00 H ATOM 2433 H LYS B 65 65.364 25.562 -16.999 1.00 0.00 H ATOM 2434 N ASP B 66 64.464 23.268 -14.870 1.00 23.09 N ATOM 2435 CA ASP B 66 64.142 22.560 -13.637 1.00 23.20 C ATOM 2436 C ASP B 66 62.673 22.735 -13.277 1.00 26.23 C ATOM 2437 O ASP B 66 62.014 21.783 -12.844 1.00 25.46 O ATOM 2438 CB ASP B 66 65.043 23.045 -12.501 1.00 29.52 C ATOM 2439 CG ASP B 66 65.046 24.556 -12.364 1.00 36.77 C ATOM 2440 OD1 ASP B 66 64.816 25.246 -13.379 1.00 33.43 O ATOM 2441 OD2 ASP B 66 65.280 25.052 -11.242 1.00 41.20 O ATOM 2442 H ASP B 66 65.166 24.036 -14.859 1.00 0.00 H ATOM 2443 N LEU B 67 62.139 23.945 -13.460 1.00 25.65 N ATOM 2444 CA LEU B 67 60.714 24.165 -13.241 1.00 19.62 C ATOM 2445 C LEU B 67 59.877 23.386 -14.248 1.00 21.67 C ATOM 2446 O LEU B 67 58.861 22.781 -13.883 1.00 21.23 O ATOM 2447 CB LEU B 67 60.395 25.658 -13.318 1.00 19.59 C ATOM 2448 CG LEU B 67 58.918 26.048 -13.236 1.00 26.11 C ATOM 2449 CD1 LEU B 67 58.338 25.697 -11.875 1.00 22.62 C ATOM 2450 CD2 LEU B 67 58.734 27.528 -13.536 1.00 22.33 C ATOM 2451 H LEU B 67 62.743 24.736 -13.761 1.00 0.00 H ATOM 2452 N LEU B 68 60.290 23.384 -15.519 1.00 25.18 N ATOM 2453 CA LEU B 68 59.544 22.650 -16.537 1.00 23.98 C ATOM 2454 C LEU B 68 59.593 21.149 -16.285 1.00 25.82 C ATOM 2455 O LEU B 68 58.588 20.451 -16.467 1.00 24.72 O ATOM 2456 CB LEU B 68 60.084 22.978 -17.928 1.00 22.13 C ATOM 2457 CG LEU B 68 59.833 24.393 -18.452 1.00 21.24 C ATOM 2458 CD1 LEU B 68 60.121 24.470 -19.942 1.00 22.98 C ATOM 2459 CD2 LEU B 68 58.408 24.836 -18.155 1.00 20.07 C ATOM 2460 H LEU B 68 61.148 23.908 -15.785 1.00 0.00 H ATOM 2461 N GLU B 69 60.752 20.632 -15.868 1.00 19.39 N ATOM 2462 CA GLU B 69 60.854 19.209 -15.561 1.00 20.51 C ATOM 2463 C GLU B 69 59.969 18.828 -14.381 1.00 24.02 C ATOM 2464 O GLU B 69 59.487 17.692 -14.309 1.00 26.66 O ATOM 2465 CB GLU B 69 62.310 18.834 -15.281 1.00 12.87 C ATOM 2466 H GLU B 69 61.585 21.246 -15.762 1.00 0.00 H ATOM 2467 N GLN B 70 59.745 19.759 -13.450 1.00 26.27 N ATOM 2468 CA GLN B 70 58.819 19.500 -12.352 1.00 23.62 C ATOM 2469 C GLN B 70 57.385 19.393 -12.854 1.00 19.74 C ATOM 2470 O GLN B 70 56.637 18.504 -12.431 1.00 19.46 O ATOM 2471 CB GLN B 70 58.929 20.604 -11.299 1.00 22.86 C ATOM 2472 CG GLN B 70 60.229 20.611 -10.518 1.00 22.30 C ATOM 2473 CD GLN B 70 60.099 19.945 -9.164 1.00 37.45 C ATOM 2474 OE1 GLN B 70 59.106 19.275 -8.881 1.00 37.32 O ATOM 2475 NE2 GLN B 70 61.103 20.131 -8.315 1.00 49.67 N ATOM 2476 HE22 GLN B 70 61.923 20.705 -8.597 1.00 0.00 H ATOM 2477 HE21 GLN B 70 61.069 19.702 -7.368 1.00 0.00 H ATOM 2478 H GLN B 70 60.234 20.675 -13.508 1.00 0.00 H ATOM 2479 N LYS B 71 56.986 20.290 -13.758 1.00 19.19 N ATOM 2480 CA LYS B 71 55.608 20.298 -14.235 1.00 22.97 C ATOM 2481 C LYS B 71 55.328 19.136 -15.179 1.00 19.44 C ATOM 2482 O LYS B 71 54.198 18.635 -15.223 1.00 23.38 O ATOM 2483 CB LYS B 71 55.302 21.630 -14.919 1.00 19.76 C ATOM 2484 CG LYS B 71 55.457 22.837 -14.011 1.00 19.50 C ATOM 2485 CD LYS B 71 54.415 22.824 -12.908 1.00 20.17 C ATOM 2486 CE LYS B 71 54.761 23.809 -11.806 1.00 17.59 C ATOM 2487 NZ LYS B 71 53.665 23.922 -10.805 1.00 22.26 N ATOM 2488 HZ1 LYS B 71 52.798 24.249 -11.277 1.00 0.00 H ATOM 2489 HZ2 LYS B 71 53.495 22.992 -10.372 1.00 0.00 H ATOM 2490 HZ3 LYS B 71 53.939 24.604 -10.069 1.00 0.00 H ATOM 2491 H LYS B 71 57.663 20.989 -14.125 1.00 0.00 H ATOM 2492 N ARG B 72 56.333 18.694 -15.938 1.00 17.57 N ATOM 2493 CA ARG B 72 56.149 17.546 -16.818 1.00 18.71 C ATOM 2494 C ARG B 72 56.006 16.243 -16.044 1.00 18.58 C ATOM 2495 O ARG B 72 55.425 15.286 -16.568 1.00 16.23 O ATOM 2496 CB ARG B 72 57.316 17.449 -17.803 1.00 17.44 C ATOM 2497 CG ARG B 72 57.360 18.587 -18.808 1.00 18.59 C ATOM 2498 CD ARG B 72 58.719 18.696 -19.476 1.00 16.78 C ATOM 2499 NE ARG B 72 58.786 19.848 -20.370 1.00 22.89 N ATOM 2500 CZ ARG B 72 59.902 20.293 -20.936 1.00 27.28 C ATOM 2501 NH1 ARG B 72 61.057 19.685 -20.700 1.00 28.71 N ATOM 2502 NH2 ARG B 72 59.866 21.351 -21.735 1.00 24.54 N ATOM 2503 HE ARG B 72 57.901 20.354 -20.577 1.00 0.00 H ATOM 2504 HH12 ARG B 72 61.929 20.035 -21.144 1.00 0.00 H ATOM 2505 HH11 ARG B 72 61.090 18.858 -20.070 1.00 0.00 H ATOM 2506 HH22 ARG B 72 60.741 21.698 -22.178 1.00 0.00 H ATOM 2507 HH21 ARG B 72 58.963 21.833 -21.919 1.00 0.00 H ATOM 2508 H ARG B 72 57.256 19.173 -15.901 1.00 0.00 H ATOM 2509 N ALA B 73 56.514 16.185 -14.816 1.00 13.20 N ATOM 2510 CA ALA B 73 56.398 15.002 -13.976 1.00 17.79 C ATOM 2511 C ALA B 73 55.188 15.046 -13.052 1.00 19.41 C ATOM 2512 O ALA B 73 54.980 14.099 -12.286 1.00 22.14 O ATOM 2513 CB ALA B 73 57.671 14.822 -13.143 1.00 19.25 C ATOM 2514 H ALA B 73 57.013 17.017 -14.442 1.00 0.00 H ATOM 2515 N ALA B 74 54.385 16.112 -13.112 1.00 20.74 N ATOM 2516 CA ALA B 74 53.282 16.267 -12.169 1.00 17.74 C ATOM 2517 C ALA B 74 52.221 15.188 -12.346 1.00 16.76 C ATOM 2518 O ALA B 74 51.571 14.797 -11.371 1.00 17.52 O ATOM 2519 CB ALA B 74 52.656 17.654 -12.318 1.00 17.35 C ATOM 2520 H ALA B 74 54.548 16.839 -13.838 1.00 0.00 H ATOM 2521 N VAL B 75 52.029 14.696 -13.573 1.00 18.87 N ATOM 2522 CA VAL B 75 51.030 13.655 -13.800 1.00 22.24 C ATOM 2523 C VAL B 75 51.375 12.390 -13.027 1.00 27.72 C ATOM 2524 O VAL B 75 50.483 11.613 -12.663 1.00 24.93 O ATOM 2525 CB VAL B 75 50.882 13.368 -15.308 1.00 21.96 C ATOM 2526 CG1 VAL B 75 50.037 14.442 -15.972 1.00 19.82 C ATOM 2527 CG2 VAL B 75 52.249 13.277 -15.968 1.00 20.64 C ATOM 2528 H VAL B 75 52.593 15.056 -14.369 1.00 0.00 H ATOM 2529 N ASP B 76 52.660 12.163 -12.754 1.00 20.71 N ATOM 2530 CA ASP B 76 53.087 10.989 -11.998 1.00 21.96 C ATOM 2531 C ASP B 76 53.241 11.299 -10.510 1.00 24.87 C ATOM 2532 O ASP B 76 52.635 10.633 -9.664 1.00 25.03 O ATOM 2533 CB ASP B 76 54.404 10.447 -12.568 1.00 20.98 C ATOM 2534 CG ASP B 76 54.223 9.761 -13.907 1.00 30.70 C ATOM 2535 OD1 ASP B 76 53.111 9.258 -14.175 1.00 24.68 O ATOM 2536 OD2 ASP B 76 55.195 9.720 -14.690 1.00 41.83 O ATOM 2537 H ASP B 76 53.376 12.839 -13.088 1.00 0.00 H ATOM 2538 N THR B 77 54.046 12.310 -10.180 1.00 22.48 N ATOM 2539 CA THR B 77 54.399 12.576 -8.791 1.00 22.93 C ATOM 2540 C THR B 77 53.321 13.338 -8.032 1.00 22.96 C ATOM 2541 O THR B 77 53.366 13.380 -6.798 1.00 22.26 O ATOM 2542 CB THR B 77 55.710 13.363 -8.724 1.00 23.78 C ATOM 2543 OG1 THR B 77 55.540 14.634 -9.362 1.00 19.47 O ATOM 2544 CG2 THR B 77 56.825 12.598 -9.423 1.00 25.45 C ATOM 2545 HG1 THR B 77 55.287 14.495 -10.309 1.00 0.00 H ATOM 2546 H THR B 77 54.430 12.921 -10.929 1.00 0.00 H ATOM 2547 N TYR B 78 52.360 13.938 -8.728 1.00 20.87 N ATOM 2548 CA TYR B 78 51.358 14.783 -8.090 1.00 19.67 C ATOM 2549 C TYR B 78 49.939 14.303 -8.342 1.00 18.48 C ATOM 2550 O TYR B 78 49.175 14.115 -7.387 1.00 20.46 O ATOM 2551 CB TYR B 78 51.532 16.233 -8.572 1.00 21.96 C ATOM 2552 CG TYR B 78 50.425 17.176 -8.167 1.00 20.75 C ATOM 2553 CD1 TYR B 78 50.257 17.556 -6.843 1.00 22.62 C ATOM 2554 CD2 TYR B 78 49.561 17.705 -9.115 1.00 19.86 C ATOM 2555 CE1 TYR B 78 49.250 18.425 -6.474 1.00 22.03 C ATOM 2556 CE2 TYR B 78 48.555 18.575 -8.755 1.00 17.85 C ATOM 2557 CZ TYR B 78 48.403 18.930 -7.435 1.00 19.47 C ATOM 2558 OH TYR B 78 47.398 19.795 -7.079 1.00 18.33 O ATOM 2559 HH TYR B 78 46.524 19.404 -7.329 1.00 0.00 H ATOM 2560 H TYR B 78 52.322 13.800 -9.758 1.00 0.00 H ATOM 2561 N CYS B 79 49.562 14.086 -9.602 1.00 20.81 N ATOM 2562 CA CYS B 79 48.201 13.658 -9.908 1.00 21.40 C ATOM 2563 C CYS B 79 47.974 12.205 -9.505 1.00 22.84 C ATOM 2564 O CYS B 79 47.091 11.903 -8.694 1.00 23.52 O ATOM 2565 CB CYS B 79 47.914 13.862 -11.396 1.00 24.06 C ATOM 2566 SG CYS B 79 47.824 15.593 -11.905 1.00 26.94 S ATOM 2567 H CYS B 79 50.245 14.223 -10.375 1.00 0.00 H ATOM 2568 N ARG B 80 48.766 11.287 -10.067 1.00 22.07 N ATOM 2569 CA ARG B 80 48.588 9.872 -9.756 1.00 22.74 C ATOM 2570 C ARG B 80 48.883 9.572 -8.293 1.00 23.51 C ATOM 2571 O ARG B 80 48.273 8.667 -7.712 1.00 27.75 O ATOM 2572 CB ARG B 80 49.473 9.016 -10.664 1.00 17.75 C ATOM 2573 CG ARG B 80 48.938 8.867 -12.078 1.00 20.67 C ATOM 2574 CD ARG B 80 49.782 7.904 -12.893 1.00 17.37 C ATOM 2575 NE ARG B 80 49.187 7.636 -14.199 1.00 23.91 N ATOM 2576 CZ ARG B 80 49.431 8.351 -15.293 1.00 22.18 C ATOM 2577 NH1 ARG B 80 48.843 8.034 -16.438 1.00 26.02 N ATOM 2578 NH2 ARG B 80 50.261 9.383 -15.241 1.00 23.37 N ATOM 2579 HE ARG B 80 48.530 6.834 -14.279 1.00 0.00 H ATOM 2580 HH12 ARG B 80 49.034 8.594 -17.293 1.00 0.00 H ATOM 2581 HH11 ARG B 80 48.190 7.225 -16.481 1.00 0.00 H ATOM 2582 HH22 ARG B 80 50.451 9.941 -16.098 1.00 0.00 H ATOM 2583 HH21 ARG B 80 50.722 9.634 -14.344 1.00 0.00 H ATOM 2584 H ARG B 80 49.512 11.582 -10.729 1.00 0.00 H ATOM 2585 N HIS B 81 49.808 10.315 -7.682 1.00 22.13 N ATOM 2586 CA HIS B 81 50.081 10.137 -6.260 1.00 19.39 C ATOM 2587 C HIS B 81 48.857 10.490 -5.423 1.00 20.34 C ATOM 2588 O HIS B 81 48.383 9.680 -4.617 1.00 25.99 O ATOM 2589 CB HIS B 81 51.282 10.988 -5.842 1.00 17.69 C ATOM 2590 CG HIS B 81 51.509 11.023 -4.363 1.00 28.00 C ATOM 2591 ND1 HIS B 81 52.333 10.128 -3.714 1.00 27.90 N ATOM 2592 CD2 HIS B 81 51.015 11.842 -3.403 1.00 27.61 C ATOM 2593 CE1 HIS B 81 52.339 10.396 -2.420 1.00 31.87 C ATOM 2594 NE2 HIS B 81 51.546 11.431 -2.205 1.00 28.39 N ATOM 2595 H HIS B 81 50.339 11.027 -8.224 1.00 0.00 H ATOM 2596 N ASN B 82 48.329 11.704 -5.605 1.00 22.59 N ATOM 2597 CA ASN B 82 47.187 12.143 -4.810 1.00 22.13 C ATOM 2598 C ASN B 82 45.958 11.285 -5.081 1.00 22.84 C ATOM 2599 O ASN B 82 45.169 11.015 -4.168 1.00 21.31 O ATOM 2600 CB ASN B 82 46.889 13.616 -5.088 1.00 18.00 C ATOM 2601 CG ASN B 82 47.972 14.536 -4.565 1.00 23.87 C ATOM 2602 OD1 ASN B 82 48.816 14.127 -3.769 1.00 27.54 O ATOM 2603 ND2 ASN B 82 47.951 15.789 -5.005 1.00 21.48 N ATOM 2604 HD22 ASN B 82 47.218 16.092 -5.678 1.00 0.00 H ATOM 2605 HD21 ASN B 82 48.667 16.468 -4.676 1.00 0.00 H ATOM 2606 H ASN B 82 48.735 12.341 -6.319 1.00 0.00 H ATOM 2607 N TYR B 83 45.776 10.853 -6.332 1.00 22.29 N ATOM 2608 CA TYR B 83 44.696 9.920 -6.637 1.00 19.91 C ATOM 2609 C TYR B 83 44.837 8.644 -5.819 1.00 24.13 C ATOM 2610 O TYR B 83 43.850 8.130 -5.281 1.00 28.46 O ATOM 2611 CB TYR B 83 44.683 9.605 -8.136 1.00 20.50 C ATOM 2612 CG TYR B 83 43.490 8.799 -8.618 1.00 28.45 C ATOM 2613 CD1 TYR B 83 42.470 9.401 -9.346 1.00 22.91 C ATOM 2614 CD2 TYR B 83 43.392 7.435 -8.362 1.00 25.78 C ATOM 2615 CE1 TYR B 83 41.383 8.669 -9.796 1.00 16.48 C ATOM 2616 CE2 TYR B 83 42.310 6.698 -8.806 1.00 22.63 C ATOM 2617 CZ TYR B 83 41.310 7.319 -9.522 1.00 22.35 C ATOM 2618 OH TYR B 83 40.234 6.584 -9.966 1.00 22.30 O ATOM 2619 HH TYR B 83 39.612 7.176 -10.459 1.00 0.00 H ATOM 2620 H TYR B 83 46.406 11.183 -7.091 1.00 0.00 H ATOM 2621 N GLY B 84 46.061 8.124 -5.704 1.00 23.85 N ATOM 2622 CA GLY B 84 46.272 6.912 -4.932 1.00 21.78 C ATOM 2623 C GLY B 84 46.051 7.102 -3.445 1.00 21.65 C ATOM 2624 O GLY B 84 45.643 6.165 -2.752 1.00 20.41 O ATOM 2625 H GLY B 84 46.867 8.589 -6.169 1.00 0.00 H ATOM 2626 N VAL B 85 46.309 8.307 -2.935 1.00 22.36 N ATOM 2627 CA VAL B 85 46.138 8.555 -1.507 1.00 23.79 C ATOM 2628 C VAL B 85 44.663 8.675 -1.147 1.00 23.54 C ATOM 2629 O VAL B 85 44.243 8.243 -0.066 1.00 25.37 O ATOM 2630 CB VAL B 85 46.927 9.811 -1.089 1.00 24.42 C ATOM 2631 CG1 VAL B 85 46.717 10.113 0.387 1.00 27.53 C ATOM 2632 CG2 VAL B 85 48.406 9.633 -1.390 1.00 20.50 C ATOM 2633 H VAL B 85 46.634 9.074 -3.558 1.00 0.00 H ATOM 2634 N GLY B 86 43.849 9.237 -2.037 1.00 23.28 N ATOM 2635 CA GLY B 86 42.477 9.550 -1.687 1.00 25.10 C ATOM 2636 C GLY B 86 41.399 8.709 -2.342 1.00 21.40 C ATOM 2637 O GLY B 86 40.215 8.894 -2.048 1.00 23.42 O ATOM 2638 H GLY B 86 44.200 9.454 -2.992 1.00 0.00 H ATOM 2639 N GLU B 87 41.785 7.776 -3.217 1.00 23.11 N ATOM 2640 CA GLU B 87 40.793 7.021 -3.978 1.00 27.22 C ATOM 2641 C GLU B 87 39.874 6.187 -3.094 1.00 26.69 C ATOM 2642 O GLU B 87 38.754 5.873 -3.513 1.00 26.12 O ATOM 2643 CB GLU B 87 41.483 6.109 -4.995 1.00 24.00 C ATOM 2644 CG GLU B 87 42.483 5.144 -4.385 1.00 29.24 C ATOM 2645 CD GLU B 87 42.853 4.021 -5.331 1.00 42.47 C ATOM 2646 OE1 GLU B 87 41.982 3.595 -6.119 1.00 42.29 O ATOM 2647 OE2 GLU B 87 44.015 3.565 -5.290 1.00 52.81 O ATOM 2648 H GLU B 87 42.798 7.586 -3.357 1.00 0.00 H ATOM 2649 N SER B 88 40.311 5.825 -1.886 1.00 24.03 N ATOM 2650 CA SER B 88 39.490 4.966 -1.038 1.00 28.38 C ATOM 2651 C SER B 88 38.276 5.704 -0.486 1.00 19.72 C ATOM 2652 O SER B 88 37.225 5.088 -0.275 1.00 22.38 O ATOM 2653 CB SER B 88 40.327 4.393 0.106 1.00 17.09 C ATOM 2654 OG SER B 88 40.659 5.395 1.052 1.00 25.47 O ATOM 2655 HG SER B 88 41.199 4.995 1.779 1.00 0.00 H ATOM 2656 H SER B 88 41.238 6.155 -1.548 1.00 0.00 H ATOM 2657 N PHE B 89 38.393 7.010 -0.247 1.00 21.55 N ATOM 2658 CA PHE B 89 37.299 7.792 0.319 1.00 26.79 C ATOM 2659 C PHE B 89 36.769 8.854 -0.638 1.00 26.09 C ATOM 2660 O PHE B 89 35.914 9.655 -0.243 1.00 22.22 O ATOM 2661 CB PHE B 89 37.732 8.439 1.641 1.00 23.62 C ATOM 2662 CG PHE B 89 38.975 9.280 1.536 1.00 27.69 C ATOM 2663 CD1 PHE B 89 38.890 10.637 1.274 1.00 29.25 C ATOM 2664 CD2 PHE B 89 40.227 8.716 1.718 1.00 29.30 C ATOM 2665 CE1 PHE B 89 40.030 11.415 1.183 1.00 26.39 C ATOM 2666 CE2 PHE B 89 41.371 9.489 1.630 1.00 33.91 C ATOM 2667 CZ PHE B 89 41.271 10.840 1.362 1.00 27.91 C ATOM 2668 H PHE B 89 39.290 7.486 -0.471 1.00 0.00 H ATOM 2669 N THR B 90 37.249 8.884 -1.884 1.00 27.25 N ATOM 2670 CA THR B 90 36.743 9.821 -2.885 1.00 21.14 C ATOM 2671 C THR B 90 36.238 9.074 -4.113 1.00 25.40 C ATOM 2672 O THR B 90 35.034 9.089 -4.380 1.00 31.89 O ATOM 2673 CB THR B 90 37.819 10.839 -3.271 1.00 23.27 C ATOM 2674 OG1 THR B 90 38.907 10.166 -3.917 1.00 20.21 O ATOM 2675 CG2 THR B 90 38.337 11.575 -2.044 1.00 18.36 C ATOM 2676 HG1 THR B 90 39.293 9.496 -3.298 1.00 0.00 H ATOM 2677 H THR B 90 38.005 8.221 -2.150 1.00 0.00 H ATOM 2678 N VAL B 91 37.123 8.421 -4.869 1.00 25.02 N ATOM 2679 CA VAL B 91 36.713 7.721 -6.084 1.00 26.29 C ATOM 2680 C VAL B 91 35.738 6.598 -5.753 1.00 30.76 C ATOM 2681 O VAL B 91 34.801 6.322 -6.514 1.00 27.30 O ATOM 2682 CB VAL B 91 37.954 7.194 -6.829 1.00 21.23 C ATOM 2683 CG1 VAL B 91 37.551 6.408 -8.068 1.00 21.51 C ATOM 2684 CG2 VAL B 91 38.877 8.345 -7.196 1.00 21.90 C ATOM 2685 H VAL B 91 38.124 8.410 -4.588 1.00 0.00 H ATOM 2686 N GLN B 92 35.930 5.944 -4.610 1.00 28.13 N ATOM 2687 CA GLN B 92 35.141 4.781 -4.230 1.00 29.26 C ATOM 2688 C GLN B 92 34.072 5.097 -3.192 1.00 25.32 C ATOM 2689 O GLN B 92 33.466 4.171 -2.643 1.00 24.55 O ATOM 2690 CB GLN B 92 36.064 3.676 -3.713 1.00 24.15 C ATOM 2691 CG GLN B 92 37.045 3.163 -4.753 1.00 24.71 C ATOM 2692 CD GLN B 92 38.134 2.300 -4.152 1.00 39.07 C ATOM 2693 OE1 GLN B 92 38.241 2.176 -2.932 1.00 37.03 O ATOM 2694 NE2 GLN B 92 38.952 1.697 -5.007 1.00 45.86 N ATOM 2695 HE22 GLN B 92 38.825 1.830 -6.031 1.00 0.00 H ATOM 2696 HE21 GLN B 92 39.720 1.092 -4.653 1.00 0.00 H ATOM 2697 H GLN B 92 36.673 6.277 -3.963 1.00 0.00 H ATOM 2698 N ARG B 93 33.824 6.374 -2.909 1.00 23.47 N ATOM 2699 CA ARG B 93 32.784 6.736 -1.956 1.00 23.77 C ATOM 2700 C ARG B 93 31.411 6.407 -2.530 1.00 24.70 C ATOM 2701 O ARG B 93 31.092 6.780 -3.663 1.00 22.10 O ATOM 2702 CB ARG B 93 32.873 8.220 -1.604 1.00 24.32 C ATOM 2703 CG ARG B 93 31.763 8.704 -0.682 1.00 20.79 C ATOM 2704 CD ARG B 93 31.924 10.176 -0.340 1.00 20.01 C ATOM 2705 NE ARG B 93 30.749 10.711 0.342 1.00 20.44 N ATOM 2706 CZ ARG B 93 30.602 10.749 1.662 1.00 20.24 C ATOM 2707 NH1 ARG B 93 31.560 10.281 2.452 1.00 14.54 N ATOM 2708 NH2 ARG B 93 29.497 11.255 2.194 1.00 15.98 N ATOM 2709 HE ARG B 93 29.976 11.087 -0.244 1.00 0.00 H ATOM 2710 HH12 ARG B 93 31.443 10.311 3.485 1.00 0.00 H ATOM 2711 HH11 ARG B 93 32.427 9.884 2.038 1.00 0.00 H ATOM 2712 HH22 ARG B 93 29.383 11.284 3.227 1.00 0.00 H ATOM 2713 HH21 ARG B 93 28.744 11.623 1.578 1.00 0.00 H ATOM 2714 H ARG B 93 34.379 7.121 -3.373 1.00 0.00 H ATOM 2715 N ARG B 94 30.600 5.700 -1.746 1.00 27.77 N ATOM 2716 CA ARG B 94 29.274 5.271 -2.176 1.00 28.76 C ATOM 2717 C ARG B 94 28.301 5.459 -1.024 1.00 27.46 C ATOM 2718 O ARG B 94 28.456 4.829 0.025 1.00 24.52 O ATOM 2719 CB ARG B 94 29.284 3.807 -2.629 1.00 26.45 C ATOM 2720 CG ARG B 94 30.095 3.535 -3.887 1.00 27.86 C ATOM 2721 CD ARG B 94 29.409 4.102 -5.117 1.00 27.02 C ATOM 2722 NE ARG B 94 30.028 3.631 -6.353 1.00 28.45 N ATOM 2723 CZ ARG B 94 30.986 4.281 -7.006 1.00 28.03 C ATOM 2724 NH1 ARG B 94 31.439 5.439 -6.545 1.00 37.04 N ATOM 2725 NH2 ARG B 94 31.490 3.774 -8.123 1.00 29.43 N ATOM 2726 HE ARG B 94 29.698 2.728 -6.748 1.00 0.00 H ATOM 2727 HH12 ARG B 94 32.189 5.945 -7.058 1.00 0.00 H ATOM 2728 HH11 ARG B 94 31.045 5.841 -5.671 1.00 0.00 H ATOM 2729 HH22 ARG B 94 32.240 4.283 -8.633 1.00 0.00 H ATOM 2730 HH21 ARG B 94 31.136 2.867 -8.489 1.00 0.00 H ATOM 2731 H ARG B 94 30.924 5.444 -0.791 1.00 0.00 H ATOM 2732 N VAL B 95 27.304 6.317 -1.217 1.00 23.91 N ATOM 2733 CA VAL B 95 26.250 6.528 -0.233 1.00 20.85 C ATOM 2734 C VAL B 95 24.914 6.351 -0.938 1.00 24.84 C ATOM 2735 O VAL B 95 24.638 7.036 -1.931 1.00 22.36 O ATOM 2736 CB VAL B 95 26.332 7.915 0.425 1.00 22.93 C ATOM 2737 CG1 VAL B 95 25.170 8.102 1.373 1.00 24.31 C ATOM 2738 CG2 VAL B 95 27.651 8.080 1.162 1.00 23.20 C ATOM 2739 H VAL B 95 27.275 6.858 -2.104 1.00 0.00 H ATOM 2740 N TYR B 96 24.072 5.426 -0.420 1.00 27.66 N ATOM 2741 CA TYR B 96 22.817 5.275 -1.140 1.00 27.36 C ATOM 2742 C TYR B 96 21.772 6.254 -0.611 1.00 24.48 C ATOM 2743 O TYR B 96 21.830 6.669 0.551 1.00 27.39 O ATOM 2744 CB TYR B 96 22.302 3.838 -1.032 1.00 33.54 C ATOM 2745 CG TYR B 96 21.973 3.361 0.365 1.00 30.73 C ATOM 2746 CD1 TYR B 96 20.716 3.578 0.915 1.00 37.19 C ATOM 2747 CD2 TYR B 96 22.909 2.666 1.121 1.00 23.48 C ATOM 2748 CE1 TYR B 96 20.406 3.136 2.185 1.00 44.14 C ATOM 2749 CE2 TYR B 96 22.608 2.218 2.393 1.00 28.73 C ATOM 2750 CZ TYR B 96 21.354 2.457 2.920 1.00 45.94 C ATOM 2751 OH TYR B 96 21.043 2.016 4.185 1.00 36.01 O ATOM 2752 HH TYR B 96 20.111 2.271 4.402 1.00 0.00 H ATOM 2753 H TYR B 96 24.304 4.867 0.426 1.00 0.00 H ATOM 2754 N PRO B 97 20.816 6.647 -1.447 1.00 22.78 N ATOM 2755 CA PRO B 97 19.894 7.719 -1.066 1.00 22.43 C ATOM 2756 C PRO B 97 18.718 7.224 -0.237 1.00 22.73 C ATOM 2757 O PRO B 97 18.346 6.049 -0.256 1.00 25.89 O ATOM 2758 CB PRO B 97 19.412 8.250 -2.418 1.00 19.96 C ATOM 2759 CG PRO B 97 19.438 7.051 -3.297 1.00 19.03 C ATOM 2760 CD PRO B 97 20.623 6.233 -2.850 1.00 22.35 C ATOM 2761 N GLU B 98 18.131 8.165 0.497 1.00 20.76 N ATOM 2762 CA GLU B 98 16.871 7.960 1.197 1.00 30.21 C ATOM 2763 C GLU B 98 15.757 8.604 0.384 1.00 26.57 C ATOM 2764 O GLU B 98 15.843 9.786 0.033 1.00 24.89 O ATOM 2765 CB GLU B 98 16.922 8.555 2.605 1.00 24.75 C ATOM 2766 H GLU B 98 18.595 9.093 0.575 1.00 0.00 H ATOM 2767 N VAL B 99 14.720 7.829 0.080 1.00 23.86 N ATOM 2768 CA VAL B 99 13.674 8.241 -0.850 1.00 23.58 C ATOM 2769 C VAL B 99 12.380 8.445 -0.075 1.00 24.36 C ATOM 2770 O VAL B 99 11.888 7.521 0.585 1.00 29.15 O ATOM 2771 CB VAL B 99 13.490 7.218 -1.981 1.00 30.04 C ATOM 2772 CG1 VAL B 99 12.420 7.689 -2.953 1.00 25.78 C ATOM 2773 CG2 VAL B 99 14.809 6.994 -2.703 1.00 22.48 C ATOM 2774 H VAL B 99 14.652 6.891 0.523 1.00 0.00 H ATOM 2775 N THR B 100 11.827 9.652 -0.167 1.00 29.73 N ATOM 2776 CA THR B 100 10.568 10.016 0.468 1.00 25.05 C ATOM 2777 C THR B 100 9.618 10.573 -0.583 1.00 32.40 C ATOM 2778 O THR B 100 10.024 11.360 -1.444 1.00 36.91 O ATOM 2779 CB THR B 100 10.794 11.050 1.586 1.00 28.41 C ATOM 2780 OG1 THR B 100 11.386 10.408 2.722 1.00 41.08 O ATOM 2781 CG2 THR B 100 9.484 11.708 2.006 1.00 29.00 C ATOM 2782 HG1 THR B 100 12.254 10.011 2.460 1.00 0.00 H ATOM 2783 H THR B 100 12.322 10.377 -0.724 1.00 0.00 H ATOM 2784 N VAL B 101 8.355 10.154 -0.519 1.00 27.01 N ATOM 2785 CA VAL B 101 7.318 10.607 -1.439 1.00 26.01 C ATOM 2786 C VAL B 101 6.226 11.299 -0.636 1.00 29.78 C ATOM 2787 O VAL B 101 5.685 10.719 0.313 1.00 29.66 O ATOM 2788 CB VAL B 101 6.736 9.441 -2.259 1.00 35.11 C ATOM 2789 CG1 VAL B 101 5.563 9.919 -3.100 1.00 34.09 C ATOM 2790 CG2 VAL B 101 7.812 8.821 -3.138 1.00 27.13 C ATOM 2791 H VAL B 101 8.096 9.472 0.222 1.00 0.00 H ATOM 2792 N TYR B 102 5.899 12.535 -1.017 1.00 30.35 N ATOM 2793 CA TYR B 102 4.842 13.292 -0.362 1.00 25.38 C ATOM 2794 C TYR B 102 4.104 14.156 -1.376 1.00 32.51 C ATOM 2795 O TYR B 102 4.725 14.693 -2.305 1.00 30.69 O ATOM 2796 CB TYR B 102 5.390 14.172 0.773 1.00 26.60 C ATOM 2797 CG TYR B 102 6.412 15.210 0.354 1.00 25.51 C ATOM 2798 CD1 TYR B 102 6.021 16.495 -0.006 1.00 33.77 C ATOM 2799 CD2 TYR B 102 7.769 14.912 0.339 1.00 31.48 C ATOM 2800 CE1 TYR B 102 6.950 17.448 -0.380 1.00 38.34 C ATOM 2801 CE2 TYR B 102 8.706 15.860 -0.034 1.00 29.45 C ATOM 2802 CZ TYR B 102 8.291 17.126 -0.392 1.00 31.90 C ATOM 2803 OH TYR B 102 9.216 18.074 -0.764 1.00 27.56 O ATOM 2804 HH TYR B 102 8.750 18.919 -0.987 1.00 0.00 H ATOM 2805 H TYR B 102 6.416 12.972 -1.807 1.00 0.00 H ATOM 2806 N PRO B 103 2.789 14.297 -1.233 1.00 30.71 N ATOM 2807 CA PRO B 103 2.022 15.125 -2.167 1.00 33.36 C ATOM 2808 C PRO B 103 2.150 16.610 -1.854 1.00 34.20 C ATOM 2809 O PRO B 103 2.495 17.017 -0.743 1.00 34.96 O ATOM 2810 CB PRO B 103 0.583 14.643 -1.961 1.00 40.72 C ATOM 2811 CG PRO B 103 0.557 14.174 -0.545 1.00 41.07 C ATOM 2812 CD PRO B 103 1.922 13.597 -0.269 1.00 38.17 C ATOM 2813 N ALA B 104 1.855 17.421 -2.866 1.00 32.37 N ATOM 2814 CA ALA B 104 1.955 18.872 -2.756 1.00 32.92 C ATOM 2815 C ALA B 104 0.921 19.503 -3.684 1.00 36.53 C ATOM 2816 O ALA B 104 0.083 18.812 -4.270 1.00 37.42 O ATOM 2817 CB ALA B 104 3.380 19.342 -3.072 1.00 26.82 C ATOM 2818 H ALA B 104 1.542 17.006 -3.767 1.00 0.00 H ATOM 2819 N LYS B 105 0.983 20.828 -3.818 1.00 44.55 N ATOM 2820 CA LYS B 105 0.058 21.581 -4.656 1.00 40.00 C ATOM 2821 C LYS B 105 0.836 22.553 -5.529 1.00 43.11 C ATOM 2822 O LYS B 105 1.734 23.249 -5.042 1.00 50.77 O ATOM 2823 CB LYS B 105 -0.960 22.358 -3.814 1.00 48.51 C ATOM 2824 CG LYS B 105 -1.849 21.508 -2.926 1.00 46.96 C ATOM 2825 CD LYS B 105 -2.893 22.378 -2.244 1.00 48.41 C ATOM 2826 CE LYS B 105 -3.276 21.834 -0.879 1.00 50.23 C ATOM 2827 NZ LYS B 105 -4.203 22.756 -0.166 1.00 45.68 N ATOM 2828 HZ1 LYS B 105 -3.741 23.678 -0.036 1.00 0.00 H ATOM 2829 HZ2 LYS B 105 -5.070 22.877 -0.728 1.00 0.00 H ATOM 2830 HZ3 LYS B 105 -4.444 22.354 0.762 1.00 0.00 H ATOM 2831 H LYS B 105 1.723 21.346 -3.303 1.00 0.00 H ATOM 2832 N THR B 106 0.484 22.605 -6.815 1.00 42.64 N ATOM 2833 CA THR B 106 1.066 23.610 -7.700 1.00 44.88 C ATOM 2834 C THR B 106 0.543 25.001 -7.367 1.00 51.16 C ATOM 2835 O THR B 106 1.311 25.969 -7.322 1.00 51.48 O ATOM 2836 CB THR B 106 0.759 23.267 -9.158 1.00 43.48 C ATOM 2837 OG1 THR B 106 -0.652 23.071 -9.315 1.00 37.68 O ATOM 2838 CG2 THR B 106 1.489 22.002 -9.577 1.00 39.74 C ATOM 2839 HG1 THR B 106 -0.948 22.328 -8.731 1.00 0.00 H ATOM 2840 H THR B 106 -0.209 21.926 -7.189 1.00 0.00 H ATOM 2841 N GLN B 107 -0.756 25.113 -7.128 1.00 54.45 N ATOM 2842 CA GLN B 107 -1.441 26.363 -6.845 1.00 57.05 C ATOM 2843 C GLN B 107 -2.403 26.113 -5.691 1.00 56.40 C ATOM 2844 O GLN B 107 -2.711 24.958 -5.382 1.00 53.72 O ATOM 2845 CB GLN B 107 -2.190 26.867 -8.087 1.00 51.74 C ATOM 2846 H GLN B 107 -1.326 24.243 -7.144 1.00 0.00 H ATOM 2847 N PRO B 108 -2.885 27.180 -5.024 1.00 60.31 N ATOM 2848 CA PRO B 108 -3.769 26.966 -3.866 1.00 65.38 C ATOM 2849 C PRO B 108 -5.074 26.288 -4.249 1.00 61.81 C ATOM 2850 O PRO B 108 -6.094 26.953 -4.454 1.00 69.31 O ATOM 2851 CB PRO B 108 -4.012 28.385 -3.330 1.00 66.08 C ATOM 2852 CG PRO B 108 -2.979 29.243 -3.974 1.00 61.83 C ATOM 2853 CD PRO B 108 -2.673 28.614 -5.287 1.00 60.41 C ATOM 2854 N LEU B 109 -5.052 24.964 -4.345 1.00 56.49 N ATOM 2855 CA LEU B 109 -6.204 24.185 -4.769 1.00 55.70 C ATOM 2856 C LEU B 109 -6.743 23.357 -3.610 1.00 58.40 C ATOM 2857 O LEU B 109 -6.155 23.291 -2.527 1.00 53.42 O ATOM 2858 CB LEU B 109 -5.839 23.278 -5.950 1.00 46.20 C ATOM 2859 H LEU B 109 -4.173 24.462 -4.107 1.00 0.00 H ATOM 2860 N GLN B 110 -7.890 22.722 -3.856 1.00 66.00 N ATOM 2861 CA GLN B 110 -8.489 21.851 -2.851 1.00 64.17 C ATOM 2862 C GLN B 110 -7.724 20.537 -2.747 1.00 65.04 C ATOM 2863 O GLN B 110 -7.249 20.161 -1.669 1.00 67.75 O ATOM 2864 CB GLN B 110 -9.960 21.598 -3.188 1.00 53.83 C ATOM 2865 H GLN B 110 -8.362 22.849 -4.774 1.00 0.00 H ATOM 2866 N HIS B 111 -7.588 19.830 -3.862 1.00 65.39 N ATOM 2867 CA HIS B 111 -6.886 18.558 -3.890 1.00 58.31 C ATOM 2868 C HIS B 111 -5.420 18.760 -4.260 1.00 52.13 C ATOM 2869 O HIS B 111 -5.033 19.772 -4.850 1.00 47.25 O ATOM 2870 CB HIS B 111 -7.548 17.599 -4.880 1.00 48.74 C ATOM 2871 H HIS B 111 -7.997 20.198 -4.744 1.00 0.00 H ATOM 2872 N HIS B 112 -4.602 17.778 -3.893 1.00 52.14 N ATOM 2873 CA HIS B 112 -3.199 17.779 -4.278 1.00 45.34 C ATOM 2874 C HIS B 112 -3.063 17.384 -5.742 1.00 39.31 C ATOM 2875 O HIS B 112 -3.744 16.473 -6.220 1.00 40.57 O ATOM 2876 CB HIS B 112 -2.398 16.815 -3.402 1.00 41.89 C ATOM 2877 CG HIS B 112 -2.497 17.102 -1.936 1.00 47.80 C ATOM 2878 ND1 HIS B 112 -1.706 18.039 -1.306 1.00 48.03 N ATOM 2879 CD2 HIS B 112 -3.288 16.569 -0.975 1.00 46.72 C ATOM 2880 CE1 HIS B 112 -2.009 18.074 -0.020 1.00 47.32 C ATOM 2881 NE2 HIS B 112 -2.966 17.192 0.207 1.00 51.07 N ATOM 2882 H HIS B 112 -4.973 16.994 -3.319 1.00 0.00 H ATOM 2883 N ASN B 113 -2.180 18.081 -6.456 1.00 33.45 N ATOM 2884 CA ASN B 113 -1.924 17.787 -7.861 1.00 33.72 C ATOM 2885 C ASN B 113 -0.429 17.685 -8.133 1.00 26.85 C ATOM 2886 O ASN B 113 0.025 17.940 -9.252 1.00 25.23 O ATOM 2887 CB ASN B 113 -2.566 18.838 -8.768 1.00 32.30 C ATOM 2888 CG ASN B 113 -1.926 20.205 -8.625 1.00 33.41 C ATOM 2889 OD1 ASN B 113 -1.361 20.535 -7.582 1.00 37.15 O ATOM 2890 ND2 ASN B 113 -2.010 21.009 -9.679 1.00 32.40 N ATOM 2891 HD22 ASN B 113 -2.497 20.688 -10.540 1.00 0.00 H ATOM 2892 HD21 ASN B 113 -1.589 21.959 -9.643 1.00 0.00 H ATOM 2893 H ASN B 113 -1.659 18.856 -5.999 1.00 0.00 H ATOM 2894 N LEU B 114 0.348 17.302 -7.123 1.00 27.37 N ATOM 2895 CA LEU B 114 1.801 17.297 -7.239 1.00 30.85 C ATOM 2896 C LEU B 114 2.363 16.223 -6.323 1.00 33.50 C ATOM 2897 O LEU B 114 2.183 16.295 -5.104 1.00 31.60 O ATOM 2898 CB LEU B 114 2.373 18.669 -6.880 1.00 26.18 C ATOM 2899 CG LEU B 114 3.690 19.079 -7.536 1.00 34.25 C ATOM 2900 CD1 LEU B 114 3.587 18.956 -9.047 1.00 34.41 C ATOM 2901 CD2 LEU B 114 4.053 20.500 -7.135 1.00 31.21 C ATOM 2902 H LEU B 114 -0.091 16.999 -6.230 1.00 0.00 H ATOM 2903 N LEU B 115 3.037 15.234 -6.905 1.00 24.15 N ATOM 2904 CA LEU B 115 3.692 14.170 -6.154 1.00 26.81 C ATOM 2905 C LEU B 115 5.194 14.418 -6.161 1.00 23.32 C ATOM 2906 O LEU B 115 5.822 14.407 -7.225 1.00 20.11 O ATOM 2907 CB LEU B 115 3.371 12.797 -6.746 1.00 26.57 C ATOM 2908 CG LEU B 115 1.973 12.247 -6.468 1.00 28.84 C ATOM 2909 CD1 LEU B 115 1.801 10.884 -7.115 1.00 25.47 C ATOM 2910 CD2 LEU B 115 1.722 12.167 -4.970 1.00 29.69 C ATOM 2911 H LEU B 115 3.099 15.220 -7.943 1.00 0.00 H ATOM 2912 N VAL B 116 5.763 14.637 -4.980 1.00 21.67 N ATOM 2913 CA VAL B 116 7.182 14.937 -4.828 1.00 26.26 C ATOM 2914 C VAL B 116 7.917 13.655 -4.466 1.00 26.68 C ATOM 2915 O VAL B 116 7.462 12.893 -3.605 1.00 27.33 O ATOM 2916 CB VAL B 116 7.412 16.017 -3.758 1.00 23.78 C ATOM 2917 CG1 VAL B 116 8.876 16.434 -3.730 1.00 24.82 C ATOM 2918 CG2 VAL B 116 6.504 17.213 -4.002 1.00 22.10 C ATOM 2919 H VAL B 116 5.170 14.592 -4.127 1.00 0.00 H ATOM 2920 N CYS B 117 9.049 13.415 -5.120 1.00 25.00 N ATOM 2921 CA CYS B 117 9.934 12.300 -4.789 1.00 24.81 C ATOM 2922 C CYS B 117 11.236 12.891 -4.261 1.00 27.97 C ATOM 2923 O CYS B 117 12.102 13.305 -5.037 1.00 26.81 O ATOM 2924 CB CYS B 117 10.177 11.402 -5.997 1.00 24.19 C ATOM 2925 SG CYS B 117 11.171 9.934 -5.635 1.00 30.81 S ATOM 2926 H CYS B 117 9.316 14.048 -5.901 1.00 0.00 H ATOM 2927 N SER B 118 11.368 12.932 -2.938 1.00 26.48 N ATOM 2928 CA SER B 118 12.561 13.481 -2.309 1.00 21.35 C ATOM 2929 C SER B 118 13.636 12.405 -2.232 1.00 26.56 C ATOM 2930 O SER B 118 13.434 11.359 -1.606 1.00 28.06 O ATOM 2931 CB SER B 118 12.232 14.019 -0.919 1.00 24.06 C ATOM 2932 OG SER B 118 13.295 14.815 -0.425 1.00 28.60 O ATOM 2933 HG SER B 118 14.118 14.267 -0.370 1.00 0.00 H ATOM 2934 H SER B 118 10.602 12.564 -2.339 1.00 0.00 H ATOM 2935 N VAL B 119 14.773 12.661 -2.871 1.00 20.18 N ATOM 2936 CA VAL B 119 15.905 11.742 -2.902 1.00 18.26 C ATOM 2937 C VAL B 119 17.072 12.468 -2.248 1.00 21.22 C ATOM 2938 O VAL B 119 17.617 13.418 -2.824 1.00 26.10 O ATOM 2939 CB VAL B 119 16.247 11.309 -4.333 1.00 20.17 C ATOM 2940 CG1 VAL B 119 17.282 10.210 -4.324 1.00 20.91 C ATOM 2941 CG2 VAL B 119 14.991 10.856 -5.066 1.00 16.29 C ATOM 2942 H VAL B 119 14.860 13.566 -3.376 1.00 0.00 H ATOM 2943 N ASN B 120 17.458 12.033 -1.050 1.00 16.81 N ATOM 2944 CA ASN B 120 18.348 12.808 -0.196 1.00 16.76 C ATOM 2945 C ASN B 120 19.598 12.027 0.185 1.00 15.99 C ATOM 2946 O ASN B 120 19.546 10.814 0.411 1.00 19.11 O ATOM 2947 CB ASN B 120 17.625 13.250 1.080 1.00 13.45 C ATOM 2948 CG ASN B 120 16.537 14.266 0.809 1.00 22.66 C ATOM 2949 OD1 ASN B 120 15.420 13.912 0.435 1.00 24.73 O ATOM 2950 ND2 ASN B 120 16.858 15.540 0.999 1.00 24.48 N ATOM 2951 HD22 ASN B 120 17.816 15.793 1.316 1.00 0.00 H ATOM 2952 HD21 ASN B 120 16.152 16.285 0.831 1.00 0.00 H ATOM 2953 H ASN B 120 17.113 11.111 -0.714 1.00 0.00 H ATOM 2954 N GLY B 121 20.719 12.743 0.251 1.00 19.23 N ATOM 2955 CA GLY B 121 21.910 12.258 0.917 1.00 12.90 C ATOM 2956 C GLY B 121 22.774 11.290 0.146 1.00 16.80 C ATOM 2957 O GLY B 121 23.611 10.621 0.755 1.00 19.91 O ATOM 2958 H GLY B 121 20.740 13.684 -0.191 1.00 0.00 H ATOM 2959 N PHE B 122 22.625 11.202 -1.171 1.00 14.43 N ATOM 2960 CA PHE B 122 23.372 10.215 -1.935 1.00 17.68 C ATOM 2961 C PHE B 122 24.692 10.785 -2.450 1.00 22.56 C ATOM 2962 O PHE B 122 24.893 11.999 -2.525 1.00 21.24 O ATOM 2963 CB PHE B 122 22.540 9.689 -3.107 1.00 16.96 C ATOM 2964 CG PHE B 122 22.041 10.761 -4.034 1.00 16.99 C ATOM 2965 CD1 PHE B 122 22.772 11.124 -5.153 1.00 15.27 C ATOM 2966 CD2 PHE B 122 20.834 11.396 -3.794 1.00 17.14 C ATOM 2967 CE1 PHE B 122 22.312 12.106 -6.010 1.00 15.86 C ATOM 2968 CE2 PHE B 122 20.370 12.379 -4.647 1.00 18.63 C ATOM 2969 CZ PHE B 122 21.110 12.734 -5.757 1.00 16.49 C ATOM 2970 H PHE B 122 21.969 11.844 -1.660 1.00 0.00 H ATOM 2971 N TYR B 123 25.597 9.874 -2.798 1.00 25.59 N ATOM 2972 CA TYR B 123 26.867 10.212 -3.434 1.00 21.33 C ATOM 2973 C TYR B 123 27.354 8.993 -4.217 1.00 20.51 C ATOM 2974 O TYR B 123 27.278 7.871 -3.719 1.00 23.04 O ATOM 2975 CB TYR B 123 27.909 10.644 -2.398 1.00 23.11 C ATOM 2976 CG TYR B 123 29.174 11.213 -3.008 1.00 27.23 C ATOM 2977 CD1 TYR B 123 29.309 12.579 -3.222 1.00 21.86 C ATOM 2978 CD2 TYR B 123 30.226 10.385 -3.379 1.00 20.03 C ATOM 2979 CE1 TYR B 123 30.458 13.103 -3.783 1.00 23.44 C ATOM 2980 CE2 TYR B 123 31.378 10.901 -3.941 1.00 20.94 C ATOM 2981 CZ TYR B 123 31.489 12.260 -4.140 1.00 22.06 C ATOM 2982 OH TYR B 123 32.634 12.779 -4.699 1.00 26.03 O ATOM 2983 HH TYR B 123 32.548 13.763 -4.770 1.00 0.00 H ATOM 2984 H TYR B 123 25.390 8.873 -2.608 1.00 0.00 H ATOM 2985 N PRO B 124 27.865 9.202 -5.443 1.00 24.65 N ATOM 2986 CA PRO B 124 28.075 10.477 -6.143 1.00 18.71 C ATOM 2987 C PRO B 124 26.802 11.111 -6.704 1.00 21.68 C ATOM 2988 O PRO B 124 25.694 10.699 -6.361 1.00 23.08 O ATOM 2989 CB PRO B 124 29.025 10.092 -7.279 1.00 23.26 C ATOM 2990 CG PRO B 124 28.697 8.673 -7.560 1.00 21.53 C ATOM 2991 CD PRO B 124 28.366 8.060 -6.230 1.00 18.45 C ATOM 2992 N GLY B 125 26.976 12.108 -7.576 1.00 19.79 N ATOM 2993 CA GLY B 125 25.847 12.910 -8.014 1.00 22.15 C ATOM 2994 C GLY B 125 25.017 12.294 -9.118 1.00 19.73 C ATOM 2995 O GLY B 125 23.829 12.608 -9.243 1.00 27.70 O ATOM 2996 H GLY B 125 27.927 12.311 -7.944 1.00 0.00 H ATOM 2997 N SER B 126 25.615 11.428 -9.935 1.00 19.23 N ATOM 2998 CA SER B 126 24.884 10.819 -11.040 1.00 24.22 C ATOM 2999 C SER B 126 23.736 9.968 -10.512 1.00 23.97 C ATOM 3000 O SER B 126 23.927 9.116 -9.640 1.00 20.70 O ATOM 3001 CB SER B 126 25.827 9.972 -11.894 1.00 24.23 C ATOM 3002 OG SER B 126 26.476 8.986 -11.110 1.00 29.49 O ATOM 3003 HG SER B 126 25.798 8.392 -10.701 1.00 0.00 H ATOM 3004 H SER B 126 26.614 11.184 -9.783 1.00 0.00 H ATOM 3005 N ILE B 127 22.537 10.204 -11.045 1.00 21.65 N ATOM 3006 CA ILE B 127 21.337 9.537 -10.556 1.00 18.49 C ATOM 3007 C ILE B 127 20.262 9.645 -11.627 1.00 23.60 C ATOM 3008 O ILE B 127 20.266 10.574 -12.439 1.00 21.62 O ATOM 3009 CB ILE B 127 20.879 10.147 -9.205 1.00 18.60 C ATOM 3010 CG1 ILE B 127 19.845 9.251 -8.522 1.00 22.41 C ATOM 3011 CG2 ILE B 127 20.333 11.554 -9.406 1.00 14.85 C ATOM 3012 CD1 ILE B 127 19.597 9.612 -7.078 1.00 23.03 C ATOM 3013 H ILE B 127 22.456 10.881 -11.830 1.00 0.00 H ATOM 3014 N GLU B 128 19.343 8.680 -11.632 1.00 24.66 N ATOM 3015 CA GLU B 128 18.239 8.633 -12.583 1.00 22.64 C ATOM 3016 C GLU B 128 16.960 8.337 -11.814 1.00 21.62 C ATOM 3017 O GLU B 128 16.819 7.254 -11.236 1.00 26.26 O ATOM 3018 CB GLU B 128 18.483 7.572 -13.659 1.00 27.03 C ATOM 3019 CG GLU B 128 17.385 7.462 -14.705 1.00 40.31 C ATOM 3020 CD GLU B 128 17.548 8.456 -15.841 1.00 46.28 C ATOM 3021 OE1 GLU B 128 16.602 9.232 -16.095 1.00 51.30 O ATOM 3022 OE2 GLU B 128 18.621 8.460 -16.481 1.00 44.89 O ATOM 3023 H GLU B 128 19.417 7.923 -10.923 1.00 0.00 H ATOM 3024 N VAL B 129 16.034 9.293 -11.806 1.00 25.28 N ATOM 3025 CA VAL B 129 14.786 9.188 -11.058 1.00 23.22 C ATOM 3026 C VAL B 129 13.630 9.188 -12.048 1.00 25.67 C ATOM 3027 O VAL B 129 13.582 10.031 -12.952 1.00 20.82 O ATOM 3028 CB VAL B 129 14.641 10.333 -10.040 1.00 20.30 C ATOM 3029 CG1 VAL B 129 13.309 10.240 -9.323 1.00 18.11 C ATOM 3030 CG2 VAL B 129 15.792 10.304 -9.043 1.00 20.00 C ATOM 3031 H VAL B 129 16.208 10.156 -12.359 1.00 0.00 H ATOM 3032 N ARG B 130 12.702 8.246 -11.877 1.00 23.46 N ATOM 3033 CA ARG B 130 11.582 8.073 -12.791 1.00 27.42 C ATOM 3034 C ARG B 130 10.281 7.911 -12.016 1.00 24.17 C ATOM 3035 O ARG B 130 10.270 7.430 -10.879 1.00 24.68 O ATOM 3036 CB ARG B 130 11.784 6.856 -13.706 1.00 28.73 C ATOM 3037 CG ARG B 130 13.079 6.877 -14.497 1.00 31.91 C ATOM 3038 CD ARG B 130 13.085 5.798 -15.564 1.00 39.89 C ATOM 3039 NE ARG B 130 13.510 6.330 -16.855 1.00 55.39 N ATOM 3040 CZ ARG B 130 14.732 6.192 -17.356 1.00 57.00 C ATOM 3041 NH1 ARG B 130 15.028 6.714 -18.539 1.00 60.86 N ATOM 3042 NH2 ARG B 130 15.658 5.526 -16.678 1.00 49.41 N ATOM 3043 HE ARG B 130 12.810 6.852 -17.420 1.00 0.00 H ATOM 3044 HH12 ARG B 130 15.985 6.605 -18.930 1.00 0.00 H ATOM 3045 HH11 ARG B 130 14.303 7.232 -19.075 1.00 0.00 H ATOM 3046 HH22 ARG B 130 16.615 5.419 -17.072 1.00 0.00 H ATOM 3047 HH21 ARG B 130 15.427 5.111 -15.753 1.00 0.00 H ATOM 3048 H ARG B 130 12.781 7.610 -11.058 1.00 0.00 H ATOM 3049 N TRP B 131 9.183 8.314 -12.650 1.00 23.35 N ATOM 3050 CA TRP B 131 7.842 8.163 -12.104 1.00 25.56 C ATOM 3051 C TRP B 131 7.071 7.121 -12.903 1.00 23.56 C ATOM 3052 O TRP B 131 7.192 7.051 -14.130 1.00 23.89 O ATOM 3053 CB TRP B 131 7.079 9.491 -12.123 1.00 21.51 C ATOM 3054 CG TRP B 131 7.356 10.384 -10.952 1.00 29.68 C ATOM 3055 CD1 TRP B 131 8.114 11.520 -10.947 1.00 23.92 C ATOM 3056 CD2 TRP B 131 6.870 10.220 -9.614 1.00 22.98 C ATOM 3057 NE1 TRP B 131 8.131 12.071 -9.688 1.00 25.71 N ATOM 3058 CE2 TRP B 131 7.375 11.292 -8.852 1.00 23.19 C ATOM 3059 CE3 TRP B 131 6.059 9.269 -8.986 1.00 25.29 C ATOM 3060 CZ2 TRP B 131 7.094 11.441 -7.496 1.00 24.06 C ATOM 3061 CZ3 TRP B 131 5.783 9.418 -7.639 1.00 23.76 C ATOM 3062 CH2 TRP B 131 6.300 10.495 -6.908 1.00 32.18 C ATOM 3063 HE1 TRP B 131 8.636 12.938 -9.414 1.00 0.00 H ATOM 3064 H TRP B 131 9.288 8.760 -13.584 1.00 0.00 H ATOM 3065 N PHE B 132 6.276 6.316 -12.202 1.00 23.60 N ATOM 3066 CA PHE B 132 5.430 5.304 -12.822 1.00 28.19 C ATOM 3067 C PHE B 132 4.031 5.402 -12.235 1.00 29.31 C ATOM 3068 O PHE B 132 3.875 5.518 -11.015 1.00 26.28 O ATOM 3069 CB PHE B 132 5.982 3.890 -12.601 1.00 29.88 C ATOM 3070 CG PHE B 132 7.311 3.637 -13.254 1.00 28.95 C ATOM 3071 CD1 PHE B 132 8.483 4.101 -12.678 1.00 26.25 C ATOM 3072 CD2 PHE B 132 7.392 2.909 -14.428 1.00 29.29 C ATOM 3073 CE1 PHE B 132 9.707 3.864 -13.275 1.00 25.93 C ATOM 3074 CE2 PHE B 132 8.613 2.667 -15.029 1.00 35.64 C ATOM 3075 CZ PHE B 132 9.772 3.145 -14.452 1.00 24.86 C ATOM 3076 H PHE B 132 6.258 6.413 -11.167 1.00 0.00 H ATOM 3077 N ARG B 133 3.019 5.355 -13.098 1.00 33.47 N ATOM 3078 CA ARG B 133 1.625 5.264 -12.676 1.00 33.09 C ATOM 3079 C ARG B 133 1.144 3.850 -12.974 1.00 40.15 C ATOM 3080 O ARG B 133 0.891 3.508 -14.135 1.00 41.19 O ATOM 3081 CB ARG B 133 0.752 6.301 -13.382 1.00 37.56 C ATOM 3082 CG ARG B 133 -0.674 6.358 -12.844 1.00 37.88 C ATOM 3083 CD ARG B 133 -1.569 7.291 -13.652 1.00 38.67 C ATOM 3084 NE ARG B 133 -1.083 8.667 -13.664 1.00 47.96 N ATOM 3085 CZ ARG B 133 -0.431 9.219 -14.683 1.00 54.55 C ATOM 3086 NH1 ARG B 133 -0.191 8.509 -15.776 1.00 53.58 N ATOM 3087 NH2 ARG B 133 -0.022 10.478 -14.610 1.00 46.33 N ATOM 3088 HE ARG B 133 -1.258 9.253 -12.823 1.00 0.00 H ATOM 3089 HH12 ARG B 133 0.319 8.939 -16.574 1.00 0.00 H ATOM 3090 HH11 ARG B 133 -0.512 7.522 -15.836 1.00 0.00 H ATOM 3091 HH22 ARG B 133 0.488 10.906 -15.409 1.00 0.00 H ATOM 3092 HH21 ARG B 133 -0.211 11.037 -13.754 1.00 0.00 H ATOM 3093 H ARG B 133 3.230 5.384 -14.116 1.00 0.00 H ATOM 3094 N ASN B 134 1.026 3.034 -11.928 1.00 42.86 N ATOM 3095 CA ASN B 134 0.611 1.636 -12.040 1.00 47.74 C ATOM 3096 C ASN B 134 1.485 0.880 -13.042 1.00 48.19 C ATOM 3097 O ASN B 134 1.005 0.280 -14.005 1.00 44.93 O ATOM 3098 CB ASN B 134 -0.871 1.528 -12.410 1.00 45.44 C ATOM 3099 CG ASN B 134 -1.740 2.482 -11.619 1.00 43.47 C ATOM 3100 OD1 ASN B 134 -1.692 2.511 -10.388 1.00 42.75 O ATOM 3101 ND2 ASN B 134 -2.546 3.266 -12.323 1.00 42.72 N ATOM 3102 HD22 ASN B 134 -2.553 3.207 -13.361 1.00 0.00 H ATOM 3103 HD21 ASN B 134 -3.171 3.940 -11.837 1.00 0.00 H ATOM 3104 H ASN B 134 1.240 3.410 -10.982 1.00 0.00 H ATOM 3105 N GLY B 135 2.793 0.931 -12.801 1.00 35.45 N ATOM 3106 CA GLY B 135 3.744 0.178 -13.589 1.00 36.07 C ATOM 3107 C GLY B 135 4.064 0.742 -14.956 1.00 41.97 C ATOM 3108 O GLY B 135 4.893 0.159 -15.666 1.00 49.10 O ATOM 3109 H GLY B 135 3.141 1.529 -12.024 1.00 0.00 H ATOM 3110 N GLN B 136 3.439 1.847 -15.355 1.00 37.84 N ATOM 3111 CA GLN B 136 3.709 2.488 -16.635 1.00 41.01 C ATOM 3112 C GLN B 136 4.406 3.819 -16.390 1.00 37.29 C ATOM 3113 O GLN B 136 3.900 4.658 -15.638 1.00 39.36 O ATOM 3114 CB GLN B 136 2.417 2.700 -17.429 1.00 28.12 C ATOM 3115 H GLN B 136 2.727 2.271 -14.726 1.00 0.00 H ATOM 3116 N GLU B 137 5.562 4.008 -17.025 1.00 30.89 N ATOM 3117 CA GLU B 137 6.355 5.207 -16.786 1.00 36.31 C ATOM 3118 C GLU B 137 5.642 6.441 -17.321 1.00 35.89 C ATOM 3119 O GLU B 137 5.124 6.438 -18.443 1.00 29.07 O ATOM 3120 CB GLU B 137 7.735 5.077 -17.430 1.00 32.24 C ATOM 3121 CG GLU B 137 8.639 6.277 -17.175 1.00 33.65 C ATOM 3122 CD GLU B 137 10.053 6.072 -17.684 1.00 43.75 C ATOM 3123 OE1 GLU B 137 10.352 4.972 -18.195 1.00 40.88 O ATOM 3124 OE2 GLU B 137 10.866 7.014 -17.571 1.00 39.65 O ATOM 3125 H GLU B 137 5.902 3.292 -17.698 1.00 0.00 H ATOM 3126 N GLU B 138 5.616 7.497 -16.514 1.00 34.95 N ATOM 3127 CA GLU B 138 5.041 8.779 -16.903 1.00 39.80 C ATOM 3128 C GLU B 138 6.177 9.768 -17.122 1.00 31.43 C ATOM 3129 O GLU B 138 6.789 10.247 -16.161 1.00 32.88 O ATOM 3130 CB GLU B 138 4.064 9.292 -15.848 1.00 38.29 C ATOM 3131 CG GLU B 138 2.615 9.245 -16.290 1.00 50.05 C ATOM 3132 CD GLU B 138 2.353 10.064 -17.543 1.00 52.56 C ATOM 3133 OE1 GLU B 138 3.053 11.077 -17.758 1.00 41.51 O ATOM 3134 OE2 GLU B 138 1.444 9.693 -18.315 1.00 56.27 O ATOM 3135 H GLU B 138 6.024 7.404 -15.562 1.00 0.00 H ATOM 3136 N LYS B 139 6.456 10.071 -18.387 1.00 32.71 N ATOM 3137 CA LYS B 139 7.491 11.029 -18.744 1.00 38.55 C ATOM 3138 C LYS B 139 6.951 12.440 -18.931 1.00 34.72 C ATOM 3139 O LYS B 139 7.743 13.372 -19.108 1.00 29.23 O ATOM 3140 CB LYS B 139 8.200 10.575 -20.022 1.00 31.85 C ATOM 3141 CG LYS B 139 8.800 9.180 -19.930 1.00 31.19 C ATOM 3142 CD LYS B 139 9.316 8.723 -21.279 1.00 34.65 C ATOM 3143 CE LYS B 139 10.504 7.793 -21.141 1.00 37.95 C ATOM 3144 NZ LYS B 139 11.361 7.833 -22.358 1.00 38.75 N ATOM 3145 HZ1 LYS B 139 10.802 7.539 -23.184 1.00 0.00 H ATOM 3146 HZ2 LYS B 139 11.711 8.802 -22.502 1.00 0.00 H ATOM 3147 HZ3 LYS B 139 12.166 7.187 -22.235 1.00 0.00 H ATOM 3148 H LYS B 139 5.916 9.608 -19.146 1.00 0.00 H ATOM 3149 N THR B 140 5.634 12.617 -18.891 1.00 28.61 N ATOM 3150 CA THR B 140 5.003 13.914 -19.078 1.00 33.27 C ATOM 3151 C THR B 140 4.715 14.554 -17.726 1.00 28.98 C ATOM 3152 O THR B 140 4.282 13.880 -16.786 1.00 34.67 O ATOM 3153 CB THR B 140 3.704 13.775 -19.876 1.00 35.56 C ATOM 3154 OG1 THR B 140 3.978 13.121 -21.122 1.00 31.99 O ATOM 3155 CG2 THR B 140 3.090 15.141 -20.153 1.00 24.89 C ATOM 3156 HG1 THR B 140 3.138 13.031 -21.638 1.00 0.00 H ATOM 3157 H THR B 140 5.027 11.790 -18.718 1.00 0.00 H ATOM 3158 N GLY B 141 4.962 15.856 -17.634 1.00 30.25 N ATOM 3159 CA GLY B 141 4.674 16.588 -16.413 1.00 33.62 C ATOM 3160 C GLY B 141 5.612 16.284 -15.265 1.00 32.84 C ATOM 3161 O GLY B 141 5.170 16.207 -14.112 1.00 33.12 O ATOM 3162 H GLY B 141 5.368 16.359 -18.449 1.00 0.00 H ATOM 3163 N VAL B 142 6.898 16.113 -15.550 1.00 26.88 N ATOM 3164 CA VAL B 142 7.907 15.866 -14.528 1.00 30.83 C ATOM 3165 C VAL B 142 8.781 17.107 -14.427 1.00 22.74 C ATOM 3166 O VAL B 142 9.410 17.518 -15.411 1.00 22.33 O ATOM 3167 CB VAL B 142 8.741 14.613 -14.841 1.00 29.83 C ATOM 3168 CG1 VAL B 142 10.107 14.700 -14.179 1.00 25.56 C ATOM 3169 CG2 VAL B 142 8.007 13.367 -14.371 1.00 24.25 C ATOM 3170 H VAL B 142 7.198 16.157 -16.545 1.00 0.00 H ATOM 3171 N VAL B 143 8.805 17.711 -13.242 1.00 22.85 N ATOM 3172 CA VAL B 143 9.643 18.866 -12.946 1.00 21.85 C ATOM 3173 C VAL B 143 10.592 18.481 -11.823 1.00 19.34 C ATOM 3174 O VAL B 143 10.188 17.826 -10.857 1.00 24.15 O ATOM 3175 CB VAL B 143 8.801 20.099 -12.554 1.00 24.06 C ATOM 3176 CG1 VAL B 143 9.698 21.267 -12.182 1.00 27.60 C ATOM 3177 CG2 VAL B 143 7.863 20.480 -13.685 1.00 32.40 C ATOM 3178 H VAL B 143 8.194 17.339 -12.487 1.00 0.00 H ATOM 3179 N SER B 144 11.855 18.873 -11.958 1.00 20.75 N ATOM 3180 CA SER B 144 12.866 18.569 -10.960 1.00 19.55 C ATOM 3181 C SER B 144 13.578 19.843 -10.534 1.00 20.57 C ATOM 3182 O SER B 144 13.647 20.820 -11.285 1.00 23.03 O ATOM 3183 CB SER B 144 13.889 17.558 -11.483 1.00 15.56 C ATOM 3184 OG SER B 144 14.923 17.353 -10.537 1.00 19.65 O ATOM 3185 HG SER B 144 14.534 17.008 -9.695 1.00 0.00 H ATOM 3186 H SER B 144 12.128 19.414 -12.804 1.00 0.00 H ATOM 3187 N THR B 145 14.104 19.822 -9.313 1.00 21.73 N ATOM 3188 CA THR B 145 14.934 20.909 -8.815 1.00 25.42 C ATOM 3189 C THR B 145 16.361 20.842 -9.341 1.00 22.37 C ATOM 3190 O THR B 145 17.162 21.728 -9.025 1.00 25.97 O ATOM 3191 CB THR B 145 14.957 20.897 -7.284 1.00 22.05 C ATOM 3192 OG1 THR B 145 15.540 22.114 -6.803 1.00 39.93 O ATOM 3193 CG2 THR B 145 15.780 19.726 -6.781 1.00 15.71 C ATOM 3194 HG1 THR B 145 16.465 22.193 -7.146 1.00 0.00 H ATOM 3195 H THR B 145 13.917 19.006 -8.696 1.00 0.00 H ATOM 3196 N GLY B 146 16.689 19.828 -10.137 1.00 18.01 N ATOM 3197 CA GLY B 146 18.056 19.600 -10.545 1.00 16.38 C ATOM 3198 C GLY B 146 18.830 18.855 -9.474 1.00 17.90 C ATOM 3199 O GLY B 146 18.291 18.435 -8.446 1.00 18.97 O ATOM 3200 H GLY B 146 15.944 19.185 -10.473 1.00 0.00 H ATOM 3201 N LEU B 147 20.124 18.689 -9.728 1.00 19.48 N ATOM 3202 CA LEU B 147 21.020 18.056 -8.768 1.00 13.22 C ATOM 3203 C LEU B 147 21.514 19.122 -7.798 1.00 17.45 C ATOM 3204 O LEU B 147 22.227 20.049 -8.194 1.00 16.35 O ATOM 3205 CB LEU B 147 22.187 17.372 -9.474 1.00 15.82 C ATOM 3206 CG LEU B 147 23.082 16.541 -8.552 1.00 21.92 C ATOM 3207 CD1 LEU B 147 22.311 15.355 -7.991 1.00 21.37 C ATOM 3208 CD2 LEU B 147 24.338 16.080 -9.272 1.00 23.99 C ATOM 3209 H LEU B 147 20.508 19.020 -10.636 1.00 0.00 H ATOM 3210 N ILE B 148 21.131 18.994 -6.531 1.00 16.53 N ATOM 3211 CA ILE B 148 21.517 19.941 -5.494 1.00 18.94 C ATOM 3212 C ILE B 148 22.739 19.399 -4.769 1.00 18.69 C ATOM 3213 O ILE B 148 22.747 18.244 -4.325 1.00 17.20 O ATOM 3214 CB ILE B 148 20.365 20.195 -4.508 1.00 21.24 C ATOM 3215 CG1 ILE B 148 19.092 20.592 -5.260 1.00 17.09 C ATOM 3216 CG2 ILE B 148 20.758 21.275 -3.519 1.00 18.35 C ATOM 3217 CD1 ILE B 148 19.211 21.892 -6.018 1.00 22.52 C ATOM 3218 H ILE B 148 20.532 18.185 -6.270 1.00 0.00 H ATOM 3219 N GLN B 149 23.769 20.230 -4.647 1.00 20.94 N ATOM 3220 CA GLN B 149 24.998 19.873 -3.949 1.00 17.68 C ATOM 3221 C GLN B 149 24.915 20.431 -2.532 1.00 20.64 C ATOM 3222 O GLN B 149 24.937 21.651 -2.337 1.00 29.99 O ATOM 3223 CB GLN B 149 26.215 20.416 -4.694 1.00 22.50 C ATOM 3224 CG GLN B 149 27.519 19.708 -4.373 1.00 29.02 C ATOM 3225 CD GLN B 149 28.652 20.143 -5.284 1.00 39.95 C ATOM 3226 OE1 GLN B 149 28.707 21.294 -5.720 1.00 37.88 O ATOM 3227 NE2 GLN B 149 29.559 19.220 -5.582 1.00 34.30 N ATOM 3228 HE22 GLN B 149 29.472 18.260 -5.191 1.00 0.00 H ATOM 3229 HE21 GLN B 149 30.356 19.457 -6.207 1.00 0.00 H ATOM 3230 H GLN B 149 23.695 21.178 -5.069 1.00 0.00 H ATOM 3231 N ASN B 150 24.811 19.539 -1.545 1.00 18.07 N ATOM 3232 CA ASN B 150 24.679 19.964 -0.156 1.00 16.44 C ATOM 3233 C ASN B 150 25.981 20.492 0.432 1.00 18.40 C ATOM 3234 O ASN B 150 25.959 21.040 1.540 1.00 18.44 O ATOM 3235 CB ASN B 150 24.161 18.806 0.699 1.00 13.46 C ATOM 3236 CG ASN B 150 22.731 18.426 0.363 1.00 22.09 C ATOM 3237 OD1 ASN B 150 21.910 19.283 0.035 1.00 18.30 O ATOM 3238 ND2 ASN B 150 22.427 17.135 0.444 1.00 15.49 N ATOM 3239 HD22 ASN B 150 23.154 16.446 0.726 1.00 0.00 H ATOM 3240 HD21 ASN B 150 21.462 16.813 0.226 1.00 0.00 H ATOM 3241 H ASN B 150 24.824 18.524 -1.770 1.00 0.00 H ATOM 3242 N GLY B 151 27.104 20.343 -0.269 1.00 17.64 N ATOM 3243 CA GLY B 151 28.379 20.829 0.213 1.00 14.64 C ATOM 3244 C GLY B 151 29.043 19.976 1.271 1.00 20.15 C ATOM 3245 O GLY B 151 30.088 20.379 1.798 1.00 17.86 O ATOM 3246 H GLY B 151 27.063 19.863 -1.191 1.00 0.00 H ATOM 3247 N ASP B 152 28.482 18.815 1.601 1.00 17.59 N ATOM 3248 CA ASP B 152 29.031 17.931 2.624 1.00 18.55 C ATOM 3249 C ASP B 152 29.214 16.523 2.075 1.00 17.03 C ATOM 3250 O ASP B 152 29.011 15.530 2.781 1.00 20.45 O ATOM 3251 CB ASP B 152 28.144 17.919 3.868 1.00 20.61 C ATOM 3252 CG ASP B 152 26.761 17.353 3.597 1.00 20.06 C ATOM 3253 OD1 ASP B 152 26.365 17.277 2.415 1.00 17.99 O ATOM 3254 OD2 ASP B 152 26.068 16.986 4.569 1.00 25.67 O ATOM 3255 H ASP B 152 27.614 18.525 1.108 1.00 0.00 H ATOM 3256 N TRP B 153 29.598 16.424 0.800 1.00 14.57 N ATOM 3257 CA TRP B 153 29.802 15.145 0.115 1.00 18.85 C ATOM 3258 C TRP B 153 28.510 14.339 0.013 1.00 22.67 C ATOM 3259 O TRP B 153 28.536 13.107 -0.052 1.00 18.72 O ATOM 3260 CB TRP B 153 30.903 14.316 0.786 1.00 19.94 C ATOM 3261 CG TRP B 153 32.270 14.900 0.620 1.00 19.64 C ATOM 3262 CD1 TRP B 153 32.837 15.888 1.371 1.00 16.98 C ATOM 3263 CD2 TRP B 153 33.245 14.533 -0.363 1.00 19.63 C ATOM 3264 NE1 TRP B 153 34.106 16.159 0.916 1.00 21.84 N ATOM 3265 CE2 TRP B 153 34.380 15.340 -0.148 1.00 17.13 C ATOM 3266 CE3 TRP B 153 33.269 13.600 -1.404 1.00 17.47 C ATOM 3267 CZ2 TRP B 153 35.525 15.242 -0.935 1.00 20.14 C ATOM 3268 CZ3 TRP B 153 34.407 13.504 -2.183 1.00 20.76 C ATOM 3269 CH2 TRP B 153 35.519 14.320 -1.945 1.00 19.60 C ATOM 3270 HE1 TRP B 153 34.752 16.870 1.314 1.00 0.00 H ATOM 3271 H TRP B 153 29.761 17.301 0.265 1.00 0.00 H ATOM 3272 N THR B 154 27.369 15.026 0.003 1.00 16.08 N ATOM 3273 CA THR B 154 26.079 14.407 -0.263 1.00 18.78 C ATOM 3274 C THR B 154 25.300 15.276 -1.238 1.00 16.64 C ATOM 3275 O THR B 154 25.462 16.499 -1.272 1.00 14.65 O ATOM 3276 CB THR B 154 25.247 14.203 1.017 1.00 22.95 C ATOM 3277 OG1 THR B 154 25.011 15.468 1.648 1.00 27.47 O ATOM 3278 CG2 THR B 154 25.959 13.269 1.991 1.00 13.45 C ATOM 3279 HG1 THR B 154 25.878 15.885 1.883 1.00 0.00 H ATOM 3280 H THR B 154 27.401 16.048 0.193 1.00 0.00 H ATOM 3281 N PHE B 155 24.456 14.632 -2.036 1.00 15.77 N ATOM 3282 CA PHE B 155 23.591 15.312 -2.986 1.00 17.36 C ATOM 3283 C PHE B 155 22.134 15.080 -2.612 1.00 17.38 C ATOM 3284 O PHE B 155 21.811 14.280 -1.730 1.00 13.84 O ATOM 3285 CB PHE B 155 23.847 14.830 -4.420 1.00 17.12 C ATOM 3286 CG PHE B 155 25.164 15.272 -4.987 1.00 20.38 C ATOM 3287 CD1 PHE B 155 26.297 14.491 -4.832 1.00 22.31 C ATOM 3288 CD2 PHE B 155 25.267 16.463 -5.684 1.00 20.81 C ATOM 3289 CE1 PHE B 155 27.510 14.893 -5.359 1.00 20.90 C ATOM 3290 CE2 PHE B 155 26.476 16.871 -6.213 1.00 23.74 C ATOM 3291 CZ PHE B 155 27.599 16.086 -6.050 1.00 21.45 C ATOM 3292 H PHE B 155 24.412 13.595 -1.979 1.00 0.00 H ATOM 3293 N GLN B 156 21.251 15.797 -3.301 1.00 15.43 N ATOM 3294 CA GLN B 156 19.818 15.601 -3.149 1.00 16.98 C ATOM 3295 C GLN B 156 19.117 16.177 -4.369 1.00 19.62 C ATOM 3296 O GLN B 156 19.666 17.022 -5.081 1.00 18.81 O ATOM 3297 CB GLN B 156 19.282 16.247 -1.867 1.00 16.68 C ATOM 3298 CG GLN B 156 19.416 17.758 -1.828 1.00 18.29 C ATOM 3299 CD GLN B 156 18.464 18.396 -0.837 1.00 20.59 C ATOM 3300 OE1 GLN B 156 17.249 18.213 -0.921 1.00 25.25 O ATOM 3301 NE2 GLN B 156 19.010 19.148 0.110 1.00 18.56 N ATOM 3302 HE22 GLN B 156 20.042 19.275 0.143 1.00 0.00 H ATOM 3303 HE21 GLN B 156 18.406 19.610 0.819 1.00 0.00 H ATOM 3304 H GLN B 156 21.595 16.518 -3.967 1.00 0.00 H ATOM 3305 N THR B 157 17.894 15.705 -4.600 1.00 19.11 N ATOM 3306 CA THR B 157 17.086 16.211 -5.699 1.00 17.32 C ATOM 3307 C THR B 157 15.620 15.905 -5.425 1.00 21.76 C ATOM 3308 O THR B 157 15.290 14.859 -4.860 1.00 23.21 O ATOM 3309 CB THR B 157 17.515 15.608 -7.045 1.00 18.50 C ATOM 3310 OG1 THR B 157 16.692 16.137 -8.093 1.00 19.90 O ATOM 3311 CG2 THR B 157 17.398 14.089 -7.029 1.00 16.29 C ATOM 3312 HG1 THR B 157 16.793 17.121 -8.126 1.00 0.00 H ATOM 3313 H THR B 157 17.509 14.961 -3.984 1.00 0.00 H ATOM 3314 N LEU B 158 14.756 16.837 -5.811 1.00 21.43 N ATOM 3315 CA LEU B 158 13.313 16.650 -5.792 1.00 16.02 C ATOM 3316 C LEU B 158 12.835 16.466 -7.224 1.00 18.80 C ATOM 3317 O LEU B 158 13.161 17.275 -8.098 1.00 16.32 O ATOM 3318 CB LEU B 158 12.603 17.846 -5.152 1.00 20.65 C ATOM 3319 CG LEU B 158 12.946 18.220 -3.709 1.00 23.26 C ATOM 3320 CD1 LEU B 158 12.252 19.516 -3.321 1.00 18.11 C ATOM 3321 CD2 LEU B 158 12.552 17.106 -2.761 1.00 25.40 C ATOM 3322 H LEU B 158 15.130 17.748 -6.144 1.00 0.00 H ATOM 3323 N VAL B 159 12.077 15.400 -7.465 1.00 19.17 N ATOM 3324 CA VAL B 159 11.501 15.117 -8.774 1.00 16.23 C ATOM 3325 C VAL B 159 9.992 15.054 -8.594 1.00 21.13 C ATOM 3326 O VAL B 159 9.471 14.122 -7.967 1.00 22.85 O ATOM 3327 CB VAL B 159 12.048 13.819 -9.381 1.00 18.79 C ATOM 3328 CG1 VAL B 159 11.431 13.570 -10.748 1.00 12.69 C ATOM 3329 CG2 VAL B 159 13.566 13.885 -9.483 1.00 13.89 C ATOM 3330 H VAL B 159 11.887 14.739 -6.685 1.00 0.00 H ATOM 3331 N MET B 160 9.291 16.042 -9.140 1.00 24.48 N ATOM 3332 CA MET B 160 7.863 16.212 -8.922 1.00 22.62 C ATOM 3333 C MET B 160 7.076 15.808 -10.161 1.00 22.81 C ATOM 3334 O MET B 160 7.504 16.059 -11.292 1.00 24.04 O ATOM 3335 CB MET B 160 7.541 17.662 -8.550 1.00 22.54 C ATOM 3336 CG MET B 160 8.018 18.057 -7.164 1.00 22.05 C ATOM 3337 SD MET B 160 8.908 19.623 -7.135 1.00 42.20 S ATOM 3338 CE MET B 160 10.439 19.156 -7.936 1.00 22.23 C ATOM 3339 H MET B 160 9.785 16.724 -9.750 1.00 0.00 H ATOM 3340 N LEU B 161 5.924 15.185 -9.936 1.00 22.69 N ATOM 3341 CA LEU B 161 5.018 14.768 -10.997 1.00 27.01 C ATOM 3342 C LEU B 161 3.721 15.559 -10.890 1.00 29.11 C ATOM 3343 O LEU B 161 3.091 15.588 -9.829 1.00 24.77 O ATOM 3344 CB LEU B 161 4.731 13.267 -10.916 1.00 25.88 C ATOM 3345 CG LEU B 161 3.700 12.711 -11.901 1.00 30.01 C ATOM 3346 CD1 LEU B 161 4.113 13.008 -13.335 1.00 27.85 C ATOM 3347 CD2 LEU B 161 3.502 11.216 -11.692 1.00 22.21 C ATOM 3348 H LEU B 161 5.656 14.985 -8.951 1.00 0.00 H ATOM 3349 N GLU B 162 3.330 16.201 -11.986 1.00 30.97 N ATOM 3350 CA GLU B 162 2.073 16.937 -12.058 1.00 28.47 C ATOM 3351 C GLU B 162 0.984 15.977 -12.518 1.00 23.07 C ATOM 3352 O GLU B 162 0.958 15.566 -13.682 1.00 24.62 O ATOM 3353 CB GLU B 162 2.196 18.127 -13.006 1.00 34.02 C ATOM 3354 CG GLU B 162 3.590 18.723 -13.082 1.00 47.80 C ATOM 3355 CD GLU B 162 3.727 19.759 -14.186 1.00 59.44 C ATOM 3356 OE1 GLU B 162 4.398 20.794 -13.966 1.00 48.88 O ATOM 3357 OE2 GLU B 162 3.145 19.552 -15.278 1.00 64.02 O ATOM 3358 H GLU B 162 3.944 16.178 -12.825 1.00 0.00 H ATOM 3359 N THR B 163 0.087 15.618 -11.604 1.00 25.51 N ATOM 3360 CA THR B 163 -0.940 14.630 -11.898 1.00 27.59 C ATOM 3361 C THR B 163 -2.107 14.830 -10.942 1.00 26.41 C ATOM 3362 O THR B 163 -1.954 15.391 -9.854 1.00 24.70 O ATOM 3363 CB THR B 163 -0.390 13.203 -11.779 1.00 26.25 C ATOM 3364 OG1 THR B 163 -1.379 12.266 -12.217 1.00 30.96 O ATOM 3365 CG2 THR B 163 -0.008 12.893 -10.339 1.00 23.59 C ATOM 3366 HG1 THR B 163 -1.019 11.347 -12.138 1.00 0.00 H ATOM 3367 H THR B 163 0.120 16.052 -10.660 1.00 0.00 H ATOM 3368 N VAL B 164 -3.280 14.369 -11.366 1.00 25.59 N ATOM 3369 CA VAL B 164 -4.466 14.343 -10.514 1.00 26.04 C ATOM 3370 C VAL B 164 -4.667 12.898 -10.047 1.00 30.81 C ATOM 3371 O VAL B 164 -4.916 12.017 -10.884 1.00 27.80 O ATOM 3372 CB VAL B 164 -5.704 14.903 -11.232 1.00 28.72 C ATOM 3373 CG1 VAL B 164 -5.498 16.378 -11.544 1.00 24.62 C ATOM 3374 CG2 VAL B 164 -6.007 14.154 -12.525 1.00 30.50 C ATOM 3375 H VAL B 164 -3.356 14.014 -12.341 1.00 0.00 H ATOM 3376 N PRO B 165 -4.515 12.609 -8.757 1.00 30.96 N ATOM 3377 CA PRO B 165 -4.608 11.213 -8.310 1.00 34.63 C ATOM 3378 C PRO B 165 -6.044 10.714 -8.299 1.00 37.06 C ATOM 3379 O PRO B 165 -6.981 11.461 -8.004 1.00 36.73 O ATOM 3380 CB PRO B 165 -4.022 11.254 -6.891 1.00 31.34 C ATOM 3381 CG PRO B 165 -3.276 12.553 -6.806 1.00 25.86 C ATOM 3382 CD PRO B 165 -4.021 13.497 -7.694 1.00 27.47 C ATOM 3383 N ARG B 166 -6.206 9.435 -8.621 1.00 36.28 N ATOM 3384 CA ARG B 166 -7.485 8.747 -8.541 1.00 38.92 C ATOM 3385 C ARG B 166 -7.508 7.787 -7.359 1.00 44.58 C ATOM 3386 O ARG B 166 -6.479 7.447 -6.765 1.00 48.08 O ATOM 3387 CB ARG B 166 -7.784 7.967 -9.828 1.00 41.02 C ATOM 3388 CG ARG B 166 -8.704 8.658 -10.802 1.00 39.53 C ATOM 3389 CD ARG B 166 -7.904 9.276 -11.888 1.00 40.43 C ATOM 3390 NE ARG B 166 -8.717 9.489 -13.082 1.00 47.52 N ATOM 3391 CZ ARG B 166 -8.779 10.615 -13.784 1.00 41.66 C ATOM 3392 NH1 ARG B 166 -8.052 11.647 -13.389 1.00 41.55 N ATOM 3393 NH2 ARG B 166 -9.555 10.677 -14.847 1.00 34.41 N ATOM 3394 HE ARG B 166 -9.297 8.691 -13.411 1.00 0.00 H ATOM 3395 HH12 ARG B 166 -8.083 12.540 -13.922 1.00 0.00 H ATOM 3396 HH11 ARG B 166 -7.449 11.566 -12.546 1.00 0.00 H ATOM 3397 HH22 ARG B 166 -9.608 11.555 -15.401 1.00 0.00 H ATOM 3398 HH21 ARG B 166 -10.114 9.848 -15.132 1.00 0.00 H ATOM 3399 H ARG B 166 -5.376 8.899 -8.947 1.00 0.00 H ATOM 3400 N SER B 167 -8.718 7.349 -7.031 1.00 47.66 N ATOM 3401 CA SER B 167 -8.881 6.259 -6.085 1.00 43.67 C ATOM 3402 C SER B 167 -8.289 4.980 -6.664 1.00 45.47 C ATOM 3403 O SER B 167 -8.485 4.659 -7.840 1.00 40.24 O ATOM 3404 CB SER B 167 -10.361 6.061 -5.762 1.00 44.23 C ATOM 3405 OG SER B 167 -11.091 5.700 -6.922 1.00 45.42 O ATOM 3406 HG SER B 167 -10.730 4.854 -7.288 1.00 0.00 H ATOM 3407 H SER B 167 -9.558 7.791 -7.456 1.00 0.00 H ATOM 3408 N GLY B 168 -7.546 4.258 -5.831 1.00 42.51 N ATOM 3409 CA GLY B 168 -6.935 3.020 -6.267 1.00 49.37 C ATOM 3410 C GLY B 168 -5.756 3.172 -7.198 1.00 47.78 C ATOM 3411 O GLY B 168 -5.253 2.164 -7.701 1.00 47.35 O ATOM 3412 H GLY B 168 -7.402 4.586 -4.855 1.00 0.00 H ATOM 3413 N GLU B 169 -5.301 4.397 -7.452 1.00 45.53 N ATOM 3414 CA GLU B 169 -4.125 4.610 -8.284 1.00 45.56 C ATOM 3415 C GLU B 169 -2.864 4.461 -7.445 1.00 45.56 C ATOM 3416 O GLU B 169 -2.776 5.001 -6.338 1.00 39.98 O ATOM 3417 CB GLU B 169 -4.167 5.994 -8.932 1.00 38.18 C ATOM 3418 CG GLU B 169 -4.480 5.978 -10.418 1.00 36.57 C ATOM 3419 CD GLU B 169 -4.435 7.361 -11.036 1.00 40.15 C ATOM 3420 OE1 GLU B 169 -4.311 8.348 -10.280 1.00 39.81 O ATOM 3421 OE2 GLU B 169 -4.520 7.462 -12.278 1.00 44.75 O ATOM 3422 H GLU B 169 -5.795 5.218 -7.048 1.00 0.00 H ATOM 3423 N VAL B 170 -1.888 3.727 -7.973 1.00 42.65 N ATOM 3424 CA VAL B 170 -0.613 3.506 -7.301 1.00 43.22 C ATOM 3425 C VAL B 170 0.486 4.132 -8.147 1.00 37.64 C ATOM 3426 O VAL B 170 0.732 3.697 -9.279 1.00 41.48 O ATOM 3427 CB VAL B 170 -0.338 2.013 -7.062 1.00 37.44 C ATOM 3428 CG1 VAL B 170 1.114 1.801 -6.661 1.00 35.71 C ATOM 3429 CG2 VAL B 170 -1.269 1.471 -5.990 1.00 41.79 C ATOM 3430 H VAL B 170 -2.041 3.292 -8.905 1.00 0.00 H ATOM 3431 N TYR B 171 1.134 5.155 -7.603 1.00 34.76 N ATOM 3432 CA TYR B 171 2.321 5.747 -8.198 1.00 36.29 C ATOM 3433 C TYR B 171 3.559 5.217 -7.486 1.00 36.54 C ATOM 3434 O TYR B 171 3.527 4.926 -6.288 1.00 40.36 O ATOM 3435 CB TYR B 171 2.288 7.274 -8.102 1.00 28.45 C ATOM 3436 CG TYR B 171 1.125 7.929 -8.813 1.00 34.29 C ATOM 3437 CD1 TYR B 171 -0.119 8.031 -8.204 1.00 35.88 C ATOM 3438 CD2 TYR B 171 1.277 8.461 -10.087 1.00 32.94 C ATOM 3439 CE1 TYR B 171 -1.182 8.635 -8.848 1.00 30.89 C ATOM 3440 CE2 TYR B 171 0.220 9.068 -10.737 1.00 34.37 C ATOM 3441 CZ TYR B 171 -1.007 9.151 -10.114 1.00 36.68 C ATOM 3442 OH TYR B 171 -2.062 9.753 -10.759 1.00 39.35 O ATOM 3443 HH TYR B 171 -2.862 9.728 -10.176 1.00 0.00 H ATOM 3444 H TYR B 171 0.776 5.551 -6.710 1.00 0.00 H ATOM 3445 N THR B 172 4.653 5.089 -8.232 1.00 35.65 N ATOM 3446 CA THR B 172 5.916 4.669 -7.644 1.00 34.12 C ATOM 3447 C THR B 172 7.056 5.471 -8.251 1.00 30.82 C ATOM 3448 O THR B 172 7.072 5.740 -9.456 1.00 24.43 O ATOM 3449 CB THR B 172 6.167 3.163 -7.829 1.00 28.66 C ATOM 3450 OG1 THR B 172 7.480 2.834 -7.357 1.00 42.99 O ATOM 3451 CG2 THR B 172 6.048 2.764 -9.284 1.00 27.98 C ATOM 3452 HG1 THR B 172 7.552 3.065 -6.397 1.00 0.00 H ATOM 3453 H THR B 172 4.605 5.292 -9.251 1.00 0.00 H ATOM 3454 N CYS B 173 8.000 5.861 -7.400 1.00 28.44 N ATOM 3455 CA CYS B 173 9.183 6.604 -7.810 1.00 32.33 C ATOM 3456 C CYS B 173 10.373 5.652 -7.826 1.00 27.19 C ATOM 3457 O CYS B 173 10.671 5.010 -6.814 1.00 25.34 O ATOM 3458 CB CYS B 173 9.437 7.778 -6.864 1.00 27.27 C ATOM 3459 SG CYS B 173 10.902 8.746 -7.258 1.00 44.72 S ATOM 3460 H CYS B 173 7.888 5.624 -6.394 1.00 0.00 H ATOM 3461 N GLN B 174 11.045 5.562 -8.970 1.00 26.75 N ATOM 3462 CA GLN B 174 12.150 4.632 -9.167 1.00 30.41 C ATOM 3463 C GLN B 174 13.466 5.396 -9.199 1.00 27.16 C ATOM 3464 O GLN B 174 13.580 6.416 -9.887 1.00 31.16 O ATOM 3465 CB GLN B 174 11.964 3.835 -10.460 1.00 29.02 C ATOM 3466 CG GLN B 174 13.044 2.802 -10.714 1.00 25.27 C ATOM 3467 CD GLN B 174 12.662 1.828 -11.808 1.00 28.36 C ATOM 3468 OE1 GLN B 174 11.943 0.858 -11.566 1.00 33.66 O ATOM 3469 NE2 GLN B 174 13.138 2.083 -13.021 1.00 30.72 N ATOM 3470 HE22 GLN B 174 13.742 2.915 -13.178 1.00 0.00 H ATOM 3471 HE21 GLN B 174 12.907 1.451 -13.814 1.00 0.00 H ATOM 3472 H GLN B 174 10.770 6.182 -9.758 1.00 0.00 H ATOM 3473 N VAL B 175 14.456 4.899 -8.459 1.00 29.56 N ATOM 3474 CA VAL B 175 15.744 5.564 -8.304 1.00 25.07 C ATOM 3475 C VAL B 175 16.851 4.589 -8.678 1.00 27.05 C ATOM 3476 O VAL B 175 16.923 3.484 -8.129 1.00 26.73 O ATOM 3477 CB VAL B 175 15.949 6.080 -6.867 1.00 21.54 C ATOM 3478 CG1 VAL B 175 17.266 6.829 -6.757 1.00 28.32 C ATOM 3479 CG2 VAL B 175 14.787 6.966 -6.445 1.00 23.56 C ATOM 3480 H VAL B 175 14.303 3.994 -7.969 1.00 0.00 H ATOM 3481 N GLU B 176 17.714 5.001 -9.604 1.00 28.33 N ATOM 3482 CA GLU B 176 18.901 4.244 -9.979 1.00 24.65 C ATOM 3483 C GLU B 176 20.139 5.056 -9.626 1.00 19.31 C ATOM 3484 O GLU B 176 20.184 6.268 -9.861 1.00 20.97 O ATOM 3485 CB GLU B 176 18.897 3.904 -11.473 1.00 24.50 C ATOM 3486 CG GLU B 176 17.638 3.194 -11.940 1.00 35.15 C ATOM 3487 CD GLU B 176 17.679 2.843 -13.414 1.00 47.66 C ATOM 3488 OE1 GLU B 176 18.284 1.807 -13.763 1.00 51.84 O ATOM 3489 OE2 GLU B 176 17.113 3.607 -14.224 1.00 51.24 O ATOM 3490 H GLU B 176 17.532 5.906 -10.083 1.00 0.00 H ATOM 3491 N HIS B 177 21.143 4.386 -9.063 1.00 22.90 N ATOM 3492 CA HIS B 177 22.301 5.072 -8.506 1.00 24.20 C ATOM 3493 C HIS B 177 23.452 4.082 -8.412 1.00 26.77 C ATOM 3494 O HIS B 177 23.220 2.896 -8.153 1.00 24.86 O ATOM 3495 CB HIS B 177 21.969 5.656 -7.124 1.00 21.05 C ATOM 3496 CG HIS B 177 23.033 6.548 -6.566 1.00 21.86 C ATOM 3497 ND1 HIS B 177 23.869 6.157 -5.544 1.00 21.62 N ATOM 3498 CD2 HIS B 177 23.390 7.816 -6.880 1.00 20.41 C ATOM 3499 CE1 HIS B 177 24.699 7.143 -5.254 1.00 25.34 C ATOM 3500 NE2 HIS B 177 24.430 8.161 -6.052 1.00 21.78 N ATOM 3501 H HIS B 177 21.099 3.348 -9.020 1.00 0.00 H ATOM 3502 N PRO B 178 24.694 4.529 -8.622 1.00 29.50 N ATOM 3503 CA PRO B 178 25.834 3.597 -8.555 1.00 26.97 C ATOM 3504 C PRO B 178 26.001 2.911 -7.208 1.00 26.37 C ATOM 3505 O PRO B 178 26.696 1.890 -7.136 1.00 25.41 O ATOM 3506 CB PRO B 178 27.038 4.494 -8.875 1.00 17.57 C ATOM 3507 CG PRO B 178 26.466 5.608 -9.684 1.00 26.02 C ATOM 3508 CD PRO B 178 25.095 5.855 -9.123 1.00 25.78 C ATOM 3509 N SER B 179 25.402 3.436 -6.140 1.00 24.06 N ATOM 3510 CA SER B 179 25.446 2.769 -4.845 1.00 28.19 C ATOM 3511 C SER B 179 24.469 1.606 -4.748 1.00 29.99 C ATOM 3512 O SER B 179 24.591 0.791 -3.827 1.00 30.97 O ATOM 3513 CB SER B 179 25.152 3.771 -3.729 1.00 26.44 C ATOM 3514 OG SER B 179 23.895 4.388 -3.940 1.00 27.71 O ATOM 3515 HG SER B 179 23.904 4.864 -4.808 1.00 0.00 H ATOM 3516 H SER B 179 24.894 4.339 -6.232 1.00 0.00 H ATOM 3517 N LEU B 180 23.514 1.511 -5.665 1.00 25.19 N ATOM 3518 CA LEU B 180 22.502 0.468 -5.646 1.00 25.24 C ATOM 3519 C LEU B 180 22.811 -0.594 -6.694 1.00 27.91 C ATOM 3520 O LEU B 180 23.362 -0.302 -7.758 1.00 23.08 O ATOM 3521 CB LEU B 180 21.114 1.056 -5.906 1.00 24.45 C ATOM 3522 CG LEU B 180 20.723 2.302 -5.108 1.00 22.73 C ATOM 3523 CD1 LEU B 180 19.462 2.928 -5.683 1.00 24.43 C ATOM 3524 CD2 LEU B 180 20.532 1.963 -3.639 1.00 18.98 C ATOM 3525 H LEU B 180 23.489 2.214 -6.431 1.00 0.00 H ATOM 3526 N THR B 181 22.449 -1.837 -6.378 1.00 31.36 N ATOM 3527 CA THR B 181 22.526 -2.933 -7.333 1.00 29.29 C ATOM 3528 C THR B 181 21.195 -3.212 -8.018 1.00 29.29 C ATOM 3529 O THR B 181 21.173 -3.917 -9.032 1.00 36.01 O ATOM 3530 CB THR B 181 23.024 -4.211 -6.645 1.00 25.28 C ATOM 3531 OG1 THR B 181 22.387 -4.350 -5.369 1.00 25.20 O ATOM 3532 CG2 THR B 181 24.533 -4.162 -6.454 1.00 28.81 C ATOM 3533 HG1 THR B 181 22.711 -5.175 -4.928 1.00 0.00 H ATOM 3534 H THR B 181 22.100 -2.030 -5.418 1.00 0.00 H ATOM 3535 N SER B 182 20.095 -2.678 -7.492 1.00 26.82 N ATOM 3536 CA SER B 182 18.773 -2.813 -8.084 1.00 33.55 C ATOM 3537 C SER B 182 18.013 -1.521 -7.824 1.00 35.00 C ATOM 3538 O SER B 182 18.320 -0.813 -6.857 1.00 32.63 O ATOM 3539 CB SER B 182 18.011 -4.015 -7.505 1.00 21.55 C ATOM 3540 OG SER B 182 17.633 -3.786 -6.160 1.00 30.90 O ATOM 3541 HG SER B 182 17.047 -2.989 -6.114 1.00 0.00 H ATOM 3542 H SER B 182 20.186 -2.135 -6.610 1.00 0.00 H ATOM 3543 N PRO B 183 17.033 -1.181 -8.663 1.00 31.24 N ATOM 3544 CA PRO B 183 16.371 0.126 -8.529 1.00 24.77 C ATOM 3545 C PRO B 183 15.605 0.243 -7.219 1.00 28.95 C ATOM 3546 O PRO B 183 14.851 -0.655 -6.838 1.00 40.54 O ATOM 3547 CB PRO B 183 15.425 0.172 -9.737 1.00 27.01 C ATOM 3548 CG PRO B 183 15.977 -0.827 -10.699 1.00 30.44 C ATOM 3549 CD PRO B 183 16.564 -1.912 -9.852 1.00 28.06 C ATOM 3550 N LEU B 184 15.810 1.364 -6.532 1.00 27.48 N ATOM 3551 CA LEU B 184 15.055 1.681 -5.328 1.00 26.86 C ATOM 3552 C LEU B 184 13.688 2.229 -5.719 1.00 32.57 C ATOM 3553 O LEU B 184 13.586 3.096 -6.593 1.00 40.99 O ATOM 3554 CB LEU B 184 15.819 2.701 -4.483 1.00 30.71 C ATOM 3555 CG LEU B 184 15.572 2.750 -2.975 1.00 30.66 C ATOM 3556 CD1 LEU B 184 15.819 1.390 -2.348 1.00 33.43 C ATOM 3557 CD2 LEU B 184 16.464 3.800 -2.332 1.00 23.65 C ATOM 3558 H LEU B 184 16.532 2.034 -6.865 1.00 0.00 H ATOM 3559 N THR B 185 12.633 1.715 -5.087 1.00 29.30 N ATOM 3560 CA THR B 185 11.270 2.127 -5.397 1.00 25.94 C ATOM 3561 C THR B 185 10.513 2.449 -4.117 1.00 25.58 C ATOM 3562 O THR B 185 10.657 1.756 -3.106 1.00 25.70 O ATOM 3563 CB THR B 185 10.502 1.044 -6.177 1.00 29.30 C ATOM 3564 OG1 THR B 185 10.183 -0.045 -5.302 1.00 43.39 O ATOM 3565 CG2 THR B 185 11.322 0.528 -7.353 1.00 29.17 C ATOM 3566 HG1 THR B 185 9.621 0.285 -4.557 1.00 0.00 H ATOM 3567 H THR B 185 12.787 0.998 -4.350 1.00 0.00 H ATOM 3568 N VAL B 186 9.707 3.507 -4.174 1.00 28.70 N ATOM 3569 CA VAL B 186 8.789 3.881 -3.104 1.00 24.53 C ATOM 3570 C VAL B 186 7.439 4.176 -3.740 1.00 27.22 C ATOM 3571 O VAL B 186 7.367 4.891 -4.745 1.00 33.32 O ATOM 3572 CB VAL B 186 9.294 5.100 -2.307 1.00 30.46 C ATOM 3573 CG1 VAL B 186 8.255 5.539 -1.285 1.00 25.14 C ATOM 3574 CG2 VAL B 186 10.612 4.780 -1.622 1.00 27.07 C ATOM 3575 H VAL B 186 9.733 4.099 -5.028 1.00 0.00 H ATOM 3576 N GLU B 187 6.375 3.625 -3.164 1.00 34.68 N ATOM 3577 CA GLU B 187 5.042 3.734 -3.736 1.00 34.13 C ATOM 3578 C GLU B 187 4.188 4.725 -2.954 1.00 31.19 C ATOM 3579 O GLU B 187 4.441 5.017 -1.782 1.00 31.88 O ATOM 3580 CB GLU B 187 4.350 2.368 -3.780 1.00 27.13 C ATOM 3581 CG GLU B 187 5.018 1.376 -4.717 1.00 37.34 C ATOM 3582 CD GLU B 187 4.161 0.154 -4.978 1.00 36.21 C ATOM 3583 OE1 GLU B 187 4.450 -0.577 -5.949 1.00 36.02 O ATOM 3584 OE2 GLU B 187 3.198 -0.072 -4.216 1.00 47.09 O ATOM 3585 H GLU B 187 6.500 3.099 -2.276 1.00 0.00 H ATOM 3586 N TRP B 188 3.163 5.239 -3.632 1.00 23.08 N ATOM 3587 CA TRP B 188 2.239 6.201 -3.048 1.00 25.83 C ATOM 3588 C TRP B 188 0.863 5.981 -3.656 1.00 32.20 C ATOM 3589 O TRP B 188 0.733 5.892 -4.880 1.00 25.45 O ATOM 3590 CB TRP B 188 2.709 7.640 -3.295 1.00 28.56 C ATOM 3591 CG TRP B 188 1.814 8.686 -2.700 1.00 29.36 C ATOM 3592 CD1 TRP B 188 1.959 9.292 -1.486 1.00 28.34 C ATOM 3593 CD2 TRP B 188 0.640 9.254 -3.295 1.00 27.49 C ATOM 3594 NE1 TRP B 188 0.947 10.200 -1.287 1.00 32.38 N ATOM 3595 CE2 TRP B 188 0.124 10.195 -2.382 1.00 27.02 C ATOM 3596 CE3 TRP B 188 -0.025 9.057 -4.509 1.00 28.32 C ATOM 3597 CZ2 TRP B 188 -1.026 10.937 -2.646 1.00 30.22 C ATOM 3598 CZ3 TRP B 188 -1.166 9.794 -4.768 1.00 29.11 C ATOM 3599 CH2 TRP B 188 -1.655 10.722 -3.841 1.00 30.59 C ATOM 3600 HE1 TRP B 188 0.826 10.794 -0.442 1.00 0.00 H ATOM 3601 H TRP B 188 3.017 4.941 -4.618 1.00 0.00 H ATOM 3602 N ARG B 189 -0.156 5.897 -2.803 1.00 30.39 N ATOM 3603 CA ARG B 189 -1.529 5.709 -3.243 1.00 37.22 C ATOM 3604 C ARG B 189 -2.436 6.698 -2.526 1.00 34.89 C ATOM 3605 O ARG B 189 -2.114 7.200 -1.445 1.00 31.17 O ATOM 3606 CB ARG B 189 -2.012 4.273 -2.992 1.00 28.71 C ATOM 3607 H ARG B 189 0.037 5.969 -1.784 1.00 0.00 H ATOM 3608 N ALA B 190 -3.579 6.975 -3.144 1.00 41.99 N ATOM 3609 CA ALA B 190 -4.556 7.895 -2.573 1.00 40.95 C ATOM 3610 C ALA B 190 -5.693 7.132 -1.900 1.00 34.42 C ATOM 3611 O ALA B 190 -6.247 6.194 -2.472 1.00 39.16 O ATOM 3612 CB ALA B 190 -5.102 8.824 -3.646 1.00 41.38 C ATOM 3613 H ALA B 190 -3.782 6.524 -4.059 1.00 0.00 H TER 3614 ALA B 190 HETATM 3615 O HOH 1 49.305 41.861 0.774 1.00 32.55 O HETATM 3616 O HOH 2 45.838 12.587 9.106 1.00 19.82 O HETATM 3617 O HOH 3 28.285 18.112 -1.616 1.00 25.65 O HETATM 3618 O HOH 4 17.978 41.340 13.586 1.00 21.08 O HETATM 3619 O HOH 5 32.147 15.447 -5.145 1.00 21.89 O HETATM 3620 O HOH 6 32.188 23.265 7.927 1.00 29.97 O HETATM 3621 O HOH 7 37.526 21.288 5.494 1.00 22.79 O HETATM 3622 O HOH 8 12.458 26.452 14.189 1.00 29.23 O HETATM 3623 O HOH 9 26.195 23.515 11.858 1.00 20.74 O HETATM 3624 O HOH 10 12.378 37.501 4.366 1.00 22.18 O HETATM 3625 O HOH 11 52.036 32.085 3.771 1.00 30.69 O HETATM 3626 O HOH 12 16.984 50.507 2.209 1.00 29.43 O HETATM 3627 O HOH 13 20.330 41.950 12.372 1.00 21.64 O HETATM 3628 O HOH 14 29.434 42.537 -12.030 1.00 19.80 O HETATM 3629 O HOH 15 34.841 40.485 -11.931 1.00 24.26 O HETATM 3630 O HOH 16 37.064 35.720 -9.169 1.00 15.69 O HETATM 3631 O HOH 17 20.166 15.652 1.487 1.00 18.28 O HETATM 3632 O HOH 18 13.861 35.499 10.277 1.00 22.73 O HETATM 3633 O HOH 19 34.931 22.416 -8.427 1.00 23.77 O HETATM 3634 O HOH 20 16.040 29.827 -1.607 1.00 18.99 O HETATM 3635 O HOH 21 35.244 24.286 4.545 1.00 18.99 O HETATM 3636 O HOH 22 37.401 46.115 -6.716 1.00 20.08 O HETATM 3637 O HOH 23 47.420 43.978 -4.820 1.00 15.77 O HETATM 3638 O HOH 24 13.449 14.079 7.042 1.00 30.99 O HETATM 3639 O HOH 25 35.817 45.162 -4.593 1.00 21.71 O HETATM 3640 O HOH 26 34.669 16.419 -11.936 1.00 30.01 O HETATM 3641 O HOH 27 32.241 41.406 -1.272 1.00 25.28 O HETATM 3642 O HOH 28 54.852 43.738 -12.679 1.00 28.66 O HETATM 3643 O HOH 29 50.172 33.266 -7.897 1.00 19.76 O HETATM 3644 O HOH 30 32.102 26.094 10.394 1.00 28.26 O HETATM 3645 O HOH 31 57.308 30.427 -0.593 1.00 23.76 O HETATM 3646 O HOH 32 12.797 17.265 9.677 1.00 40.99 O HETATM 3647 O HOH 33 24.376 39.415 7.057 1.00 27.91 O HETATM 3648 O HOH 34 22.362 29.781 -4.712 1.00 16.60 O HETATM 3649 O HOH 35 19.400 34.618 -5.298 1.00 25.89 O HETATM 3650 O HOH 36 34.201 36.821 4.182 1.00 25.68 O HETATM 3651 O HOH 37 37.468 30.098 -8.553 1.00 8.89 O HETATM 3652 O HOH 38 11.203 25.914 12.214 1.00 36.76 O HETATM 3653 O HOH 39 17.339 43.770 2.774 1.00 29.53 O HETATM 3654 O HOH 40 40.170 17.448 10.050 1.00 30.53 O HETATM 3655 O HOH 41 40.585 28.698 7.539 1.00 30.22 O HETATM 3656 O HOH 42 13.658 33.921 17.977 1.00 34.96 O HETATM 3657 O HOH 43 11.582 34.851 18.464 1.00 26.38 O HETATM 3658 O HOH 44 49.164 19.659 9.065 1.00 30.73 O HETATM 3659 O HOH 45 19.897 42.615 -2.618 1.00 27.33 O HETATM 3660 O HOH 46 47.109 15.835 8.110 1.00 20.30 O HETATM 3661 O HOH 47 30.074 35.829 7.470 1.00 22.24 O HETATM 3662 O HOH 48 31.413 23.527 -8.649 1.00 30.81 O HETATM 3663 O HOH 49 30.696 26.975 -12.652 1.00 33.36 O HETATM 3664 O HOH 50 22.233 14.575 3.485 1.00 28.28 O HETATM 3665 O HOH 51 38.800 27.572 9.044 1.00 28.57 O HETATM 3666 O HOH 52 32.646 46.773 -9.130 1.00 22.62 O HETATM 3667 O HOH 53 30.060 47.065 -7.626 1.00 23.66 O HETATM 3668 O HOH 54 49.704 38.538 4.606 1.00 25.97 O HETATM 3669 O HOH 55 10.660 22.964 3.224 1.00 24.51 O HETATM 3670 O HOH 56 56.086 42.277 -14.804 1.00 24.56 O HETATM 3671 O HOH 57 35.328 24.191 -9.817 1.00 20.62 O HETATM 3672 O HOH 58 31.620 24.741 -11.690 1.00 26.95 O HETATM 3673 O HOH 59 22.780 28.935 -7.225 1.00 17.40 O HETATM 3674 O HOH 60 25.105 44.000 1.057 1.00 23.25 O HETATM 3675 O HOH 61 26.037 26.918 -11.958 1.00 25.20 O HETATM 3676 O HOH 62 37.590 41.376 -12.882 1.00 25.76 O HETATM 3677 O HOH 63 24.727 46.121 2.347 1.00 30.38 O HETATM 3678 O HOH 64 52.047 35.101 2.776 1.00 21.09 O HETATM 3679 O HOH 65 49.804 36.149 4.125 1.00 24.53 O HETATM 3680 O HOH 66 58.466 36.105 -8.276 1.00 32.05 O HETATM 3681 O HOH 67 60.063 31.215 -10.938 1.00 25.88 O HETATM 3682 O HOH 68 59.179 29.431 -9.262 1.00 20.15 O HETATM 3683 O HOH 69 45.224 7.000 1.593 1.00 31.32 O HETATM 3684 O HOH 70 37.645 33.851 -16.878 1.00 25.97 O HETATM 3685 O HOH 71 48.281 35.632 -26.012 1.00 22.54 O HETATM 3686 O HOH 72 10.834 16.472 -16.972 1.00 17.85 O HETATM 3687 O HOH 73 61.206 23.078 -23.470 1.00 32.34 O HETATM 3688 O HOH 74 28.708 14.344 4.823 1.00 16.41 O HETATM 3689 O HOH 75 53.583 15.780 -18.119 1.00 19.81 O HETATM 3690 O HOH 76 48.944 14.896 -20.964 1.00 26.95 O HETATM 3691 O HOH 77 43.853 16.531 -24.956 1.00 24.32 O HETATM 3692 O HOH 78 -4.582 9.988 -12.782 1.00 27.89 O HETATM 3693 O HOH 79 45.147 18.719 -7.879 1.00 14.03 O HETATM 3694 O HOH 80 52.628 16.575 -15.851 1.00 18.21 O HETATM 3695 O HOH 81 17.953 -1.415 -4.280 1.00 30.47 O HETATM 3696 O HOH 82 32.053 37.501 -14.759 1.00 25.26 O HETATM 3697 O HOH 83 2.999 2.423 -10.076 1.00 34.84 O HETATM 3698 O HOH 84 54.636 10.566 -17.216 1.00 35.68 O HETATM 3699 O HOH 85 37.626 25.636 -10.688 1.00 14.97 O HETATM 3700 O HOH 86 56.561 17.159 -9.765 1.00 25.40 O HETATM 3701 O HOH 87 -7.358 13.795 -6.593 1.00 31.56 O HETATM 3702 O HOH 88 50.533 25.200 -21.711 1.00 18.98 O HETATM 3703 O HOH 89 48.686 4.394 -14.456 1.00 29.49 O HETATM 3704 O HOH 90 39.937 32.975 -17.898 1.00 21.24 O HETATM 3705 O HOH 91 54.116 17.446 -20.308 1.00 15.57 O HETATM 3706 O HOH 92 37.774 25.986 -15.861 1.00 19.71 O HETATM 3707 O HOH 93 52.563 35.673 -12.237 1.00 21.40 O HETATM 3708 O HOH 94 61.342 31.057 -22.955 1.00 19.86 O HETATM 3709 O HOH 95 14.139 11.267 1.871 1.00 28.54 O HETATM 3710 O HOH 96 40.693 30.558 -20.361 1.00 25.35 O HETATM 3711 O HOH 97 13.129 17.571 0.591 1.00 25.83 O HETATM 3712 O HOH 98 39.752 22.690 -17.068 1.00 27.62 O HETATM 3713 O HOH 99 14.866 4.765 -12.653 1.00 29.27 O HETATM 3714 O HOH 100 46.038 16.207 -7.257 1.00 24.49 O HETATM 3715 O HOH 101 -10.683 9.590 -7.339 1.00 32.22 O HETATM 3716 O HOH 102 46.108 24.081 -22.860 1.00 23.43 O HETATM 3717 O HOH 103 38.773 39.275 -14.500 1.00 19.78 O HETATM 3718 O HOH 104 23.938 23.254 -5.385 1.00 21.79 O HETATM 3719 O HOH 105 40.762 23.705 -19.827 1.00 32.52 O HETATM 3720 O HOH 106 19.996 23.062 -11.067 1.00 25.04 O HETATM 3721 O HOH 107 51.851 10.260 -18.579 1.00 30.57 O HETATM 3722 O HOH 108 -0.017 20.836 -13.497 1.00 36.55 O HETATM 3723 O HOH 109 0.921 -2.611 -6.750 1.00 38.16 O HETATM 3724 O HOH 110 48.680 25.027 -26.319 1.00 22.71 O HETATM 3725 O HOH 111 16.522 -1.755 -2.358 1.00 35.22 O HETATM 3726 O HOH 112 48.375 25.454 -23.485 1.00 15.74 O HETATM 3727 O HOH 113 29.741 37.781 -14.447 1.00 24.71 O HETATM 3728 N GLN A 114 51.093 8.286 3.423 1.00 0.24 N HETATM 3729 CA GLN A 114 49.779 8.618 2.886 1.00 0.07 C HETATM 3730 C GLN A 114 49.552 10.123 2.953 1.00 0.23 C HETATM 3731 O GLN A 114 48.535 10.588 3.468 1.00 -0.39 O HETATM 3732 N GLN A 114 50.514 10.876 2.430 1.00 -0.26 N HETATM 3733 CA GLN A 114 50.463 12.330 2.417 1.00 0.14 C HETATM 3734 C GLN A 114 50.097 12.833 1.028 1.00 0.20 C HETATM 3735 O GLN A 114 50.536 12.276 0.018 1.00 -0.39 O HETATM 3736 N GLN A 114 49.292 13.890 0.985 1.00 -0.27 N HETATM 3737 CA GLN A 114 48.960 14.540 -0.275 1.00 0.11 C HETATM 3738 C GLN A 114 49.893 15.722 -0.504 1.00 0.11 C HETATM 3739 O GLN A 114 50.657 16.098 0.386 1.00 -0.35 O HETATM 3740 H23 GLN A 114 50.172 16.196 1.197 1.00 0.22 H HETATM 3741 N2 GLN A 114 50.334 15.516 -1.719 1.00 0.27 N HETATM 3742 C2 GLN A 114 51.416 16.335 -2.201 1.00 0.07 C HETATM 3743 C1 GLN A 114 50.870 17.602 -2.746 1.00 0.23 C HETATM 3744 O1 GLN A 114 49.670 17.658 -3.110 1.00 -0.39 O HETATM 3745 N GLN A 114 51.487 18.672 -2.325 1.00 -0.26 N HETATM 3746 CA GLN A 114 51.013 19.886 -2.979 1.00 0.13 C HETATM 3747 C GLN A 114 51.891 20.237 -4.174 1.00 0.20 C HETATM 3748 O GLN A 114 53.066 19.874 -4.219 1.00 -0.39 O HETATM 3749 N GLN A 114 51.314 20.941 -5.143 1.00 -0.26 N HETATM 3750 CA GLN A 114 52.055 21.396 -6.310 1.00 0.14 C HETATM 3751 C GLN A 114 52.570 22.811 -6.078 1.00 0.21 C HETATM 3752 O GLN A 114 51.862 23.662 -5.532 1.00 -0.39 O HETATM 3753 N GLN A 114 53.808 23.053 -6.498 1.00 -0.26 N HETATM 3754 CA GLN A 114 54.456 24.332 -6.244 1.00 0.13 C HETATM 3755 C GLN A 114 53.880 25.425 -7.137 1.00 0.20 C HETATM 3756 O GLN A 114 53.629 25.213 -8.326 1.00 -0.39 O HETATM 3757 N GLN A 114 53.667 26.602 -6.551 1.00 -0.26 N HETATM 3758 CA GLN A 114 53.293 27.779 -7.323 1.00 0.13 C HETATM 3759 C GLN A 114 54.543 28.417 -7.914 1.00 0.20 C HETATM 3760 O GLN A 114 55.547 28.596 -7.218 1.00 -0.39 O HETATM 3761 N GLN A 114 54.484 28.756 -9.200 1.00 -0.26 N HETATM 3762 CA GLN A 114 55.637 29.317 -9.890 1.00 0.13 C HETATM 3763 C GLN A 114 55.723 30.819 -9.647 1.00 0.20 C HETATM 3764 O GLN A 114 54.747 31.548 -9.852 1.00 -0.39 O HETATM 3765 N GLN A 114 56.895 31.278 -9.215 1.00 -0.27 N HETATM 3766 CA GLN A 114 57.076 32.695 -8.939 1.00 0.12 C HETATM 3767 C GLN A 114 57.177 33.495 -10.225 1.00 0.20 C HETATM 3768 O GLN A 114 57.975 33.173 -11.115 1.00 -0.39 O HETATM 3769 N GLN A 114 56.373 34.549 -10.326 1.00 -0.27 N HETATM 3770 CA GLN A 114 56.342 35.355 -11.528 1.00 0.12 C HETATM 3771 C GLN A 114 57.577 36.223 -11.691 1.00 0.20 C HETATM 3772 O GLN A 114 58.407 36.374 -10.793 1.00 -0.39 O HETATM 3773 N GLN A 114 57.690 36.805 -12.882 1.00 -0.26 N HETATM 3774 CA GLN A 114 58.814 37.675 -13.195 1.00 0.13 C HETATM 3775 C GLN A 114 58.698 38.992 -12.433 1.00 0.20 C HETATM 3776 O GLN A 114 57.600 39.506 -12.209 1.00 -0.39 O HETATM 3777 N GLN A 114 59.856 39.537 -12.054 1.00 -0.27 N HETATM 3778 CA GLN A 114 60.001 40.706 -11.169 1.00 0.09 C HETATM 3779 C GLN A 114 59.663 40.328 -9.731 1.00 0.06 C HETATM 3780 O GLN A 114 60.292 40.811 -8.788 1.00 -0.57 O HETATM 3781 OXT GLN A 114 58.755 39.533 -9.485 1.00 -0.57 O HETATM 3782 CB GLN A 114 59.130 41.895 -11.608 1.00 -0.01 C HETATM 3783 CG GLN A 114 59.172 42.221 -13.091 1.00 -0.02 C HETATM 3784 CD GLN A 114 60.590 42.317 -13.610 1.00 0.06 C HETATM 3785 NE GLN A 114 60.619 42.282 -15.068 1.00 -0.27 N HETATM 3786 CZ GLN A 114 61.725 42.146 -15.790 1.00 0.29 C HETATM 3787 NH1 GLN A 114 62.901 42.028 -15.188 1.00 -0.28 N HETATM 3788 H96 GLN A 114 63.758 41.922 -15.749 1.00 0.26 H HETATM 3789 H97 GLN A 114 62.957 42.042 -14.160 1.00 0.26 H HETATM 3790 NH2 GLN A 114 61.656 42.123 -17.114 1.00 -0.28 N HETATM 3791 H98 GLN A 114 60.744 42.214 -17.584 1.00 0.26 H HETATM 3792 H99 GLN A 114 62.514 42.014 -17.673 1.00 0.26 H HETATM 3793 H95 GLN A 114 59.724 42.368 -15.570 1.00 0.26 H HETATM 3794 H93 GLN A 114 61.174 41.471 -13.219 1.00 0.07 H HETATM 3795 H94 GLN A 114 61.036 43.261 -13.264 1.00 0.07 H HETATM 3796 H91 GLN A 114 58.667 43.184 -13.258 1.00 0.03 H HETATM 3797 H92 GLN A 114 58.644 41.430 -13.644 1.00 0.03 H HETATM 3798 H89 GLN A 114 59.467 42.785 -11.055 1.00 0.03 H HETATM 3799 H90 GLN A 114 58.087 41.669 -11.340 1.00 0.03 H HETATM 3800 H88 GLN A 114 61.053 41.026 -11.205 1.00 0.07 H HETATM 3801 H87 GLN A 114 60.695 39.117 -12.399 1.00 0.19 H HETATM 3802 CB GLN A 114 58.877 37.932 -14.703 1.00 -0.01 C HETATM 3803 CG GLN A 114 60.025 38.780 -15.252 1.00 -0.04 C HETATM 3804 CD1 GLN A 114 61.364 38.272 -14.741 1.00 -0.06 C HETATM 3805 H81 GLN A 114 62.173 38.896 -15.149 1.00 0.02 H HETATM 3806 H82 GLN A 114 61.508 37.230 -15.063 1.00 0.02 H HETATM 3807 H83 GLN A 114 61.380 38.322 -13.642 1.00 0.02 H HETATM 3808 CD2 GLN A 114 59.998 38.780 -16.773 1.00 -0.06 C HETATM 3809 H84 GLN A 114 59.023 39.150 -17.122 1.00 0.02 H HETATM 3810 H85 GLN A 114 60.155 37.756 -17.142 1.00 0.02 H HETATM 3811 H86 GLN A 114 60.796 39.434 -17.154 1.00 0.02 H HETATM 3812 H80 GLN A 114 59.891 39.814 -14.902 1.00 0.03 H HETATM 3813 H78 GLN A 114 57.939 38.433 -14.986 1.00 0.03 H HETATM 3814 H79 GLN A 114 58.933 36.951 -15.197 1.00 0.03 H HETATM 3815 H77 GLN A 114 59.743 37.173 -12.886 1.00 0.08 H HETATM 3816 H76 GLN A 114 56.989 36.642 -13.576 1.00 0.19 H HETATM 3817 H74 GLN A 114 55.457 36.008 -11.490 1.00 0.08 H HETATM 3818 H75 GLN A 114 56.267 34.685 -12.398 1.00 0.08 H HETATM 3819 H73 GLN A 114 55.779 34.789 -9.558 1.00 0.19 H HETATM 3820 H71 GLN A 114 57.999 32.832 -8.357 1.00 0.08 H HETATM 3821 H72 GLN A 114 56.218 33.060 -8.356 1.00 0.08 H HETATM 3822 H70 GLN A 114 57.657 30.645 -9.079 1.00 0.19 H HETATM 3823 CB GLN A 114 55.556 29.025 -11.388 1.00 -0.02 C HETATM 3824 H67 GLN A 114 56.433 29.455 -11.893 1.00 0.03 H HETATM 3825 H68 GLN A 114 54.640 29.473 -11.800 1.00 0.03 H HETATM 3826 H69 GLN A 114 55.537 27.937 -11.549 1.00 0.03 H HETATM 3827 H66 GLN A 114 56.547 28.845 -9.491 1.00 0.08 H HETATM 3828 H65 GLN A 114 53.630 28.623 -9.703 1.00 0.19 H HETATM 3829 CB GLN A 114 52.545 28.782 -6.446 1.00 -0.02 C HETATM 3830 H62 GLN A 114 52.272 29.662 -7.047 1.00 0.03 H HETATM 3831 H63 GLN A 114 53.191 29.093 -5.612 1.00 0.03 H HETATM 3832 H64 GLN A 114 51.633 28.313 -6.048 1.00 0.03 H HETATM 3833 H61 GLN A 114 52.630 27.468 -8.144 1.00 0.08 H HETATM 3834 H60 GLN A 114 53.766 26.679 -5.559 1.00 0.19 H HETATM 3835 CB GLN A 114 55.964 24.208 -6.472 1.00 0.00 C HETATM 3836 CG GLN A 114 56.714 25.532 -6.527 1.00 0.04 C HETATM 3837 CD GLN A 114 57.142 26.024 -5.158 1.00 0.17 C HETATM 3838 OE1 GLN A 114 57.241 25.246 -4.209 1.00 -0.40 O HETATM 3839 NE2 GLN A 114 57.403 27.322 -5.050 1.00 -0.30 N HETATM 3840 H58 GLN A 114 57.690 27.703 -4.171 1.00 0.18 H HETATM 3841 H59 GLN A 114 57.313 27.918 -5.848 1.00 0.18 H HETATM 3842 H56 GLN A 114 56.058 26.288 -6.983 1.00 0.05 H HETATM 3843 H57 GLN A 114 57.611 25.402 -7.150 1.00 0.05 H HETATM 3844 H54 GLN A 114 56.124 23.685 -7.426 1.00 0.03 H HETATM 3845 H55 GLN A 114 56.386 23.610 -5.651 1.00 0.03 H HETATM 3846 H53 GLN A 114 54.280 24.610 -5.194 1.00 0.08 H HETATM 3847 H52 GLN A 114 54.304 22.343 -6.998 1.00 0.19 H HETATM 3848 CB GLN A 114 51.178 21.352 -7.563 1.00 0.04 C HETATM 3849 CG GLN A 114 51.971 21.572 -8.838 1.00 0.04 C HETATM 3850 OD1 GLN A 114 51.559 22.419 -9.659 1.00 -0.57 O HETATM 3851 OD2 GLN A 114 53.005 20.894 -9.020 1.00 -0.57 O HETATM 3852 H50 GLN A 114 50.412 22.137 -7.485 1.00 0.05 H HETATM 3853 H51 GLN A 114 50.690 20.368 -7.617 1.00 0.05 H HETATM 3854 H49 GLN A 114 52.915 20.728 -6.462 1.00 0.08 H HETATM 3855 H48 GLN A 114 50.342 21.165 -5.068 1.00 0.19 H HETATM 3856 CB GLN A 114 50.976 21.042 -1.991 1.00 -0.02 C HETATM 3857 H45 GLN A 114 50.617 21.948 -2.500 1.00 0.03 H HETATM 3858 H46 GLN A 114 51.987 21.220 -1.597 1.00 0.03 H HETATM 3859 H47 GLN A 114 50.297 20.794 -1.162 1.00 0.03 H HETATM 3860 H44 GLN A 114 49.990 19.706 -3.342 1.00 0.08 H HETATM 3861 H43 GLN A 114 52.206 18.661 -1.630 1.00 0.19 H HETATM 3862 C3 GLN A 114 52.132 15.609 -3.295 1.00 0.01 C HETATM 3863 C4 GLN A 114 53.243 14.766 -2.708 1.00 -0.03 C HETATM 3864 C5 GLN A 114 53.875 13.943 -3.805 1.00 0.03 C HETATM 3865 N6 GLN A 114 54.872 13.053 -3.231 1.00 -0.27 N HETATM 3866 C7 GLN A 114 55.511 12.054 -4.048 1.00 0.25 C HETATM 3867 O7 GLN A 114 55.219 11.947 -5.228 1.00 -0.40 O HETATM 3868 N8 GLN A 114 56.498 11.176 -3.469 1.00 -0.29 N HETATM 3869 H41 GLN A 114 56.943 10.482 -4.035 1.00 0.18 H HETATM 3870 H42 GLN A 114 56.737 11.262 -2.502 1.00 0.18 H HETATM 3871 H40 GLN A 114 55.115 13.135 -2.264 1.00 0.18 H HETATM 3872 H38 GLN A 114 54.357 14.612 -4.534 1.00 0.05 H HETATM 3873 H39 GLN A 114 53.100 13.348 -4.310 1.00 0.05 H HETATM 3874 H36 GLN A 114 52.830 14.098 -1.938 1.00 0.03 H HETATM 3875 H37 GLN A 114 54.002 15.421 -2.256 1.00 0.03 H HETATM 3876 H34 GLN A 114 52.560 16.338 -3.999 1.00 0.03 H HETATM 3877 H35 GLN A 114 51.422 14.959 -3.827 1.00 0.03 H HETATM 3878 H31 GLN A 114 52.113 16.552 -1.378 1.00 0.11 H HETATM 3879 H32 GLN A 114 49.556 15.650 -2.346 1.00 0.21 H HETATM 3880 H33 GLN A 114 50.642 14.557 -1.766 1.00 0.21 H HETATM 3881 H22 GLN A 114 49.224 16.590 -0.595 1.00 0.12 H HETATM 3882 CB GLN A 114 47.502 15.004 -0.286 1.00 -0.01 C HETATM 3883 CG GLN A 114 46.512 13.959 0.200 1.00 -0.00 C HETATM 3884 SD GLN A 114 44.824 14.307 -0.325 1.00 -0.16 S HETATM 3885 CE GLN A 114 44.921 13.891 -2.063 1.00 -0.02 C HETATM 3886 H28 GLN A 114 43.941 14.056 -2.535 1.00 0.03 H HETATM 3887 H29 GLN A 114 45.207 12.835 -2.172 1.00 0.03 H HETATM 3888 H30 GLN A 114 45.674 14.527 -2.551 1.00 0.03 H HETATM 3889 H26 GLN A 114 46.540 13.931 1.299 1.00 0.04 H HETATM 3890 H27 GLN A 114 46.810 12.979 -0.200 1.00 0.04 H HETATM 3891 H24 GLN A 114 47.235 15.279 -1.317 1.00 0.03 H HETATM 3892 H25 GLN A 114 47.416 15.888 0.363 1.00 0.03 H HETATM 3893 H21 GLN A 114 49.101 13.816 -1.091 1.00 0.06 H HETATM 3894 H20 GLN A 114 48.906 14.246 1.836 1.00 0.19 H HETATM 3895 CB GLN A 114 51.806 12.926 2.842 1.00 0.02 C HETATM 3896 CG GLN A 114 51.973 13.089 4.335 1.00 -0.05 C HETATM 3897 CD1 GLN A 114 52.290 12.005 5.143 1.00 -0.07 C HETATM 3898 CE1 GLN A 114 52.446 12.153 6.509 1.00 -0.04 C HETATM 3899 CZ GLN A 114 52.290 13.398 7.082 1.00 0.08 C HETATM 3900 CE2 GLN A 114 51.978 14.491 6.300 1.00 -0.04 C HETATM 3901 CD2 GLN A 114 51.824 14.333 4.936 1.00 -0.07 C HETATM 3902 H16 GLN A 114 51.583 15.195 4.324 1.00 0.05 H HETATM 3903 H18 GLN A 114 51.854 15.468 6.753 1.00 0.05 H HETATM 3904 OH GLN A 114 52.445 13.553 8.441 1.00 -0.34 O HETATM 3905 H19 GLN A 114 52.656 12.713 8.832 1.00 0.25 H HETATM 3906 H17 GLN A 114 52.690 11.296 7.126 1.00 0.05 H HETATM 3907 H15 GLN A 114 52.417 11.026 4.695 1.00 0.05 H HETATM 3908 H13 GLN A 114 51.906 13.917 2.375 1.00 0.05 H HETATM 3909 H14 GLN A 114 52.606 12.266 2.477 1.00 0.05 H HETATM 3910 H12 GLN A 114 49.691 12.659 3.128 1.00 0.08 H HETATM 3911 H11 GLN A 114 51.309 10.423 2.027 1.00 0.19 H HETATM 3912 CB GLN A 114 48.675 7.874 3.644 1.00 0.02 C HETATM 3913 CG GLN A 114 48.712 6.357 3.488 1.00 0.04 C HETATM 3914 CD GLN A 114 49.854 5.714 4.253 1.00 0.17 C HETATM 3915 OE1 GLN A 114 50.171 6.117 5.372 1.00 -0.40 O HETATM 3916 NE2 GLN A 114 50.486 4.716 3.645 1.00 -0.30 N HETATM 3917 H9 GLN A 114 51.247 4.254 4.101 1.00 0.18 H HETATM 3918 H10 GLN A 114 50.201 4.426 2.731 1.00 0.18 H HETATM 3919 H7 GLN A 114 48.825 6.116 2.421 1.00 0.05 H HETATM 3920 H8 GLN A 114 47.763 5.942 3.859 1.00 0.05 H HETATM 3921 H5 GLN A 114 47.703 8.234 3.276 1.00 0.04 H HETATM 3922 H6 GLN A 114 48.772 8.112 4.714 1.00 0.04 H HETATM 3923 H4 GLN A 114 49.745 8.306 1.832 1.00 0.11 H HETATM 3924 H1 GLN A 114 51.234 7.289 3.374 1.00 0.20 H HETATM 3925 H2 GLN A 114 51.149 8.587 4.383 1.00 0.20 H HETATM 3926 H3 GLN A 114 51.805 8.752 2.882 1.00 0.20 H CONECT 1 2 10 11 12 CONECT 10 1 CONECT 11 1 CONECT 12 1 CONECT 1004 1003 1559 CONECT 1559 1004 1558 CONECT 1753 1754 1761 1762 1763 CONECT 1761 1753 CONECT 1762 1753 CONECT 1763 1753 CONECT 1904 1903 2566 CONECT 2566 1904 2565 CONECT 2925 2924 3459 CONECT 3459 2925 3458 CONECT 3728 3729 3924 3925 3926 CONECT 3729 3728 3730 3912 3923 CONECT 3730 3729 3731 3732 CONECT 3731 3730 CONECT 3732 3730 3733 3911 CONECT 3733 3732 3734 3895 3910 CONECT 3734 3733 3735 3736 CONECT 3735 3734 CONECT 3736 3734 3737 3894 CONECT 3737 3736 3738 3882 3893 CONECT 3738 3737 3739 3741 3881 CONECT 3739 3738 3740 CONECT 3740 3739 CONECT 3741 3738 3742 3879 3880 CONECT 3742 3741 3743 3862 3878 CONECT 3743 3742 3744 3745 CONECT 3744 3743 CONECT 3745 3743 3746 3861 CONECT 3746 3745 3747 3856 3860 CONECT 3747 3746 3748 3749 CONECT 3748 3747 CONECT 3749 3747 3750 3855 CONECT 3750 3749 3751 3848 3854 CONECT 3751 3750 3752 3753 CONECT 3752 3751 CONECT 3753 3751 3754 3847 CONECT 3754 3753 3755 3835 3846 CONECT 3755 3754 3756 3757 CONECT 3756 3755 CONECT 3757 3755 3758 3834 CONECT 3758 3757 3759 3829 3833 CONECT 3759 3758 3760 3761 CONECT 3760 3759 CONECT 3761 3759 3762 3828 CONECT 3762 3761 3763 3823 3827 CONECT 3763 3762 3764 3765 CONECT 3764 3763 CONECT 3765 3763 3766 3822 CONECT 3766 3765 3767 3820 3821 CONECT 3767 3766 3768 3769 CONECT 3768 3767 CONECT 3769 3767 3770 3819 CONECT 3770 3769 3771 3817 3818 CONECT 3771 3770 3772 3773 CONECT 3772 3771 CONECT 3773 3771 3774 3816 CONECT 3774 3773 3775 3802 3815 CONECT 3775 3774 3776 3777 CONECT 3776 3775 CONECT 3777 3775 3778 3801 CONECT 3778 3777 3779 3782 3800 CONECT 3779 3778 3780 3781 CONECT 3780 3779 CONECT 3781 3779 CONECT 3782 3778 3783 3798 3799 CONECT 3783 3782 3784 3796 3797 CONECT 3784 3783 3785 3794 3795 CONECT 3785 3784 3786 3793 CONECT 3786 3785 3787 3790 CONECT 3787 3786 3788 3789 CONECT 3788 3787 CONECT 3789 3787 CONECT 3790 3786 3791 3792 CONECT 3791 3790 CONECT 3792 3790 CONECT 3793 3785 CONECT 3794 3784 CONECT 3795 3784 CONECT 3796 3783 CONECT 3797 3783 CONECT 3798 3782 CONECT 3799 3782 CONECT 3800 3778 CONECT 3801 3777 CONECT 3802 3774 3803 3813 3814 CONECT 3803 3802 3804 3808 3812 CONECT 3804 3803 3805 3806 3807 CONECT 3805 3804 CONECT 3806 3804 CONECT 3807 3804 CONECT 3808 3803 3809 3810 3811 CONECT 3809 3808 CONECT 3810 3808 CONECT 3811 3808 CONECT 3812 3803 CONECT 3813 3802 CONECT 3814 3802 CONECT 3815 3774 CONECT 3816 3773 CONECT 3817 3770 CONECT 3818 3770 CONECT 3819 3769 CONECT 3820 3766 CONECT 3821 3766 CONECT 3822 3765 CONECT 3823 3762 3824 3825 3826 CONECT 3824 3823 CONECT 3825 3823 CONECT 3826 3823 CONECT 3827 3762 CONECT 3828 3761 CONECT 3829 3758 3830 3831 3832 CONECT 3830 3829 CONECT 3831 3829 CONECT 3832 3829 CONECT 3833 3758 CONECT 3834 3757 CONECT 3835 3754 3836 3844 3845 CONECT 3836 3835 3837 3842 3843 CONECT 3837 3836 3838 3839 CONECT 3838 3837 CONECT 3839 3837 3840 3841 CONECT 3840 3839 CONECT 3841 3839 CONECT 3842 3836 CONECT 3843 3836 CONECT 3844 3835 CONECT 3845 3835 CONECT 3846 3754 CONECT 3847 3753 CONECT 3848 3750 3849 3852 3853 CONECT 3849 3848 3850 3851 CONECT 3850 3849 CONECT 3851 3849 CONECT 3852 3848 CONECT 3853 3848 CONECT 3854 3750 CONECT 3855 3749 CONECT 3856 3746 3857 3858 3859 CONECT 3857 3856 CONECT 3858 3856 CONECT 3859 3856 CONECT 3860 3746 CONECT 3861 3745 CONECT 3862 3742 3863 3876 3877 CONECT 3863 3862 3864 3874 3875 CONECT 3864 3863 3865 3872 3873 CONECT 3865 3864 3866 3871 CONECT 3866 3865 3867 3868 CONECT 3867 3866 CONECT 3868 3866 3869 3870 CONECT 3869 3868 CONECT 3870 3868 CONECT 3871 3865 CONECT 3872 3864 CONECT 3873 3864 CONECT 3874 3863 CONECT 3875 3863 CONECT 3876 3862 CONECT 3877 3862 CONECT 3878 3742 CONECT 3879 3741 CONECT 3880 3741 CONECT 3881 3738 CONECT 3882 3737 3883 3891 3892 CONECT 3883 3882 3884 3889 3890 CONECT 3884 3883 3885 CONECT 3885 3884 3886 3887 3888 CONECT 3886 3885 CONECT 3887 3885 CONECT 3888 3885 CONECT 3889 3883 CONECT 3890 3883 CONECT 3891 3882 CONECT 3892 3882 CONECT 3893 3737 CONECT 3894 3736 CONECT 3895 3733 3896 3908 3909 CONECT 3896 3895 3897 3901 CONECT 3897 3896 3898 3907 CONECT 3898 3897 3899 3906 CONECT 3899 3898 3900 3904 CONECT 3900 3899 3901 3903 CONECT 3901 3896 3900 3902 CONECT 3902 3901 CONECT 3903 3900 CONECT 3904 3899 3905 CONECT 3905 3904 CONECT 3906 3898 CONECT 3907 3897 CONECT 3908 3895 CONECT 3909 3895 CONECT 3910 3733 CONECT 3911 3732 CONECT 3912 3729 3913 3921 3922 CONECT 3913 3912 3914 3919 3920 CONECT 3914 3913 3915 3916 CONECT 3915 3914 CONECT 3916 3914 3917 3918 CONECT 3917 3916 CONECT 3918 3916 CONECT 3919 3913 CONECT 3920 3913 CONECT 3921 3912 CONECT 3922 3912 CONECT 3923 3729 CONECT 3924 3728 CONECT 3925 3728 CONECT 3926 3728 MASTER 0 0 0 0 0 0 0 0 3924 2 213 29 END
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13-mer
1jwu
RCSB PDB
PDBbind
13-mer
1k3n
RCSB PDB
PDBbind
13-mer
1k3q
RCSB PDB
PDBbind
13-mer
1oeb
RCSB PDB
PDBbind
13-mer
1opi
RCSB PDB
PDBbind
13-mer
1osv
RCSB PDB
PDBbind
13-mer
1ow6
RCSB PDB
PDBbind
13-mer
1ow7
RCSB PDB
PDBbind
13-mer
1ow8
RCSB PDB
PDBbind
13-mer
1p4u
RCSB PDB
PDBbind
13-mer
1r5v
RCSB PDB
PDBbind
13-mer
1r5w
RCSB PDB
PDBbind
13-mer
1rgj
RCSB PDB
PDBbind
13-mer
1sjh
RCSB PDB
PDBbind
13-mer
1sm3
RCSB PDB
PDBbind
13-mer
1thr
RCSB PDB
PDBbind
13-mer
1u9l
RCSB PDB
PDBbind
13-mer
1uef
RCSB PDB
PDBbind
13-mer
1yvh
RCSB PDB
PDBbind
13-mer
1ywh
RCSB PDB
PDBbind
13-mer
1zhk
RCSB PDB
PDBbind
13-mer
1zhl
RCSB PDB
PDBbind
13-mer
2a25
RCSB PDB
PDBbind
13-mer
2c9t
RCSB PDB
PDBbind
13-mer
2dwx
RCSB PDB
PDBbind
13-mer
2fts
RCSB PDB
PDBbind
13-mer
2las
RCSB PDB
PDBbind
13-mer
2lct
RCSB PDB
PDBbind
13-mer
2lsp
RCSB PDB
PDBbind
13-mer
2lto
RCSB PDB
PDBbind
13-mer
2lyw
RCSB PDB
PDBbind
13-mer
2mc1
RCSB PDB
PDBbind
13-mer
2mkr
RCSB PDB
PDBbind
13-mer
2ndf
RCSB PDB
PDBbind
13-mer
2ndg
RCSB PDB
PDBbind
13-mer
2qki
RCSB PDB
PDBbind
13-mer
2r0y
RCSB PDB
PDBbind
13-mer
2rnx
RCSB PDB
PDBbind
13-mer
2v87
RCSB PDB
PDBbind
13-mer
2vr3
RCSB PDB
PDBbind
13-mer
3ask
RCSB PDB
PDBbind
13-mer
3bum
RCSB PDB
PDBbind
13-mer
3bun
RCSB PDB
PDBbind
13-mer
3buo
RCSB PDB
PDBbind
13-mer
3buw
RCSB PDB
PDBbind
13-mer
3bux
RCSB PDB
PDBbind
13-mer
3c3o
RCSB PDB
PDBbind
13-mer
3c3r
RCSB PDB
PDBbind
13-mer
3coj
RCSB PDB
PDBbind
13-mer
3e1r
RCSB PDB
PDBbind
13-mer
3eg6
RCSB PDB
PDBbind
13-mer
3emh
RCSB PDB
PDBbind
13-mer
3g2s
RCSB PDB
PDBbind
13-mer
3g2t
RCSB PDB
PDBbind
13-mer
3g2u
RCSB PDB
PDBbind
13-mer
3g2v
RCSB PDB
PDBbind
13-mer
3ml4
RCSB PDB
PDBbind
13-mer
3n5u
RCSB PDB
PDBbind
13-mer
3nfk
RCSB PDB
PDBbind
13-mer
3nti
RCSB PDB
PDBbind
13-mer
3o1d
RCSB PDB
PDBbind
13-mer
3o1e
RCSB PDB
PDBbind
13-mer
3q5u
RCSB PDB
PDBbind
13-mer
3rqf
RCSB PDB
PDBbind
13-mer
3rqg
RCSB PDB
PDBbind
13-mer
3rz9
RCSB PDB
PDBbind
13-mer
3s7f
RCSB PDB
PDBbind
13-mer
3tdz
RCSB PDB
PDBbind
13-mer
3ui2
RCSB PDB
PDBbind
13-mer
4abi
RCSB PDB
PDBbind
13-mer
4abj
RCSB PDB
PDBbind
13-mer
4b9w
RCSB PDB
PDBbind
13-mer
4bea
RCSB PDB
PDBbind
13-mer
4bv2
RCSB PDB
PDBbind
13-mer
4f14
RCSB PDB
PDBbind
13-mer
4f20
RCSB PDB
PDBbind
13-mer
4h3q
RCSB PDB
PDBbind
13-mer
4ib5
RCSB PDB
PDBbind
13-mer
4jmg
RCSB PDB
PDBbind
13-mer
4jmh
RCSB PDB
PDBbind
13-mer
4l1u
RCSB PDB
PDBbind
13-mer
4m7c
RCSB PDB
PDBbind
13-mer
4mz5
RCSB PDB
PDBbind
13-mer
4mz6
RCSB PDB
PDBbind
13-mer
4n7h
RCSB PDB
PDBbind
13-mer
4po7
RCSB PDB
PDBbind
13-mer
4qh8
RCSB PDB
PDBbind
13-mer
4rme
RCSB PDB
PDBbind
13-mer
4um9
RCSB PDB
PDBbind
13-mer
4umn
RCSB PDB
PDBbind
13-mer
4w4z
RCSB PDB
PDBbind
13-mer
4wj7
RCSB PDB
PDBbind
13-mer
4x3e
RCSB PDB
PDBbind
13-mer
4yjl
RCSB PDB
PDBbind
13-mer
4z0d
RCSB PDB
PDBbind
13-mer
4z0e
RCSB PDB
PDBbind
13-mer
4z0f
RCSB PDB
PDBbind
13-mer
5cil
RCSB PDB
PDBbind
13-mer
5dd0
RCSB PDB
PDBbind
13-mer
5dhf
RCSB PDB
PDBbind
13-mer
5dx3
RCSB PDB
PDBbind
13-mer
5dxb
RCSB PDB
PDBbind
13-mer
5dxe
RCSB PDB
PDBbind
13-mer
5dxg
RCSB PDB
PDBbind
13-mer
5e0m
RCSB PDB
PDBbind
13-mer
5eay
RCSB PDB
PDBbind
13-mer
5eyz
RCSB PDB
PDBbind
13-mer
5fyq
RCSB PDB
PDBbind
13-mer
5gg4
RCSB PDB
PDBbind
13-mer
5h1e
RCSB PDB
PDBbind
13-mer
5h7g
RCSB PDB
PDBbind
13-mer
5hyr
RCSB PDB
PDBbind
13-mer
5hyx
RCSB PDB
PDBbind
13-mer
5jr2
RCSB PDB
PDBbind
13-mer
5kgn
RCSB PDB
PDBbind
13-mer
5lgp
RCSB PDB
PDBbind
13-mer
5lu2
RCSB PDB
PDBbind
13-mer
5n8b
RCSB PDB
PDBbind
13-mer
5n8e
RCSB PDB
PDBbind
13-mer
5n8t
RCSB PDB
PDBbind
13-mer
5t6j
RCSB PDB
PDBbind
13-mer
5u6k
RCSB PDB
PDBbind
13-mer
5umz
RCSB PDB
PDBbind
13-mer
5vqi
RCSB PDB
PDBbind
13-mer
5wgd
RCSB PDB
PDBbind
13-mer
5wgq
RCSB PDB
PDBbind
13-mer
5yyz
RCSB PDB
PDBbind
13-mer
6bij
RCSB PDB
PDBbind
13-mer
6bil
RCSB PDB
PDBbind
13-mer
6bir
RCSB PDB
PDBbind
13-mer
6biv
RCSB PDB
PDBbind
13-mer
6bix
RCSB PDB
PDBbind
13-mer
6biy
RCSB PDB
PDBbind
13-mer
6bnh
RCSB PDB
PDBbind
13-mer
6cf6
RCSB PDB
PDBbind
13-mer
6drt
RCSB PDB
PDBbind
13-mer
6e8k
RCSB PDB
PDBbind
13-mer
6e8m
RCSB PDB
PDBbind
13-mer
6o7g
RCSB PDB
PDBbind
13-mer
6o3y
RCSB PDB
PDBbind
13-mer
6nkp
RCSB PDB
PDBbind
13-mer
6n9t
RCSB PDB
PDBbind
13-mer
6n87
RCSB PDB
PDBbind
13-mer
6n7q
RCSB PDB
PDBbind
13-mer
6hy7
RCSB PDB
PDBbind
13-mer
6bcy
RCSB PDB
PDBbind
13-mer
5yy9
RCSB PDB
PDBbind
13-mer
5mtw
RCSB PDB
PDBbind
13-mer
Entry Information
PDB ID
6bin
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
HLA class II DR-beta (HLA-DR B)
Ligand Name
13-mer
EC.Number
E.C.-.-.-.-
Resolution
2.5(Å)
Affinity (Kd/Ki/IC50)
IC50=0.46uM
Release Year
2018
Protein/NA Sequence
Check fasta file
Primary Reference
(2018) J. Biol. Chem. Vol. 293: pp. 3236-3251
Ligand Properties
Formula
C
5
9
H
1
0
1
N
2
0
O
2
0
S
Molecular Weight
1442.620
Exact Mass
1441.720
No. of atoms
201
No. of bonds
201
Polar Surface Area
712.02
LOGP Value
-7.06 (
Computed with XLOGP3
)
-3.88 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 19
No. of Hydrogen Bond Acceptors: 20
No. of Rotatable Bonds: 61
No. of Nitrogen and Oxygen Atoms: 40
No. of Rings: 1
Canonical SMILES
CSCC[C@@H]([C@H]([NH2+][C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC[NH+]=C(N)N)CC(C)C)C)C)CCC(=O)N)CC(=O)O)C)CCCNC(=O)N)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)N)[NH3+])Cc1ccc(cc1)O
InChI String
InChI=1S/C59H98N20O20S/c1-28(2)23-39(54(94)77-38(57(97)98)10-8-20-66-58(63)64)73-45(84)27-68-44(83)26-69-47(87)29(3)70-48(88)30(4)71-52(92)36(16-18-43(62)82)75-56(96)41(25-46(85)86)78-49(89)31(5)72-51(91)35(9-7-21-67-59(65)99)74-53(93)37(19-22-100-6)76-55(95)40(24-32-11-13-33(80)14-12-32)79-50(90)34(60)15-17-42(61)81/h11-14,28-31,34-41,53,74,80,93H,7-10,15-27,60H2,1-6H3,(H2,61,81)(H2,62,82)(H,68,83)(H,69,87)(H,70,88)(H,71,92)(H,72,91)(H,73,84)(H,75,96)(H,76,95)(H,77,94)(H,78,89)(H,79,90)(H,85,86)(H,97,98)(H4,63,64,66)(H3,65,67,99)/p+3/t29-,30-,31-,34-,35-,36-,37-,38-,39-,40-,41-,53+/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P02458
P01903
P01911
Entrez Gene ID
NCBI Entrez Gene ID:
1280
3122
3123
ASD
Information of known allosteric effects of PDB entries
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