Browse entries in the PDBbind-CN Database
HEADER 5W7I_COMPLEX COMPND 5W7I_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 229 ILE ASP ASP TYR SER THR TRP ASP ILE VAL LYS ALA THR SEQRES 2 A 229 GLN TYR GLY ILE TYR GLU ARG CYS ARG GLU LEU VAL GLU SEQRES 3 A 229 ALA GLY TYR ASP VAL ARG GLN PRO ASP LYS GLU ASN VAL SEQRES 4 A 229 THR LEU LEU HIS TRP ALA ALA ILE ASN ASN ARG ILE ASP SEQRES 5 A 229 LEU VAL LYS TYR TYR ILE SER LYS GLY ALA ILE VAL ASP SEQRES 6 A 229 GLN LEU GLY GLY ASP LEU ASN SER THR PRO LEU HIS TRP SEQRES 7 A 229 ALA THR ARG GLN GLY HIS LEU SER MET VAL VAL GLN LEU SEQRES 8 A 229 MET LYS TYR GLY ALA ASP PRO SER LEU ILE ASP GLY GLU SEQRES 9 A 229 GLY CYS SER CYS ILE HIS LEU ALA ALA GLN PHE GLY HIS SEQRES 10 A 229 THR SER ILE VAL ALA TYR LEU ILE ALA LYS GLY GLN ASP SEQRES 11 A 229 VAL ASP MET MET ASP GLN ASN GLY MET THR PRO LEU MET SEQRES 12 A 229 TRP ALA ALA TYR ARG THR HIS SER VAL ASP PRO THR ARG SEQRES 13 A 229 LEU LEU LEU THR PHE ASN VAL SER VAL ASN LEU GLY ASP SEQRES 14 A 229 LYS TYR HIS LYS ASN THR ALA LEU HIS TRP ALA VAL LEU SEQRES 15 A 229 ALA GLY ASN THR THR VAL ILE SER LEU LEU LEU GLU ALA SEQRES 16 A 229 GLY ALA ASN VAL ASP ALA GLN ASN ILE LYS GLY GLU SER SEQRES 17 A 229 ALA LEU ASP LEU ALA LYS GLN ARG LYS ASN VAL TRP MET SEQRES 18 A 229 ILE ASN HIS LEU GLN GLU ALA ARG HET GLY A 323 130 ATOM 1 N ILE A 53 9.306 10.971 -1.326 1.00 49.66 N ATOM 2 CA ILE A 53 9.771 12.235 -1.908 1.00 49.63 C ATOM 3 C ILE A 53 9.009 12.635 -3.177 1.00 46.23 C ATOM 4 O ILE A 53 9.274 12.105 -4.249 1.00 47.50 O ATOM 5 CB ILE A 53 11.280 12.192 -2.238 1.00 45.81 C ATOM 6 CG1 ILE A 53 12.088 11.625 -1.069 1.00 52.54 C ATOM 7 CG2 ILE A 53 11.778 13.596 -2.580 1.00 44.21 C ATOM 8 CD1 ILE A 53 12.180 12.551 0.122 1.00 47.05 C ATOM 9 HN3 ILE A 53 9.428 10.206 -2.020 1.00 0.00 H ATOM 10 HN2 ILE A 53 8.300 11.056 -1.075 1.00 0.00 H ATOM 11 HN1 ILE A 53 9.861 10.759 -0.473 1.00 0.00 H ATOM 12 N ASP A 54 8.090 13.594 -3.067 1.00 46.07 N ATOM 13 CA ASP A 54 7.396 14.098 -4.246 1.00 45.56 C ATOM 14 C ASP A 54 8.365 14.911 -5.092 1.00 45.68 C ATOM 15 O ASP A 54 8.945 15.886 -4.607 1.00 46.10 O ATOM 16 CB ASP A 54 6.188 14.949 -3.847 1.00 43.76 C ATOM 17 CG ASP A 54 5.266 15.250 -5.034 1.00 40.53 C ATOM 18 OD1 ASP A 54 5.677 15.032 -6.197 1.00 41.82 O ATOM 19 OD2 ASP A 54 4.123 15.701 -4.806 1.00 42.25 O ATOM 20 H ASP A 54 7.866 13.987 -2.131 1.00 0.00 H ATOM 21 N ASP A 55 8.537 14.519 -6.356 1.00 42.25 N ATOM 22 CA ASP A 55 9.492 15.169 -7.247 1.00 43.16 C ATOM 23 C ASP A 55 8.823 16.057 -8.294 1.00 42.22 C ATOM 24 O ASP A 55 9.500 16.514 -9.227 1.00 41.32 O ATOM 25 CB ASP A 55 10.361 14.118 -7.937 1.00 44.14 C ATOM 26 CG ASP A 55 9.548 13.172 -8.812 1.00 45.86 C ATOM 27 OD1 ASP A 55 8.315 13.053 -8.603 1.00 47.37 O ATOM 28 OD2 ASP A 55 10.154 12.545 -9.703 1.00 49.16 O ATOM 29 H ASP A 55 7.972 13.724 -6.718 1.00 0.00 H ATOM 30 N TYR A 56 7.511 16.281 -8.176 1.00 38.84 N ATOM 31 CA TYR A 56 6.747 17.181 -9.039 1.00 39.98 C ATOM 32 C TYR A 56 6.487 16.594 -10.424 1.00 39.16 C ATOM 33 O TYR A 56 5.750 17.198 -11.212 1.00 37.73 O ATOM 34 CB TYR A 56 7.445 18.545 -9.191 1.00 37.55 C ATOM 35 CG TYR A 56 7.926 19.193 -7.901 1.00 33.24 C ATOM 36 CD1 TYR A 56 7.019 19.612 -6.932 1.00 36.17 C ATOM 37 CD2 TYR A 56 9.287 19.426 -7.677 1.00 34.40 C ATOM 38 CE1 TYR A 56 7.451 20.218 -5.744 1.00 37.59 C ATOM 39 CE2 TYR A 56 9.740 20.041 -6.492 1.00 34.67 C ATOM 40 CZ TYR A 56 8.810 20.428 -5.528 1.00 36.94 C ATOM 41 OH TYR A 56 9.220 21.025 -4.355 1.00 35.72 O ATOM 42 HH TYR A 56 8.429 21.229 -3.796 1.00 0.00 H ATOM 43 H TYR A 56 6.999 15.782 -7.420 1.00 0.00 H ATOM 44 N SER A 57 7.068 15.427 -10.739 1.00 40.46 N ATOM 45 CA SER A 57 6.858 14.821 -12.060 1.00 42.95 C ATOM 46 C SER A 57 5.417 14.402 -12.280 1.00 38.81 C ATOM 47 O SER A 57 5.047 14.080 -13.411 1.00 47.01 O ATOM 48 CB SER A 57 7.763 13.599 -12.259 1.00 44.45 C ATOM 49 OG SER A 57 7.569 12.650 -11.218 1.00 46.63 O ATOM 50 HG SER A 57 7.785 13.068 -10.347 1.00 0.00 H ATOM 51 H SER A 57 7.672 14.947 -10.042 1.00 0.00 H ATOM 52 N THR A 58 4.608 14.403 -11.229 1.00 38.74 N ATOM 53 CA THR A 58 3.197 14.053 -11.253 1.00 41.85 C ATOM 54 C THR A 58 2.267 15.267 -11.309 1.00 43.82 C ATOM 55 O THR A 58 1.071 15.094 -11.573 1.00 44.83 O ATOM 56 CB THR A 58 2.863 13.214 -9.998 1.00 42.79 C ATOM 57 OG1 THR A 58 1.445 13.135 -9.819 1.00 52.04 O ATOM 58 CG2 THR A 58 3.492 13.835 -8.733 1.00 40.72 C ATOM 59 HG1 THR A 58 1.076 14.047 -9.707 1.00 0.00 H ATOM 60 H THR A 58 5.016 14.677 -10.313 1.00 0.00 H ATOM 61 N TRP A 59 2.771 16.478 -11.058 1.00 36.06 N ATOM 62 CA TRP A 59 1.914 17.644 -10.867 1.00 37.15 C ATOM 63 C TRP A 59 1.402 18.179 -12.198 1.00 38.10 C ATOM 64 O TRP A 59 2.122 18.181 -13.199 1.00 35.80 O ATOM 65 CB TRP A 59 2.674 18.758 -10.143 1.00 37.58 C ATOM 66 CG TRP A 59 3.009 18.469 -8.716 1.00 39.40 C ATOM 67 CD1 TRP A 59 3.147 17.242 -8.134 1.00 38.22 C ATOM 68 CD2 TRP A 59 3.252 19.433 -7.684 1.00 41.80 C ATOM 69 NE1 TRP A 59 3.458 17.381 -6.809 1.00 40.00 N ATOM 70 CE2 TRP A 59 3.528 18.715 -6.502 1.00 42.22 C ATOM 71 CE3 TRP A 59 3.260 20.834 -7.642 1.00 36.91 C ATOM 72 CZ2 TRP A 59 3.815 19.350 -5.288 1.00 40.02 C ATOM 73 CZ3 TRP A 59 3.544 21.463 -6.434 1.00 36.92 C ATOM 74 CH2 TRP A 59 3.817 20.720 -5.278 1.00 38.99 C ATOM 75 HE1 TRP A 59 3.616 16.599 -6.141 1.00 0.00 H ATOM 76 H TRP A 59 3.803 16.593 -10.997 1.00 0.00 H ATOM 77 N ASP A 60 0.156 18.650 -12.200 1.00 38.03 N ATOM 78 CA ASP A 60 -0.392 19.315 -13.372 1.00 38.65 C ATOM 79 C ASP A 60 0.243 20.703 -13.542 1.00 39.12 C ATOM 80 O ASP A 60 0.880 21.248 -12.630 1.00 35.81 O ATOM 81 CB ASP A 60 -1.908 19.426 -13.248 1.00 37.80 C ATOM 82 CG ASP A 60 -2.320 20.343 -12.127 1.00 43.99 C ATOM 83 OD1 ASP A 60 -2.349 21.569 -12.369 1.00 44.61 O ATOM 84 OD2 ASP A 60 -2.596 19.854 -10.999 1.00 54.48 O ATOM 85 H ASP A 60 -0.434 18.541 -11.351 1.00 0.00 H ATOM 86 N ILE A 61 0.038 21.294 -14.724 1.00 38.20 N ATOM 87 CA ILE A 61 0.745 22.531 -15.058 1.00 36.70 C ATOM 88 C ILE A 61 0.248 23.714 -14.221 1.00 35.39 C ATOM 89 O ILE A 61 0.999 24.664 -13.964 1.00 32.75 O ATOM 90 CB ILE A 61 0.626 22.819 -16.566 1.00 33.58 C ATOM 91 CG1 ILE A 61 1.611 23.912 -16.955 1.00 32.97 C ATOM 92 CG2 ILE A 61 -0.777 23.256 -16.908 1.00 36.16 C ATOM 93 CD1 ILE A 61 1.938 23.947 -18.399 1.00 39.02 C ATOM 94 H ILE A 61 -0.625 20.874 -15.407 1.00 0.00 H ATOM 95 N VAL A 62 -1.008 23.688 -13.781 1.00 37.37 N ATOM 96 CA VAL A 62 -1.512 24.788 -12.969 1.00 37.02 C ATOM 97 C VAL A 62 -0.884 24.758 -11.581 1.00 35.11 C ATOM 98 O VAL A 62 -0.409 25.781 -11.079 1.00 33.79 O ATOM 99 CB VAL A 62 -3.045 24.746 -12.894 1.00 34.27 C ATOM 100 CG1 VAL A 62 -3.534 25.733 -11.828 1.00 37.48 C ATOM 101 CG2 VAL A 62 -3.635 25.067 -14.253 1.00 32.53 C ATOM 102 H VAL A 62 -1.627 22.886 -14.016 1.00 0.00 H ATOM 103 N LYS A 63 -0.869 23.588 -10.942 1.00 32.77 N ATOM 104 CA LYS A 63 -0.250 23.481 -9.628 1.00 33.02 C ATOM 105 C LYS A 63 1.243 23.766 -9.704 1.00 34.82 C ATOM 106 O LYS A 63 1.803 24.433 -8.823 1.00 34.05 O ATOM 107 CB LYS A 63 -0.502 22.097 -9.032 1.00 35.05 C ATOM 108 CG LYS A 63 -0.261 22.043 -7.523 1.00 36.65 C ATOM 109 CD LYS A 63 -0.388 20.630 -6.949 1.00 38.04 C ATOM 110 CE LYS A 63 -0.561 20.646 -5.420 1.00 38.49 C ATOM 111 NZ LYS A 63 -0.262 19.305 -4.852 1.00 38.45 N ATOM 112 HZ1 LYS A 63 -0.913 18.604 -5.260 1.00 0.00 H ATOM 113 HZ2 LYS A 63 0.718 19.044 -5.080 1.00 0.00 H ATOM 114 HZ3 LYS A 63 -0.383 19.332 -3.819 1.00 0.00 H ATOM 115 H LYS A 63 -1.300 22.750 -11.383 1.00 0.00 H ATOM 116 N ALA A 64 1.903 23.278 -10.759 1.00 31.18 N ATOM 117 CA ALA A 64 3.330 23.511 -10.899 1.00 28.86 C ATOM 118 C ALA A 64 3.622 24.983 -11.145 1.00 29.52 C ATOM 119 O ALA A 64 4.671 25.488 -10.722 1.00 30.40 O ATOM 120 CB ALA A 64 3.890 22.656 -12.029 1.00 32.75 C ATOM 121 H ALA A 64 1.394 22.730 -11.481 1.00 0.00 H ATOM 122 N THR A 65 2.709 25.684 -11.817 1.00 27.92 N ATOM 123 CA THR A 65 2.887 27.116 -12.022 1.00 32.76 C ATOM 124 C THR A 65 2.741 27.857 -10.704 1.00 32.41 C ATOM 125 O THR A 65 3.588 28.683 -10.349 1.00 28.82 O ATOM 126 CB THR A 65 1.871 27.649 -13.034 1.00 32.77 C ATOM 127 OG1 THR A 65 2.168 27.143 -14.344 1.00 29.72 O ATOM 128 CG2 THR A 65 1.871 29.195 -13.027 1.00 27.66 C ATOM 129 HG1 THR A 65 2.127 26.154 -14.332 1.00 0.00 H ATOM 130 H THR A 65 1.866 25.207 -12.197 1.00 0.00 H ATOM 131 N GLN A 66 1.665 27.557 -9.971 1.00 31.16 N ATOM 132 CA GLN A 66 1.428 28.153 -8.667 1.00 29.78 C ATOM 133 C GLN A 66 2.666 28.067 -7.793 1.00 31.18 C ATOM 134 O GLN A 66 3.023 29.037 -7.114 1.00 31.33 O ATOM 135 CB GLN A 66 0.237 27.459 -7.998 1.00 30.87 C ATOM 136 CG GLN A 66 -1.125 27.853 -8.610 1.00 32.73 C ATOM 137 CD GLN A 66 -2.259 26.901 -8.242 1.00 36.75 C ATOM 138 OE1 GLN A 66 -2.028 25.815 -7.692 1.00 36.65 O ATOM 139 NE2 GLN A 66 -3.498 27.308 -8.544 1.00 33.98 N ATOM 140 HE22 GLN A 66 -3.645 28.228 -9.006 1.00 0.00 H ATOM 141 HE21 GLN A 66 -4.314 26.704 -8.317 1.00 0.00 H ATOM 142 H GLN A 66 0.975 26.875 -10.346 1.00 0.00 H ATOM 143 N TYR A 67 3.356 26.932 -7.824 1.00 25.45 N ATOM 144 CA TYR A 67 4.491 26.714 -6.943 1.00 27.30 C ATOM 145 C TYR A 67 5.815 27.103 -7.578 1.00 29.73 C ATOM 146 O TYR A 67 6.856 26.981 -6.921 1.00 26.69 O ATOM 147 CB TYR A 67 4.528 25.249 -6.485 1.00 28.40 C ATOM 148 CG TYR A 67 3.574 24.973 -5.345 1.00 29.55 C ATOM 149 CD1 TYR A 67 2.233 24.708 -5.589 1.00 31.42 C ATOM 150 CD2 TYR A 67 4.006 25.011 -4.018 1.00 33.50 C ATOM 151 CE1 TYR A 67 1.349 24.466 -4.555 1.00 33.40 C ATOM 152 CE2 TYR A 67 3.124 24.770 -2.963 1.00 31.84 C ATOM 153 CZ TYR A 67 1.794 24.493 -3.245 1.00 37.04 C ATOM 154 OH TYR A 67 0.896 24.249 -2.229 1.00 36.93 O ATOM 155 HH TYR A 67 0.002 24.072 -2.616 1.00 0.00 H ATOM 156 H TYR A 67 3.078 26.185 -8.492 1.00 0.00 H ATOM 157 N GLY A 68 5.794 27.582 -8.824 1.00 28.66 N ATOM 158 CA GLY A 68 7.004 28.007 -9.499 1.00 26.78 C ATOM 159 C GLY A 68 7.933 26.890 -9.900 1.00 27.43 C ATOM 160 O GLY A 68 9.134 27.128 -10.049 1.00 25.74 O ATOM 161 H GLY A 68 4.885 27.652 -9.324 1.00 0.00 H ATOM 162 N ILE A 69 7.414 25.670 -10.079 1.00 25.15 N ATOM 163 CA ILE A 69 8.261 24.546 -10.460 1.00 28.49 C ATOM 164 C ILE A 69 8.582 24.683 -11.943 1.00 33.79 C ATOM 165 O ILE A 69 7.870 24.146 -12.803 1.00 29.89 O ATOM 166 CB ILE A 69 7.602 23.195 -10.140 1.00 31.24 C ATOM 167 CG1 ILE A 69 7.097 23.177 -8.691 1.00 27.24 C ATOM 168 CG2 ILE A 69 8.597 22.054 -10.403 1.00 27.56 C ATOM 169 CD1 ILE A 69 8.191 23.454 -7.632 1.00 27.03 C ATOM 170 H ILE A 69 6.393 25.521 -9.945 1.00 0.00 H ATOM 171 N TYR A 70 9.664 25.412 -12.234 1.00 31.08 N ATOM 172 CA TYR A 70 9.894 25.944 -13.574 1.00 34.60 C ATOM 173 C TYR A 70 10.106 24.835 -14.603 1.00 35.62 C ATOM 174 O TYR A 70 9.529 24.862 -15.699 1.00 30.86 O ATOM 175 CB TYR A 70 11.099 26.885 -13.546 1.00 30.62 C ATOM 176 CG TYR A 70 11.414 27.502 -14.894 1.00 34.84 C ATOM 177 CD1 TYR A 70 10.858 28.720 -15.270 1.00 31.80 C ATOM 178 CD2 TYR A 70 12.276 26.872 -15.786 1.00 36.76 C ATOM 179 CE1 TYR A 70 11.147 29.295 -16.505 1.00 31.93 C ATOM 180 CE2 TYR A 70 12.570 27.438 -17.029 1.00 41.81 C ATOM 181 CZ TYR A 70 12.004 28.645 -17.379 1.00 35.95 C ATOM 182 OH TYR A 70 12.300 29.198 -18.605 1.00 42.21 O ATOM 183 HH TYR A 70 11.818 30.057 -18.703 1.00 0.00 H ATOM 184 H TYR A 70 10.360 25.605 -11.486 1.00 0.00 H ATOM 185 N GLU A 71 10.969 23.871 -14.287 1.00 37.78 N ATOM 186 CA GLU A 71 11.271 22.829 -15.263 1.00 36.38 C ATOM 187 C GLU A 71 10.065 21.924 -15.510 1.00 35.15 C ATOM 188 O GLU A 71 9.884 21.428 -16.626 1.00 39.75 O ATOM 189 CB GLU A 71 12.496 22.030 -14.800 1.00 32.85 C ATOM 190 CG GLU A 71 13.557 21.871 -15.880 1.00 45.43 C ATOM 191 CD GLU A 71 14.212 23.189 -16.243 1.00 48.96 C ATOM 192 OE1 GLU A 71 14.972 23.738 -15.419 1.00 51.49 O ATOM 193 OE2 GLU A 71 13.928 23.701 -17.343 1.00 52.17 O ATOM 194 H GLU A 71 11.424 23.861 -13.352 1.00 0.00 H ATOM 195 N ARG A 72 9.219 21.719 -14.499 1.00 30.33 N ATOM 196 CA ARG A 72 7.996 20.949 -14.702 1.00 35.18 C ATOM 197 C ARG A 72 7.102 21.631 -15.726 1.00 36.63 C ATOM 198 O ARG A 72 6.607 20.995 -16.661 1.00 36.10 O ATOM 199 CB ARG A 72 7.259 20.769 -13.371 1.00 30.16 C ATOM 200 CG ARG A 72 5.973 19.980 -13.449 1.00 35.52 C ATOM 201 CD ARG A 72 6.152 18.646 -14.171 1.00 38.61 C ATOM 202 NE ARG A 72 4.896 17.899 -14.202 1.00 40.83 N ATOM 203 CZ ARG A 72 4.621 16.909 -15.048 1.00 41.37 C ATOM 204 NH1 ARG A 72 5.513 16.519 -15.950 1.00 39.59 N ATOM 205 NH2 ARG A 72 3.447 16.302 -14.985 1.00 39.51 N ATOM 206 HE ARG A 72 4.163 18.160 -13.512 1.00 0.00 H ATOM 207 HH12 ARG A 72 5.285 15.744 -16.605 1.00 0.00 H ATOM 208 HH11 ARG A 72 6.440 16.988 -16.002 1.00 0.00 H ATOM 209 HH22 ARG A 72 3.226 15.528 -15.643 1.00 0.00 H ATOM 210 HH21 ARG A 72 2.745 16.599 -14.277 1.00 0.00 H ATOM 211 H ARG A 72 9.433 22.111 -13.560 1.00 0.00 H ATOM 212 N CYS A 73 6.894 22.937 -15.562 1.00 34.24 N ATOM 213 CA CYS A 73 6.053 23.685 -16.486 1.00 35.63 C ATOM 214 C CYS A 73 6.629 23.652 -17.894 1.00 34.50 C ATOM 215 O CYS A 73 5.904 23.435 -18.868 1.00 37.93 O ATOM 216 CB CYS A 73 5.904 25.128 -15.994 1.00 31.83 C ATOM 217 SG CYS A 73 5.135 25.284 -14.347 1.00 37.67 S ATOM 218 H CYS A 73 7.339 23.430 -14.762 1.00 0.00 H ATOM 219 N ARG A 74 7.937 23.844 -18.012 1.00 36.68 N ATOM 220 CA ARG A 74 8.576 23.882 -19.315 1.00 40.47 C ATOM 221 C ARG A 74 8.465 22.542 -20.029 1.00 42.40 C ATOM 222 O ARG A 74 8.268 22.513 -21.242 1.00 42.58 O ATOM 223 CB ARG A 74 10.039 24.304 -19.156 1.00 41.87 C ATOM 224 CG ARG A 74 10.837 24.304 -20.438 1.00 48.63 C ATOM 225 CD ARG A 74 12.305 24.089 -20.129 1.00 53.32 C ATOM 226 NE ARG A 74 13.062 23.765 -21.330 1.00 59.03 N ATOM 227 CZ ARG A 74 13.446 24.665 -22.234 1.00 66.18 C ATOM 228 NH1 ARG A 74 13.142 25.949 -22.054 1.00 62.90 N ATOM 229 NH2 ARG A 74 14.134 24.285 -23.315 1.00 55.14 N ATOM 230 HE ARG A 74 13.319 22.770 -21.492 1.00 0.00 H ATOM 231 HH12 ARG A 74 13.439 26.657 -22.756 1.00 0.00 H ATOM 232 HH11 ARG A 74 12.608 26.244 -21.212 1.00 0.00 H ATOM 233 HH22 ARG A 74 14.431 24.992 -24.017 1.00 0.00 H ATOM 234 HH21 ARG A 74 14.372 23.282 -23.454 1.00 0.00 H ATOM 235 H ARG A 74 8.514 23.969 -17.156 1.00 0.00 H ATOM 236 N GLU A 75 8.545 21.427 -19.302 1.00 38.53 N ATOM 237 CA GLU A 75 8.399 20.137 -19.964 1.00 40.66 C ATOM 238 C GLU A 75 6.962 19.920 -20.427 1.00 42.26 C ATOM 239 O GLU A 75 6.735 19.436 -21.545 1.00 39.47 O ATOM 240 CB GLU A 75 8.898 19.010 -19.051 1.00 36.50 C ATOM 241 CG GLU A 75 7.875 18.259 -18.236 1.00 43.64 C ATOM 242 CD GLU A 75 8.526 17.387 -17.149 1.00 52.37 C ATOM 243 OE1 GLU A 75 9.736 17.570 -16.877 1.00 56.25 O ATOM 244 OE2 GLU A 75 7.830 16.533 -16.555 1.00 45.26 O ATOM 245 H GLU A 75 8.709 21.477 -18.276 1.00 0.00 H ATOM 246 N LEU A 76 5.976 20.326 -19.617 1.00 39.95 N ATOM 247 CA LEU A 76 4.579 20.187 -20.029 1.00 39.09 C ATOM 248 C LEU A 76 4.260 21.040 -21.253 1.00 43.61 C ATOM 249 O LEU A 76 3.413 20.655 -22.069 1.00 45.88 O ATOM 250 CB LEU A 76 3.644 20.546 -18.871 1.00 39.32 C ATOM 251 CG LEU A 76 3.735 19.585 -17.680 1.00 40.55 C ATOM 252 CD1 LEU A 76 2.729 19.900 -16.586 1.00 35.13 C ATOM 253 CD2 LEU A 76 3.557 18.167 -18.161 1.00 42.86 C ATOM 254 H LEU A 76 6.204 20.742 -18.691 1.00 0.00 H ATOM 255 N VAL A 77 4.937 22.183 -21.415 1.00 44.78 N ATOM 256 CA VAL A 77 4.669 23.060 -22.558 1.00 43.80 C ATOM 257 C VAL A 77 5.231 22.454 -23.842 1.00 48.08 C ATOM 258 O VAL A 77 4.515 22.315 -24.841 1.00 48.42 O ATOM 259 CB VAL A 77 5.226 24.474 -22.299 1.00 40.10 C ATOM 260 CG1 VAL A 77 5.161 25.310 -23.542 1.00 38.99 C ATOM 261 CG2 VAL A 77 4.424 25.164 -21.211 1.00 42.89 C ATOM 262 H VAL A 77 5.663 22.452 -20.721 1.00 0.00 H ATOM 263 N GLU A 78 6.518 22.074 -23.831 1.00 48.62 N ATOM 264 CA GLU A 78 7.118 21.450 -25.008 1.00 44.94 C ATOM 265 C GLU A 78 6.415 20.151 -25.380 1.00 47.32 C ATOM 266 O GLU A 78 6.384 19.777 -26.557 1.00 54.72 O ATOM 267 CB GLU A 78 8.601 21.162 -24.780 1.00 43.73 C ATOM 268 CG GLU A 78 9.346 22.149 -23.928 1.00 44.08 C ATOM 269 CD GLU A 78 9.893 23.348 -24.689 1.00 59.36 C ATOM 270 OE1 GLU A 78 9.276 23.761 -25.701 1.00 62.74 O ATOM 271 OE2 GLU A 78 10.940 23.897 -24.261 1.00 58.08 O ATOM 272 H GLU A 78 7.093 22.225 -22.978 1.00 0.00 H ATOM 273 N ALA A 79 5.871 19.436 -24.400 1.00 45.89 N ATOM 274 CA ALA A 79 5.105 18.239 -24.714 1.00 48.01 C ATOM 275 C ALA A 79 3.732 18.560 -25.279 1.00 48.05 C ATOM 276 O ALA A 79 2.957 17.629 -25.523 1.00 50.66 O ATOM 277 CB ALA A 79 4.961 17.350 -23.477 1.00 39.47 C ATOM 278 H ALA A 79 5.993 19.732 -23.410 1.00 0.00 H ATOM 279 N GLY A 80 3.404 19.836 -25.467 1.00 48.04 N ATOM 280 CA GLY A 80 2.200 20.221 -26.183 1.00 49.57 C ATOM 281 C GLY A 80 1.202 21.087 -25.430 1.00 49.63 C ATOM 282 O GLY A 80 0.187 21.471 -26.032 1.00 46.24 O ATOM 283 H GLY A 80 4.027 20.579 -25.091 1.00 0.00 H ATOM 284 N TYR A 81 1.389 21.425 -24.150 1.00 47.78 N ATOM 285 CA TYR A 81 0.389 22.247 -23.473 1.00 45.15 C ATOM 286 C TYR A 81 0.463 23.672 -24.011 1.00 41.86 C ATOM 287 O TYR A 81 1.533 24.287 -24.010 1.00 43.61 O ATOM 288 CB TYR A 81 0.568 22.233 -21.951 1.00 43.51 C ATOM 289 CG TYR A 81 -0.665 22.764 -21.237 1.00 40.35 C ATOM 290 CD1 TYR A 81 -0.837 24.124 -21.023 1.00 37.77 C ATOM 291 CD2 TYR A 81 -1.674 21.912 -20.824 1.00 37.74 C ATOM 292 CE1 TYR A 81 -1.966 24.618 -20.402 1.00 36.89 C ATOM 293 CE2 TYR A 81 -2.807 22.399 -20.203 1.00 41.63 C ATOM 294 CZ TYR A 81 -2.946 23.754 -19.997 1.00 39.37 C ATOM 295 OH TYR A 81 -4.074 24.245 -19.383 1.00 42.97 O ATOM 296 HH TYR A 81 -4.009 25.231 -19.316 1.00 0.00 H ATOM 297 H TYR A 81 2.238 21.106 -23.641 1.00 0.00 H ATOM 298 N ASP A 82 -0.671 24.176 -24.496 1.00 39.66 N ATOM 299 CA ASP A 82 -0.761 25.517 -25.062 1.00 43.23 C ATOM 300 C ASP A 82 -0.761 26.531 -23.924 1.00 39.21 C ATOM 301 O ASP A 82 -1.668 26.520 -23.088 1.00 36.52 O ATOM 302 CB ASP A 82 -2.032 25.644 -25.908 1.00 36.85 C ATOM 303 CG ASP A 82 -2.033 26.876 -26.817 1.00 44.43 C ATOM 304 OD1 ASP A 82 -1.413 27.905 -26.468 1.00 42.67 O ATOM 305 OD2 ASP A 82 -2.670 26.819 -27.896 1.00 50.41 O ATOM 306 H ASP A 82 -1.528 23.588 -24.470 1.00 0.00 H ATOM 307 N VAL A 83 0.248 27.409 -23.897 1.00 40.74 N ATOM 308 CA VAL A 83 0.327 28.408 -22.834 1.00 40.05 C ATOM 309 C VAL A 83 -0.879 29.334 -22.847 1.00 42.99 C ATOM 310 O VAL A 83 -1.198 29.944 -21.816 1.00 38.25 O ATOM 311 CB VAL A 83 1.647 29.213 -22.923 1.00 38.62 C ATOM 312 CG1 VAL A 83 2.837 28.260 -23.011 1.00 42.76 C ATOM 313 CG2 VAL A 83 1.638 30.206 -24.103 1.00 36.25 C ATOM 314 H VAL A 83 0.979 27.380 -24.636 1.00 0.00 H ATOM 315 N ARG A 84 -1.573 29.443 -23.992 1.00 39.42 N ATOM 316 CA ARG A 84 -2.761 30.277 -24.111 1.00 36.38 C ATOM 317 C ARG A 84 -4.040 29.571 -23.679 1.00 36.61 C ATOM 318 O ARG A 84 -5.079 30.224 -23.548 1.00 39.02 O ATOM 319 CB ARG A 84 -2.910 30.776 -25.549 1.00 36.75 C ATOM 320 CG ARG A 84 -1.979 31.934 -25.873 1.00 41.01 C ATOM 321 CD ARG A 84 -1.572 31.989 -27.344 1.00 39.18 C ATOM 322 NE ARG A 84 -2.447 32.853 -28.129 1.00 43.21 N ATOM 323 CZ ARG A 84 -2.042 33.913 -28.824 1.00 43.86 C ATOM 324 NH1 ARG A 84 -2.935 34.623 -29.507 1.00 43.90 N ATOM 325 NH2 ARG A 84 -0.756 34.264 -28.845 1.00 34.28 N ATOM 326 HE ARG A 84 -3.461 32.624 -28.147 1.00 0.00 H ATOM 327 HH12 ARG A 84 -2.631 35.454 -30.054 1.00 0.00 H ATOM 328 HH11 ARG A 84 -3.938 34.348 -29.494 1.00 0.00 H ATOM 329 HH22 ARG A 84 -0.453 35.095 -29.392 1.00 0.00 H ATOM 330 HH21 ARG A 84 -0.056 33.707 -28.314 1.00 0.00 H ATOM 331 H ARG A 84 -1.250 28.911 -24.825 1.00 0.00 H ATOM 332 N GLN A 85 -3.993 28.277 -23.433 1.00 38.96 N ATOM 333 CA GLN A 85 -5.208 27.529 -23.143 1.00 38.99 C ATOM 334 C GLN A 85 -5.640 27.766 -21.708 1.00 37.87 C ATOM 335 O GLN A 85 -4.860 27.502 -20.781 1.00 38.04 O ATOM 336 CB GLN A 85 -4.972 26.054 -23.388 1.00 40.00 C ATOM 337 CG GLN A 85 -6.021 25.155 -22.788 1.00 46.70 C ATOM 338 CD GLN A 85 -5.784 23.721 -23.182 1.00 54.90 C ATOM 339 OE1 GLN A 85 -5.532 23.427 -24.356 1.00 60.66 O ATOM 340 NE2 GLN A 85 -5.839 22.816 -22.208 1.00 50.74 N ATOM 341 HE22 GLN A 85 -6.055 23.112 -21.235 1.00 0.00 H ATOM 342 HE21 GLN A 85 -5.666 21.813 -22.420 1.00 0.00 H ATOM 343 H GLN A 85 -3.077 27.784 -23.446 1.00 0.00 H ATOM 344 N PRO A 86 -6.843 28.271 -21.463 1.00 41.02 N ATOM 345 CA PRO A 86 -7.306 28.487 -20.090 1.00 37.40 C ATOM 346 C PRO A 86 -7.684 27.173 -19.413 1.00 43.11 C ATOM 347 O PRO A 86 -7.844 26.134 -20.059 1.00 42.27 O ATOM 348 CB PRO A 86 -8.531 29.391 -20.266 1.00 38.15 C ATOM 349 CG PRO A 86 -9.006 29.099 -21.628 1.00 34.53 C ATOM 350 CD PRO A 86 -7.784 28.813 -22.456 1.00 34.87 C ATOM 351 N ASP A 87 -7.805 27.236 -18.082 1.00 38.12 N ATOM 352 CA ASP A 87 -8.238 26.096 -17.292 1.00 34.68 C ATOM 353 C ASP A 87 -9.760 26.133 -17.124 1.00 37.63 C ATOM 354 O ASP A 87 -10.441 27.008 -17.659 1.00 37.66 O ATOM 355 CB ASP A 87 -7.501 26.064 -15.945 1.00 36.22 C ATOM 356 CG ASP A 87 -7.746 27.305 -15.076 1.00 39.93 C ATOM 357 OD1 ASP A 87 -8.729 28.050 -15.291 1.00 37.63 O ATOM 358 OD2 ASP A 87 -6.933 27.530 -14.147 1.00 40.40 O ATOM 359 H ASP A 87 -7.582 28.129 -17.598 1.00 0.00 H ATOM 360 N LYS A 88 -10.307 25.186 -16.352 1.00 39.18 N ATOM 361 CA LYS A 88 -11.760 25.086 -16.225 1.00 40.33 C ATOM 362 C LYS A 88 -12.364 26.285 -15.518 1.00 39.54 C ATOM 363 O LYS A 88 -13.589 26.460 -15.549 1.00 37.56 O ATOM 364 CB LYS A 88 -12.160 23.807 -15.484 1.00 35.09 C ATOM 365 H LYS A 88 -9.696 24.518 -15.840 1.00 0.00 H ATOM 366 N GLU A 89 -11.546 27.108 -14.880 1.00 37.24 N ATOM 367 CA GLU A 89 -12.026 28.329 -14.262 1.00 39.38 C ATOM 368 C GLU A 89 -11.895 29.531 -15.189 1.00 37.98 C ATOM 369 O GLU A 89 -12.163 30.657 -14.759 1.00 36.16 O ATOM 370 CB GLU A 89 -11.262 28.600 -12.971 1.00 40.74 C ATOM 371 CG GLU A 89 -11.415 27.563 -11.887 1.00 42.71 C ATOM 372 CD GLU A 89 -10.319 27.735 -10.827 1.00 53.26 C ATOM 373 OE1 GLU A 89 -9.150 27.363 -11.105 1.00 59.00 O ATOM 374 OE2 GLU A 89 -10.612 28.288 -9.737 1.00 54.14 O ATOM 375 H GLU A 89 -10.535 26.873 -14.821 1.00 0.00 H ATOM 376 N ASN A 90 -11.491 29.310 -16.446 1.00 35.75 N ATOM 377 CA ASN A 90 -11.170 30.383 -17.389 1.00 38.89 C ATOM 378 C ASN A 90 -10.056 31.278 -16.837 1.00 34.95 C ATOM 379 O ASN A 90 -10.153 32.505 -16.838 1.00 38.05 O ATOM 380 CB ASN A 90 -12.421 31.196 -17.761 1.00 36.47 C ATOM 381 CG ASN A 90 -12.202 32.101 -18.981 1.00 41.33 C ATOM 382 OD1 ASN A 90 -11.503 31.740 -19.930 1.00 39.93 O ATOM 383 ND2 ASN A 90 -12.797 33.290 -18.947 1.00 40.76 N ATOM 384 HD22 ASN A 90 -13.379 33.557 -18.127 1.00 0.00 H ATOM 385 HD21 ASN A 90 -12.680 33.953 -19.740 1.00 0.00 H ATOM 386 H ASN A 90 -11.401 28.326 -16.769 1.00 0.00 H ATOM 387 N VAL A 91 -8.977 30.645 -16.375 1.00 33.09 N ATOM 388 CA VAL A 91 -7.787 31.335 -15.881 1.00 31.91 C ATOM 389 C VAL A 91 -6.582 30.857 -16.690 1.00 29.72 C ATOM 390 O VAL A 91 -6.399 29.649 -16.884 1.00 35.52 O ATOM 391 CB VAL A 91 -7.575 31.084 -14.368 1.00 31.12 C ATOM 392 CG1 VAL A 91 -6.272 31.707 -13.884 1.00 28.53 C ATOM 393 CG2 VAL A 91 -8.773 31.607 -13.540 1.00 30.94 C ATOM 394 H VAL A 91 -8.983 29.605 -16.366 1.00 0.00 H ATOM 395 N THR A 92 -5.751 31.790 -17.143 1.00 26.95 N ATOM 396 CA THR A 92 -4.578 31.398 -17.908 1.00 29.68 C ATOM 397 C THR A 92 -3.379 31.194 -16.994 1.00 30.75 C ATOM 398 O THR A 92 -3.351 31.655 -15.854 1.00 29.67 O ATOM 399 CB THR A 92 -4.222 32.437 -18.960 1.00 28.02 C ATOM 400 OG1 THR A 92 -3.499 33.510 -18.336 1.00 29.94 O ATOM 401 CG2 THR A 92 -5.485 32.969 -19.617 1.00 32.55 C ATOM 402 HG1 THR A 92 -4.064 33.924 -17.636 1.00 0.00 H ATOM 403 H THR A 92 -5.939 32.795 -16.951 1.00 0.00 H ATOM 404 N LEU A 93 -2.365 30.516 -17.534 1.00 30.63 N ATOM 405 CA LEU A 93 -1.154 30.260 -16.771 1.00 31.65 C ATOM 406 C LEU A 93 -0.468 31.564 -16.369 1.00 30.63 C ATOM 407 O LEU A 93 0.120 31.653 -15.286 1.00 25.62 O ATOM 408 CB LEU A 93 -0.209 29.371 -17.582 1.00 26.16 C ATOM 409 CG LEU A 93 -0.690 27.968 -17.965 1.00 31.42 C ATOM 410 CD1 LEU A 93 0.414 27.258 -18.727 1.00 32.65 C ATOM 411 CD2 LEU A 93 -1.093 27.129 -16.761 1.00 29.63 C ATOM 412 H LEU A 93 -2.441 30.167 -18.511 1.00 0.00 H ATOM 413 N LEU A 94 -0.531 32.587 -17.229 1.00 29.03 N ATOM 414 CA LEU A 94 0.045 33.877 -16.869 1.00 26.75 C ATOM 415 C LEU A 94 -0.576 34.419 -15.584 1.00 27.87 C ATOM 416 O LEU A 94 0.127 34.981 -14.729 1.00 27.19 O ATOM 417 CB LEU A 94 -0.126 34.874 -18.013 1.00 24.55 C ATOM 418 CG LEU A 94 0.990 35.924 -18.031 1.00 23.65 C ATOM 419 CD1 LEU A 94 2.346 35.246 -18.105 1.00 27.37 C ATOM 420 CD2 LEU A 94 0.856 36.948 -19.145 1.00 25.10 C ATOM 421 H LEU A 94 -0.991 32.462 -18.154 1.00 0.00 H ATOM 422 N HIS A 95 -1.890 34.256 -15.427 1.00 28.28 N ATOM 423 CA HIS A 95 -2.558 34.718 -14.211 1.00 26.72 C ATOM 424 C HIS A 95 -1.945 34.063 -12.988 1.00 30.22 C ATOM 425 O HIS A 95 -1.545 34.746 -12.037 1.00 28.70 O ATOM 426 CB HIS A 95 -4.057 34.410 -14.258 1.00 25.37 C ATOM 427 CG HIS A 95 -4.843 35.299 -15.174 1.00 28.92 C ATOM 428 ND1 HIS A 95 -5.012 35.019 -16.515 1.00 28.57 N ATOM 429 CD2 HIS A 95 -5.525 36.446 -14.938 1.00 25.65 C ATOM 430 CE1 HIS A 95 -5.755 35.963 -17.066 1.00 30.95 C ATOM 431 NE2 HIS A 95 -6.083 36.839 -16.131 1.00 30.02 N ATOM 432 H HIS A 95 -2.445 33.796 -16.177 1.00 0.00 H ATOM 433 N TRP A 96 -1.873 32.727 -12.999 1.00 29.66 N ATOM 434 CA TRP A 96 -1.349 31.991 -11.852 1.00 30.60 C ATOM 435 C TRP A 96 0.095 32.382 -11.570 1.00 28.60 C ATOM 436 O TRP A 96 0.480 32.572 -10.407 1.00 26.93 O ATOM 437 CB TRP A 96 -1.469 30.484 -12.097 1.00 25.84 C ATOM 438 CG TRP A 96 -2.895 29.960 -12.081 1.00 32.41 C ATOM 439 CD1 TRP A 96 -3.530 29.293 -13.089 1.00 32.55 C ATOM 440 CD2 TRP A 96 -3.851 30.061 -11.009 1.00 29.42 C ATOM 441 NE1 TRP A 96 -4.810 28.965 -12.712 1.00 32.15 N ATOM 442 CE2 TRP A 96 -5.038 29.428 -11.446 1.00 30.57 C ATOM 443 CE3 TRP A 96 -3.819 30.620 -9.723 1.00 31.72 C ATOM 444 CZ2 TRP A 96 -6.184 29.334 -10.643 1.00 32.01 C ATOM 445 CZ3 TRP A 96 -4.965 30.522 -8.920 1.00 30.01 C ATOM 446 CH2 TRP A 96 -6.125 29.884 -9.388 1.00 32.78 C ATOM 447 HE1 TRP A 96 -5.496 28.447 -13.297 1.00 0.00 H ATOM 448 H TRP A 96 -2.196 32.204 -13.838 1.00 0.00 H ATOM 449 N ALA A 97 0.897 32.533 -12.630 1.00 28.13 N ATOM 450 CA ALA A 97 2.286 32.958 -12.468 1.00 31.40 C ATOM 451 C ALA A 97 2.358 34.332 -11.814 1.00 28.33 C ATOM 452 O ALA A 97 3.114 34.543 -10.854 1.00 27.24 O ATOM 453 CB ALA A 97 2.993 32.966 -13.828 1.00 24.48 C ATOM 454 H ALA A 97 0.527 32.345 -13.583 1.00 0.00 H ATOM 455 N ALA A 98 1.548 35.269 -12.306 1.00 25.32 N ATOM 456 CA ALA A 98 1.585 36.643 -11.809 1.00 26.60 C ATOM 457 C ALA A 98 1.190 36.725 -10.337 1.00 26.38 C ATOM 458 O ALA A 98 1.836 37.422 -9.538 1.00 28.37 O ATOM 459 CB ALA A 98 0.653 37.515 -12.654 1.00 25.95 C ATOM 460 H ALA A 98 0.876 35.017 -13.059 1.00 0.00 H ATOM 461 N ILE A 99 0.099 36.058 -9.962 1.00 26.39 N ATOM 462 CA ILE A 99 -0.390 36.178 -8.598 1.00 27.56 C ATOM 463 C ILE A 99 0.499 35.446 -7.606 1.00 26.43 C ATOM 464 O ILE A 99 0.372 35.667 -6.394 1.00 28.09 O ATOM 465 CB ILE A 99 -1.847 35.683 -8.500 1.00 29.96 C ATOM 466 CG1 ILE A 99 -2.595 36.453 -7.401 1.00 28.28 C ATOM 467 CG2 ILE A 99 -1.889 34.184 -8.260 1.00 28.77 C ATOM 468 CD1 ILE A 99 -4.002 35.963 -7.135 1.00 23.91 C ATOM 469 H ILE A 99 -0.402 35.453 -10.644 1.00 0.00 H ATOM 470 N ASN A 100 1.416 34.600 -8.087 1.00 26.21 N ATOM 471 CA ASN A 100 2.418 33.976 -7.230 1.00 27.79 C ATOM 472 C ASN A 100 3.810 34.563 -7.443 1.00 26.54 C ATOM 473 O ASN A 100 4.796 33.960 -7.016 1.00 25.02 O ATOM 474 CB ASN A 100 2.452 32.460 -7.436 1.00 24.90 C ATOM 475 CG ASN A 100 1.284 31.757 -6.762 1.00 29.61 C ATOM 476 OD1 ASN A 100 1.268 31.589 -5.548 1.00 30.19 O ATOM 477 ND2 ASN A 100 0.295 31.357 -7.551 1.00 30.56 N ATOM 478 HD22 ASN A 100 0.350 31.520 -8.577 1.00 0.00 H ATOM 479 HD21 ASN A 100 -0.535 30.881 -7.144 1.00 0.00 H ATOM 480 H ASN A 100 1.415 34.380 -9.103 1.00 0.00 H ATOM 481 N ASN A 101 3.915 35.714 -8.109 1.00 21.25 N ATOM 482 CA ASN A 101 5.197 36.412 -8.270 1.00 25.50 C ATOM 483 C ASN A 101 6.258 35.556 -8.979 1.00 26.74 C ATOM 484 O ASN A 101 7.464 35.742 -8.774 1.00 28.18 O ATOM 485 CB ASN A 101 5.728 36.905 -6.916 1.00 24.03 C ATOM 486 CG ASN A 101 6.801 37.956 -7.068 1.00 28.35 C ATOM 487 OD1 ASN A 101 6.664 38.878 -7.868 1.00 29.46 O ATOM 488 ND2 ASN A 101 7.895 37.810 -6.325 1.00 28.74 N ATOM 489 HD22 ASN A 101 7.969 37.014 -5.660 1.00 0.00 H ATOM 490 HD21 ASN A 101 8.676 38.492 -6.410 1.00 0.00 H ATOM 491 H ASN A 101 3.060 36.131 -8.529 1.00 0.00 H ATOM 492 N ARG A 102 5.845 34.628 -9.844 1.00 27.50 N ATOM 493 CA ARG A 102 6.792 33.766 -10.558 1.00 26.52 C ATOM 494 C ARG A 102 7.349 34.526 -11.765 1.00 28.25 C ATOM 495 O ARG A 102 6.923 34.351 -12.914 1.00 26.92 O ATOM 496 CB ARG A 102 6.119 32.461 -10.962 1.00 27.38 C ATOM 497 CG ARG A 102 5.452 31.714 -9.807 1.00 25.25 C ATOM 498 CD ARG A 102 6.382 31.516 -8.600 1.00 23.39 C ATOM 499 NE ARG A 102 5.634 30.871 -7.524 1.00 29.73 N ATOM 500 CZ ARG A 102 6.060 30.713 -6.272 1.00 29.90 C ATOM 501 NH1 ARG A 102 7.251 31.145 -5.906 1.00 28.58 N ATOM 502 NH2 ARG A 102 5.288 30.114 -5.387 1.00 23.92 N ATOM 503 HE ARG A 102 4.689 30.504 -7.755 1.00 0.00 H ATOM 504 HH12 ARG A 102 7.572 31.016 -4.925 1.00 0.00 H ATOM 505 HH11 ARG A 102 7.869 31.615 -6.598 1.00 0.00 H ATOM 506 HH22 ARG A 102 5.618 29.989 -4.409 1.00 0.00 H ATOM 507 HH21 ARG A 102 4.349 29.766 -5.667 1.00 0.00 H ATOM 508 H ARG A 102 4.826 34.513 -10.016 1.00 0.00 H ATOM 509 N ILE A 103 8.349 35.371 -11.478 1.00 28.23 N ATOM 510 CA ILE A 103 8.953 36.248 -12.487 1.00 27.00 C ATOM 511 C ILE A 103 9.431 35.450 -13.699 1.00 31.67 C ATOM 512 O ILE A 103 9.117 35.787 -14.851 1.00 31.62 O ATOM 513 CB ILE A 103 10.120 37.040 -11.874 1.00 28.68 C ATOM 514 CG1 ILE A 103 9.632 37.947 -10.740 1.00 29.69 C ATOM 515 CG2 ILE A 103 10.884 37.796 -12.974 1.00 32.53 C ATOM 516 CD1 ILE A 103 9.000 39.260 -11.200 1.00 29.61 C ATOM 517 H ILE A 103 8.710 35.406 -10.503 1.00 0.00 H ATOM 518 N ASP A 104 10.226 34.402 -13.461 1.00 27.94 N ATOM 519 CA ASP A 104 10.809 33.660 -14.575 1.00 27.64 C ATOM 520 C ASP A 104 9.749 32.928 -15.376 1.00 31.42 C ATOM 521 O ASP A 104 9.818 32.897 -16.610 1.00 31.93 O ATOM 522 CB ASP A 104 11.854 32.675 -14.072 1.00 30.13 C ATOM 523 CG ASP A 104 13.160 33.362 -13.706 1.00 36.67 C ATOM 524 OD1 ASP A 104 13.367 34.518 -14.148 1.00 32.58 O ATOM 525 OD2 ASP A 104 13.970 32.743 -12.984 1.00 35.57 O ATOM 526 H ASP A 104 10.429 34.115 -12.482 1.00 0.00 H ATOM 527 N LEU A 105 8.778 32.307 -14.700 1.00 26.73 N ATOM 528 CA LEU A 105 7.689 31.681 -15.438 1.00 29.65 C ATOM 529 C LEU A 105 6.955 32.708 -16.279 1.00 29.45 C ATOM 530 O LEU A 105 6.512 32.403 -17.393 1.00 28.99 O ATOM 531 CB LEU A 105 6.719 30.977 -14.497 1.00 23.81 C ATOM 532 CG LEU A 105 7.128 29.558 -14.107 1.00 28.97 C ATOM 533 CD1 LEU A 105 6.079 28.982 -13.201 1.00 27.70 C ATOM 534 CD2 LEU A 105 7.343 28.650 -15.324 1.00 25.23 C ATOM 535 H LEU A 105 8.799 32.271 -13.661 1.00 0.00 H ATOM 536 N VAL A 106 6.836 33.941 -15.778 1.00 28.22 N ATOM 537 CA VAL A 106 6.125 34.953 -16.545 1.00 30.07 C ATOM 538 C VAL A 106 6.884 35.263 -17.835 1.00 33.28 C ATOM 539 O VAL A 106 6.298 35.267 -18.921 1.00 28.60 O ATOM 540 CB VAL A 106 5.879 36.219 -15.709 1.00 29.20 C ATOM 541 CG1 VAL A 106 5.571 37.391 -16.634 1.00 28.94 C ATOM 542 CG2 VAL A 106 4.721 36.010 -14.745 1.00 27.06 C ATOM 543 H VAL A 106 7.246 34.175 -14.851 1.00 0.00 H ATOM 544 N LYS A 107 8.193 35.526 -17.730 1.00 31.88 N ATOM 545 CA LYS A 107 9.016 35.722 -18.922 1.00 34.61 C ATOM 546 C LYS A 107 8.844 34.565 -19.895 1.00 32.38 C ATOM 547 O LYS A 107 8.658 34.768 -21.100 1.00 33.34 O ATOM 548 CB LYS A 107 10.491 35.856 -18.536 1.00 31.25 C ATOM 549 CG LYS A 107 10.810 36.955 -17.532 1.00 41.32 C ATOM 550 CD LYS A 107 12.248 37.446 -17.741 1.00 46.34 C ATOM 551 CE LYS A 107 12.816 38.083 -16.485 1.00 48.79 C ATOM 552 NZ LYS A 107 14.219 38.541 -16.676 1.00 57.64 N ATOM 553 HZ1 LYS A 107 14.817 37.728 -16.927 1.00 0.00 H ATOM 554 HZ2 LYS A 107 14.251 39.245 -17.441 1.00 0.00 H ATOM 555 HZ3 LYS A 107 14.566 38.969 -15.794 1.00 0.00 H ATOM 556 H LYS A 107 8.630 35.592 -16.788 1.00 0.00 H ATOM 557 N TYR A 108 8.890 33.334 -19.378 1.00 34.03 N ATOM 558 CA TYR A 108 8.866 32.160 -20.244 1.00 33.04 C ATOM 559 C TYR A 108 7.532 32.039 -20.966 1.00 32.16 C ATOM 560 O TYR A 108 7.493 31.847 -22.184 1.00 36.20 O ATOM 561 CB TYR A 108 9.167 30.900 -19.427 1.00 32.76 C ATOM 562 CG TYR A 108 8.944 29.619 -20.202 1.00 36.47 C ATOM 563 CD1 TYR A 108 9.872 29.186 -21.153 1.00 42.67 C ATOM 564 CD2 TYR A 108 7.808 28.843 -19.992 1.00 33.36 C ATOM 565 CE1 TYR A 108 9.673 28.005 -21.875 1.00 41.34 C ATOM 566 CE2 TYR A 108 7.602 27.662 -20.703 1.00 39.30 C ATOM 567 CZ TYR A 108 8.536 27.255 -21.648 1.00 40.91 C ATOM 568 OH TYR A 108 8.331 26.096 -22.358 1.00 44.57 O ATOM 569 HH TYR A 108 9.086 25.955 -22.983 1.00 0.00 H ATOM 570 H TYR A 108 8.944 33.211 -18.347 1.00 0.00 H ATOM 571 N TYR A 109 6.424 32.171 -20.233 1.00 31.00 N ATOM 572 CA TYR A 109 5.106 32.035 -20.846 1.00 32.04 C ATOM 573 C TYR A 109 4.871 33.116 -21.887 1.00 32.75 C ATOM 574 O TYR A 109 4.257 32.864 -22.929 1.00 36.41 O ATOM 575 CB TYR A 109 4.011 32.095 -19.777 1.00 29.21 C ATOM 576 CG TYR A 109 3.916 30.878 -18.889 1.00 31.46 C ATOM 577 CD1 TYR A 109 4.393 29.640 -19.315 1.00 31.42 C ATOM 578 CD2 TYR A 109 3.323 30.958 -17.637 1.00 28.83 C ATOM 579 CE1 TYR A 109 4.292 28.526 -18.517 1.00 32.34 C ATOM 580 CE2 TYR A 109 3.215 29.841 -16.829 1.00 30.08 C ATOM 581 CZ TYR A 109 3.708 28.630 -17.272 1.00 32.55 C ATOM 582 OH TYR A 109 3.613 27.517 -16.470 1.00 32.89 O ATOM 583 HH TYR A 109 2.660 27.333 -16.275 1.00 0.00 H ATOM 584 H TYR A 109 6.501 32.373 -19.216 1.00 0.00 H ATOM 585 N ILE A 110 5.342 34.331 -21.618 1.00 31.31 N ATOM 586 CA ILE A 110 5.185 35.402 -22.591 1.00 34.86 C ATOM 587 C ILE A 110 6.039 35.124 -23.819 1.00 36.12 C ATOM 588 O ILE A 110 5.616 35.376 -24.955 1.00 32.81 O ATOM 589 CB ILE A 110 5.524 36.755 -21.945 1.00 34.19 C ATOM 590 CG1 ILE A 110 4.453 37.116 -20.909 1.00 30.22 C ATOM 591 CG2 ILE A 110 5.691 37.842 -23.010 1.00 31.92 C ATOM 592 CD1 ILE A 110 4.775 38.339 -20.100 1.00 26.81 C ATOM 593 H ILE A 110 5.822 34.515 -20.714 1.00 0.00 H ATOM 594 N SER A 111 7.243 34.578 -23.617 1.00 33.72 N ATOM 595 CA SER A 111 8.082 34.231 -24.759 1.00 33.70 C ATOM 596 C SER A 111 7.454 33.123 -25.588 1.00 34.66 C ATOM 597 O SER A 111 7.660 33.065 -26.806 1.00 41.40 O ATOM 598 CB SER A 111 9.473 33.819 -24.293 1.00 32.19 C ATOM 599 OG SER A 111 9.431 32.511 -23.753 1.00 32.93 O ATOM 600 HG SER A 111 8.809 32.493 -22.983 1.00 0.00 H ATOM 601 H SER A 111 7.580 34.401 -22.649 1.00 0.00 H ATOM 602 N LYS A 112 6.678 32.248 -24.966 1.00 32.69 N ATOM 603 CA LYS A 112 5.901 31.277 -25.722 1.00 34.20 C ATOM 604 C LYS A 112 4.615 31.865 -26.289 1.00 37.33 C ATOM 605 O LYS A 112 3.778 31.107 -26.795 1.00 33.44 O ATOM 606 CB LYS A 112 5.578 30.067 -24.851 1.00 33.22 C ATOM 607 CG LYS A 112 6.806 29.390 -24.285 1.00 36.77 C ATOM 608 CD LYS A 112 7.736 28.890 -25.377 1.00 35.86 C ATOM 609 CE LYS A 112 7.191 27.670 -26.086 1.00 42.70 C ATOM 610 NZ LYS A 112 8.301 26.885 -26.731 1.00 36.99 N ATOM 611 HZ1 LYS A 112 8.791 27.485 -27.425 1.00 0.00 H ATOM 612 HZ2 LYS A 112 8.975 26.576 -26.001 1.00 0.00 H ATOM 613 HZ3 LYS A 112 7.902 26.053 -27.211 1.00 0.00 H ATOM 614 H LYS A 112 6.623 32.255 -23.927 1.00 0.00 H ATOM 615 N GLY A 113 4.431 33.181 -26.207 1.00 33.89 N ATOM 616 CA GLY A 113 3.271 33.826 -26.800 1.00 35.98 C ATOM 617 C GLY A 113 2.015 33.933 -25.952 1.00 39.27 C ATOM 618 O GLY A 113 0.940 34.178 -26.512 1.00 38.82 O ATOM 619 H GLY A 113 5.134 33.762 -25.707 1.00 0.00 H ATOM 620 N ALA A 114 2.096 33.761 -24.630 1.00 34.51 N ATOM 621 CA ALA A 114 0.926 34.026 -23.798 1.00 36.02 C ATOM 622 C ALA A 114 0.467 35.470 -23.987 1.00 36.34 C ATOM 623 O ALA A 114 1.273 36.365 -24.254 1.00 34.52 O ATOM 624 CB ALA A 114 1.237 33.759 -22.321 1.00 33.74 C ATOM 625 H ALA A 114 2.986 33.441 -24.197 1.00 0.00 H ATOM 626 N ILE A 115 -0.841 35.697 -23.862 1.00 32.26 N ATOM 627 CA ILE A 115 -1.423 37.025 -24.061 1.00 33.53 C ATOM 628 C ILE A 115 -1.333 37.787 -22.743 1.00 31.39 C ATOM 629 O ILE A 115 -1.888 37.350 -21.730 1.00 30.12 O ATOM 630 CB ILE A 115 -2.879 36.940 -24.552 1.00 32.98 C ATOM 631 CG1 ILE A 115 -2.943 36.257 -25.927 1.00 35.05 C ATOM 632 CG2 ILE A 115 -3.499 38.332 -24.617 1.00 30.65 C ATOM 633 CD1 ILE A 115 -4.251 35.569 -26.194 1.00 35.06 C ATOM 634 H ILE A 115 -1.468 34.905 -23.615 1.00 0.00 H ATOM 635 N VAL A 116 -0.670 38.949 -22.774 1.00 30.41 N ATOM 636 CA VAL A 116 -0.255 39.636 -21.550 1.00 29.87 C ATOM 637 C VAL A 116 -1.463 40.083 -20.721 1.00 27.40 C ATOM 638 O VAL A 116 -1.511 39.869 -19.503 1.00 25.10 O ATOM 639 CB VAL A 116 0.655 40.825 -21.905 1.00 27.94 C ATOM 640 CG1 VAL A 116 0.894 41.698 -20.669 1.00 31.18 C ATOM 641 CG2 VAL A 116 1.975 40.333 -22.506 1.00 30.48 C ATOM 642 H VAL A 116 -0.443 39.376 -23.695 1.00 0.00 H ATOM 643 N ASP A 117 -2.449 40.725 -21.367 1.00 29.25 N ATOM 644 CA ASP A 117 -3.602 41.324 -20.700 1.00 24.94 C ATOM 645 C ASP A 117 -4.890 40.525 -20.912 1.00 27.99 C ATOM 646 O ASP A 117 -5.987 41.086 -20.863 1.00 28.35 O ATOM 647 CB ASP A 117 -3.799 42.769 -21.170 1.00 23.26 C ATOM 648 CG ASP A 117 -2.906 43.774 -20.409 1.00 31.61 C ATOM 649 OD1 ASP A 117 -2.518 43.487 -19.253 1.00 27.19 O ATOM 650 OD2 ASP A 117 -2.574 44.851 -20.962 1.00 29.13 O ATOM 651 H ASP A 117 -2.388 40.800 -22.403 1.00 0.00 H ATOM 652 N GLN A 118 -4.781 39.218 -21.138 1.00 26.26 N ATOM 653 CA GLN A 118 -5.967 38.393 -21.357 1.00 27.85 C ATOM 654 C GLN A 118 -6.865 38.353 -20.118 1.00 33.38 C ATOM 655 O GLN A 118 -6.419 37.977 -19.032 1.00 27.70 O ATOM 656 CB GLN A 118 -5.529 36.976 -21.739 1.00 29.30 C ATOM 657 CG GLN A 118 -6.660 36.011 -22.035 1.00 32.28 C ATOM 658 CD GLN A 118 -7.562 36.508 -23.147 1.00 41.40 C ATOM 659 OE1 GLN A 118 -8.782 36.562 -22.991 1.00 46.24 O ATOM 660 NE2 GLN A 118 -6.962 36.901 -24.268 1.00 32.77 N ATOM 661 HE22 GLN A 118 -5.928 36.837 -24.354 1.00 0.00 H ATOM 662 HE21 GLN A 118 -7.528 37.272 -25.058 1.00 0.00 H ATOM 663 H GLN A 118 -3.839 38.778 -21.159 1.00 0.00 H ATOM 664 N LEU A 119 -8.141 38.719 -20.282 1.00 33.44 N ATOM 665 CA LEU A 119 -9.093 38.620 -19.175 1.00 31.08 C ATOM 666 C LEU A 119 -9.324 37.169 -18.780 1.00 34.24 C ATOM 667 O LEU A 119 -9.353 36.271 -19.623 1.00 33.79 O ATOM 668 CB LEU A 119 -10.443 39.239 -19.543 1.00 29.17 C ATOM 669 CG LEU A 119 -10.469 40.750 -19.783 1.00 31.74 C ATOM 670 CD1 LEU A 119 -11.896 41.246 -19.914 1.00 30.17 C ATOM 671 CD2 LEU A 119 -9.737 41.505 -18.691 1.00 25.82 C ATOM 672 H LEU A 119 -8.460 39.077 -21.205 1.00 0.00 H ATOM 673 N GLY A 120 -9.524 36.945 -17.480 1.00 32.25 N ATOM 674 CA GLY A 120 -9.835 35.610 -16.995 1.00 30.31 C ATOM 675 C GLY A 120 -10.492 35.649 -15.630 1.00 36.04 C ATOM 676 O GLY A 120 -10.551 36.687 -14.966 1.00 32.76 O ATOM 677 H GLY A 120 -9.457 37.734 -16.806 1.00 0.00 H ATOM 678 N GLY A 121 -10.998 34.487 -15.215 1.00 37.60 N ATOM 679 CA GLY A 121 -11.564 34.326 -13.890 1.00 35.53 C ATOM 680 C GLY A 121 -12.940 34.954 -13.751 1.00 34.80 C ATOM 681 O GLY A 121 -13.409 35.717 -14.599 1.00 32.78 O ATOM 682 H GLY A 121 -10.986 33.672 -15.861 1.00 0.00 H ATOM 683 N ASP A 122 -13.601 34.617 -12.637 1.00 35.21 N ATOM 684 CA ASP A 122 -14.931 35.162 -12.358 1.00 35.26 C ATOM 685 C ASP A 122 -14.934 36.680 -12.310 1.00 34.41 C ATOM 686 O ASP A 122 -15.944 37.307 -12.654 1.00 36.09 O ATOM 687 CB ASP A 122 -15.468 34.612 -11.038 1.00 34.58 C ATOM 688 CG ASP A 122 -15.869 33.159 -11.145 1.00 42.60 C ATOM 689 OD1 ASP A 122 -15.961 32.656 -12.284 1.00 48.66 O ATOM 690 OD2 ASP A 122 -16.083 32.512 -10.101 1.00 50.10 O ATOM 691 H ASP A 122 -13.164 33.959 -11.960 1.00 0.00 H ATOM 692 N LEU A 123 -13.834 37.288 -11.875 1.00 29.68 N ATOM 693 CA LEU A 123 -13.742 38.737 -11.780 1.00 31.43 C ATOM 694 C LEU A 123 -13.272 39.384 -13.071 1.00 31.34 C ATOM 695 O LEU A 123 -13.173 40.616 -13.126 1.00 30.37 O ATOM 696 CB LEU A 123 -12.809 39.134 -10.634 1.00 28.98 C ATOM 697 CG LEU A 123 -13.382 38.828 -9.260 1.00 33.34 C ATOM 698 CD1 LEU A 123 -12.547 39.508 -8.179 1.00 33.67 C ATOM 699 CD2 LEU A 123 -14.833 39.275 -9.201 1.00 29.88 C ATOM 700 H LEU A 123 -13.016 36.711 -11.595 1.00 0.00 H ATOM 701 N ASN A 124 -12.967 38.591 -14.099 1.00 33.83 N ATOM 702 CA ASN A 124 -12.730 39.105 -15.446 1.00 31.35 C ATOM 703 C ASN A 124 -11.601 40.133 -15.457 1.00 33.65 C ATOM 704 O ASN A 124 -11.811 41.316 -15.765 1.00 28.22 O ATOM 705 CB ASN A 124 -14.012 39.713 -16.015 1.00 33.34 C ATOM 706 CG ASN A 124 -14.163 39.453 -17.484 1.00 38.38 C ATOM 707 OD1 ASN A 124 -13.755 38.399 -17.983 1.00 38.69 O ATOM 708 ND2 ASN A 124 -14.745 40.417 -18.199 1.00 45.08 N ATOM 709 HD22 ASN A 124 -15.072 41.286 -17.731 1.00 0.00 H ATOM 710 HD21 ASN A 124 -14.872 40.299 -19.224 1.00 0.00 H ATOM 711 H ASN A 124 -12.895 37.566 -13.935 1.00 0.00 H ATOM 712 N SER A 125 -10.391 39.649 -15.137 1.00 28.73 N ATOM 713 CA SER A 125 -9.241 40.495 -14.860 1.00 29.27 C ATOM 714 C SER A 125 -8.017 40.015 -15.627 1.00 26.35 C ATOM 715 O SER A 125 -7.896 38.840 -15.994 1.00 26.02 O ATOM 716 CB SER A 125 -8.902 40.501 -13.356 1.00 27.44 C ATOM 717 OG SER A 125 -10.080 40.448 -12.576 1.00 29.49 O ATOM 718 HG SER A 125 -10.578 39.619 -12.788 1.00 0.00 H ATOM 719 H SER A 125 -10.270 38.617 -15.084 1.00 0.00 H ATOM 720 N THR A 126 -7.092 40.942 -15.824 1.00 24.52 N ATOM 721 CA THR A 126 -5.807 40.647 -16.424 1.00 25.86 C ATOM 722 C THR A 126 -4.873 40.001 -15.403 1.00 26.06 C ATOM 723 O THR A 126 -5.104 40.080 -14.191 1.00 24.38 O ATOM 724 CB THR A 126 -5.177 41.929 -16.943 1.00 26.07 C ATOM 725 OG1 THR A 126 -4.784 42.731 -15.818 1.00 26.56 O ATOM 726 CG2 THR A 126 -6.174 42.701 -17.809 1.00 23.66 C ATOM 727 HG1 THR A 126 -4.371 43.571 -16.141 1.00 0.00 H ATOM 728 H THR A 126 -7.296 41.920 -15.537 1.00 0.00 H ATOM 729 N PRO A 127 -3.803 39.355 -15.864 1.00 25.40 N ATOM 730 CA PRO A 127 -2.778 38.912 -14.909 1.00 25.18 C ATOM 731 C PRO A 127 -2.196 40.062 -14.089 1.00 27.13 C ATOM 732 O PRO A 127 -1.918 39.894 -12.891 1.00 26.31 O ATOM 733 CB PRO A 127 -1.731 38.240 -15.817 1.00 26.00 C ATOM 734 CG PRO A 127 -2.527 37.800 -17.054 1.00 26.59 C ATOM 735 CD PRO A 127 -3.535 38.889 -17.243 1.00 25.51 C ATOM 736 N LEU A 128 -2.005 41.237 -14.696 1.00 25.03 N ATOM 737 CA LEU A 128 -1.528 42.385 -13.932 1.00 23.47 C ATOM 738 C LEU A 128 -2.506 42.744 -12.818 1.00 28.26 C ATOM 739 O LEU A 128 -2.087 43.039 -11.689 1.00 27.67 O ATOM 740 CB LEU A 128 -1.295 43.584 -14.857 1.00 23.54 C ATOM 741 CG LEU A 128 -0.938 44.905 -14.153 1.00 25.22 C ATOM 742 CD1 LEU A 128 0.390 44.788 -13.415 1.00 25.77 C ATOM 743 CD2 LEU A 128 -0.898 46.078 -15.153 1.00 26.60 C ATOM 744 H LEU A 128 -2.196 41.333 -15.714 1.00 0.00 H ATOM 745 N HIS A 129 -3.812 42.730 -13.113 1.00 26.58 N ATOM 746 CA HIS A 129 -4.807 42.911 -12.058 1.00 26.73 C ATOM 747 C HIS A 129 -4.553 41.960 -10.896 1.00 26.98 C ATOM 748 O HIS A 129 -4.634 42.345 -9.725 1.00 29.30 O ATOM 749 CB HIS A 129 -6.213 42.656 -12.594 1.00 26.42 C ATOM 750 CG HIS A 129 -6.745 43.750 -13.448 1.00 28.50 C ATOM 751 ND1 HIS A 129 -7.642 43.514 -14.466 1.00 27.77 N ATOM 752 CD2 HIS A 129 -6.530 45.087 -13.431 1.00 27.33 C ATOM 753 CE1 HIS A 129 -7.948 44.658 -15.052 1.00 29.01 C ATOM 754 NE2 HIS A 129 -7.288 45.626 -14.442 1.00 30.42 N ATOM 755 H HIS A 129 -4.119 42.590 -14.097 1.00 0.00 H ATOM 756 N TRP A 130 -4.278 40.697 -11.208 1.00 27.53 N ATOM 757 CA TRP A 130 -4.080 39.706 -10.157 1.00 28.65 C ATOM 758 C TRP A 130 -2.867 40.059 -9.307 1.00 27.19 C ATOM 759 O TRP A 130 -2.945 40.092 -8.075 1.00 28.41 O ATOM 760 CB TRP A 130 -3.940 38.308 -10.780 1.00 23.68 C ATOM 761 CG TRP A 130 -5.286 37.670 -11.122 1.00 27.34 C ATOM 762 CD1 TRP A 130 -6.431 38.313 -11.505 1.00 25.11 C ATOM 763 CD2 TRP A 130 -5.610 36.271 -11.077 1.00 28.12 C ATOM 764 NE1 TRP A 130 -7.445 37.399 -11.710 1.00 26.93 N ATOM 765 CE2 TRP A 130 -6.965 36.141 -11.456 1.00 26.66 C ATOM 766 CE3 TRP A 130 -4.882 35.113 -10.761 1.00 26.43 C ATOM 767 CZ2 TRP A 130 -7.601 34.904 -11.533 1.00 28.40 C ATOM 768 CZ3 TRP A 130 -5.518 33.885 -10.836 1.00 26.19 C ATOM 769 CH2 TRP A 130 -6.865 33.789 -11.216 1.00 25.93 C ATOM 770 HE1 TRP A 130 -8.415 37.628 -12.008 1.00 0.00 H ATOM 771 H TRP A 130 -4.204 40.415 -12.206 1.00 0.00 H ATOM 772 N ALA A 131 -1.734 40.333 -9.958 1.00 26.78 N ATOM 773 CA ALA A 131 -0.522 40.691 -9.229 1.00 28.68 C ATOM 774 C ALA A 131 -0.753 41.912 -8.353 1.00 28.73 C ATOM 775 O ALA A 131 -0.189 42.013 -7.256 1.00 25.77 O ATOM 776 CB ALA A 131 0.620 40.960 -10.204 1.00 24.81 C ATOM 777 H ALA A 131 -1.715 40.291 -10.997 1.00 0.00 H ATOM 778 N THR A 132 -1.560 42.863 -8.840 1.00 29.74 N ATOM 779 CA THR A 132 -1.824 44.083 -8.087 1.00 26.64 C ATOM 780 C THR A 132 -2.645 43.781 -6.836 1.00 30.93 C ATOM 781 O THR A 132 -2.296 44.225 -5.738 1.00 33.50 O ATOM 782 CB THR A 132 -2.529 45.107 -8.981 1.00 25.30 C ATOM 783 OG1 THR A 132 -1.747 45.318 -10.173 1.00 27.52 O ATOM 784 CG2 THR A 132 -2.728 46.455 -8.251 1.00 20.60 C ATOM 785 HG1 THR A 132 -1.653 44.461 -10.660 1.00 0.00 H ATOM 786 H THR A 132 -2.006 42.729 -9.770 1.00 0.00 H ATOM 787 N ARG A 133 -3.730 43.006 -6.983 1.00 30.77 N ATOM 788 CA ARG A 133 -4.519 42.575 -5.829 1.00 29.75 C ATOM 789 C ARG A 133 -3.642 41.922 -4.781 1.00 30.08 C ATOM 790 O ARG A 133 -3.798 42.170 -3.580 1.00 26.72 O ATOM 791 CB ARG A 133 -5.604 41.585 -6.262 1.00 26.14 C ATOM 792 CG ARG A 133 -6.815 42.236 -6.855 1.00 26.76 C ATOM 793 CD ARG A 133 -7.828 41.206 -7.339 1.00 26.14 C ATOM 794 NE ARG A 133 -8.993 41.883 -7.900 1.00 30.52 N ATOM 795 CZ ARG A 133 -10.104 42.135 -7.221 1.00 31.13 C ATOM 796 NH1 ARG A 133 -10.201 41.746 -5.947 1.00 32.76 N ATOM 797 NH2 ARG A 133 -11.115 42.772 -7.811 1.00 28.03 N ATOM 798 HE ARG A 133 -8.949 42.187 -8.894 1.00 0.00 H ATOM 799 HH12 ARG A 133 -11.069 41.940 -5.409 1.00 0.00 H ATOM 800 HH11 ARG A 133 -9.408 41.249 -5.493 1.00 0.00 H ATOM 801 HH22 ARG A 133 -11.986 42.970 -7.279 1.00 0.00 H ATOM 802 HH21 ARG A 133 -11.033 43.071 -8.804 1.00 0.00 H ATOM 803 H ARG A 133 -4.016 42.705 -7.937 1.00 0.00 H ATOM 804 N GLN A 134 -2.708 41.084 -5.224 1.00 27.07 N ATOM 805 CA GLN A 134 -1.903 40.298 -4.305 1.00 28.01 C ATOM 806 C GLN A 134 -0.760 41.098 -3.696 1.00 33.93 C ATOM 807 O GLN A 134 -0.266 40.721 -2.623 1.00 29.46 O ATOM 808 CB GLN A 134 -1.367 39.061 -5.023 1.00 27.05 C ATOM 809 CG GLN A 134 -0.789 38.010 -4.122 1.00 30.38 C ATOM 810 CD GLN A 134 -1.797 37.519 -3.105 1.00 35.44 C ATOM 811 OE1 GLN A 134 -2.994 37.413 -3.397 1.00 33.11 O ATOM 812 NE2 GLN A 134 -1.321 37.234 -1.895 1.00 34.79 N ATOM 813 HE22 GLN A 134 -0.305 37.339 -1.698 1.00 0.00 H ATOM 814 HE21 GLN A 134 -1.965 36.906 -1.147 1.00 0.00 H ATOM 815 H GLN A 134 -2.551 40.990 -6.248 1.00 0.00 H ATOM 816 N GLY A 135 -0.343 42.185 -4.341 1.00 29.18 N ATOM 817 CA GLY A 135 0.652 43.069 -3.786 1.00 25.73 C ATOM 818 C GLY A 135 2.080 42.821 -4.214 1.00 26.13 C ATOM 819 O GLY A 135 2.995 43.151 -3.456 1.00 25.58 O ATOM 820 H GLY A 135 -0.747 42.404 -5.274 1.00 0.00 H ATOM 821 N HIS A 136 2.303 42.258 -5.405 1.00 27.01 N ATOM 822 CA HIS A 136 3.635 41.875 -5.868 1.00 25.29 C ATOM 823 C HIS A 136 4.206 43.002 -6.732 1.00 29.02 C ATOM 824 O HIS A 136 4.052 43.011 -7.959 1.00 26.79 O ATOM 825 CB HIS A 136 3.563 40.567 -6.637 1.00 30.58 C ATOM 826 CG HIS A 136 3.282 39.373 -5.784 1.00 27.34 C ATOM 827 ND1 HIS A 136 4.014 39.076 -4.656 1.00 29.33 N ATOM 828 CD2 HIS A 136 2.373 38.378 -5.917 1.00 27.02 C ATOM 829 CE1 HIS A 136 3.553 37.962 -4.116 1.00 25.13 C ATOM 830 NE2 HIS A 136 2.557 37.519 -4.861 1.00 29.70 N ATOM 831 H HIS A 136 1.491 42.084 -6.031 1.00 0.00 H ATOM 832 N LEU A 137 4.899 43.945 -6.086 1.00 25.88 N ATOM 833 CA LEU A 137 5.416 45.106 -6.806 1.00 26.08 C ATOM 834 C LEU A 137 6.345 44.681 -7.939 1.00 26.08 C ATOM 835 O LEU A 137 6.224 45.165 -9.069 1.00 27.09 O ATOM 836 CB LEU A 137 6.136 46.044 -5.842 1.00 25.65 C ATOM 837 CG LEU A 137 6.843 47.235 -6.471 1.00 25.85 C ATOM 838 CD1 LEU A 137 5.902 48.001 -7.403 1.00 27.54 C ATOM 839 CD2 LEU A 137 7.410 48.151 -5.395 1.00 26.12 C ATOM 840 H LEU A 137 5.071 43.851 -5.065 1.00 0.00 H ATOM 841 N SER A 138 7.277 43.768 -7.659 1.00 27.35 N ATOM 842 CA SER A 138 8.191 43.319 -8.708 1.00 30.33 C ATOM 843 C SER A 138 7.428 42.748 -9.893 1.00 26.05 C ATOM 844 O SER A 138 7.824 42.953 -11.044 1.00 29.60 O ATOM 845 CB SER A 138 9.165 42.274 -8.165 1.00 30.49 C ATOM 846 OG SER A 138 8.445 41.114 -7.776 1.00 31.73 O ATOM 847 HG SER A 138 7.791 41.354 -7.073 1.00 0.00 H ATOM 848 H SER A 138 7.353 43.377 -6.698 1.00 0.00 H ATOM 849 N MET A 139 6.318 42.048 -9.628 1.00 23.90 N ATOM 850 CA MET A 139 5.535 41.473 -10.711 1.00 27.79 C ATOM 851 C MET A 139 4.773 42.550 -11.469 1.00 26.72 C ATOM 852 O MET A 139 4.646 42.476 -12.695 1.00 27.68 O ATOM 853 CB MET A 139 4.573 40.407 -10.189 1.00 24.21 C ATOM 854 CG MET A 139 3.751 39.771 -11.323 1.00 30.19 C ATOM 855 SD MET A 139 4.774 38.974 -12.619 1.00 27.12 S ATOM 856 CE MET A 139 5.536 37.678 -11.645 1.00 26.62 C ATOM 857 H MET A 139 6.014 41.915 -8.642 1.00 0.00 H ATOM 858 N VAL A 140 4.257 43.552 -10.754 1.00 25.72 N ATOM 859 CA VAL A 140 3.636 44.699 -11.404 1.00 24.79 C ATOM 860 C VAL A 140 4.638 45.400 -12.302 1.00 29.07 C ATOM 861 O VAL A 140 4.320 45.784 -13.433 1.00 27.35 O ATOM 862 CB VAL A 140 3.076 45.671 -10.354 1.00 25.16 C ATOM 863 CG1 VAL A 140 2.760 47.008 -11.006 1.00 22.34 C ATOM 864 CG2 VAL A 140 1.861 45.053 -9.617 1.00 24.69 C ATOM 865 H VAL A 140 4.299 43.514 -9.716 1.00 0.00 H ATOM 866 N VAL A 141 5.858 45.595 -11.801 1.00 28.97 N ATOM 867 CA VAL A 141 6.906 46.217 -12.601 1.00 29.06 C ATOM 868 C VAL A 141 7.214 45.355 -13.817 1.00 29.02 C ATOM 869 O VAL A 141 7.294 45.844 -14.949 1.00 28.09 O ATOM 870 CB VAL A 141 8.167 46.445 -11.745 1.00 27.12 C ATOM 871 CG1 VAL A 141 9.292 46.960 -12.608 1.00 29.96 C ATOM 872 CG2 VAL A 141 7.877 47.412 -10.590 1.00 28.72 C ATOM 873 H VAL A 141 6.065 45.299 -10.826 1.00 0.00 H ATOM 874 N GLN A 142 7.384 44.053 -13.598 1.00 30.24 N ATOM 875 CA GLN A 142 7.733 43.163 -14.694 1.00 30.28 C ATOM 876 C GLN A 142 6.632 43.129 -15.751 1.00 29.89 C ATOM 877 O GLN A 142 6.910 43.295 -16.946 1.00 30.97 O ATOM 878 CB GLN A 142 8.034 41.770 -14.150 1.00 29.46 C ATOM 879 CG GLN A 142 8.484 40.770 -15.194 1.00 36.69 C ATOM 880 CD GLN A 142 9.983 40.842 -15.433 1.00 47.60 C ATOM 881 OE1 GLN A 142 10.522 40.112 -16.262 1.00 56.42 O ATOM 882 NE2 GLN A 142 10.664 41.741 -14.712 1.00 45.38 N ATOM 883 HE22 GLN A 142 10.166 42.338 -14.021 1.00 0.00 H ATOM 884 HE21 GLN A 142 11.691 41.842 -14.843 1.00 0.00 H ATOM 885 H GLN A 142 7.267 43.670 -12.638 1.00 0.00 H ATOM 886 N LEU A 143 5.370 42.978 -15.339 1.00 28.42 N ATOM 887 CA LEU A 143 4.290 42.897 -16.326 1.00 26.58 C ATOM 888 C LEU A 143 4.106 44.216 -17.060 1.00 28.30 C ATOM 889 O LEU A 143 3.785 44.228 -18.251 1.00 26.89 O ATOM 890 CB LEU A 143 2.982 42.481 -15.660 1.00 27.58 C ATOM 891 CG LEU A 143 2.882 40.994 -15.316 1.00 30.06 C ATOM 892 CD1 LEU A 143 1.617 40.736 -14.514 1.00 19.84 C ATOM 893 CD2 LEU A 143 2.963 40.088 -16.582 1.00 20.09 C ATOM 894 H LEU A 143 5.155 42.918 -14.323 1.00 0.00 H ATOM 895 N MET A 144 4.287 45.343 -16.379 1.00 28.26 N ATOM 896 CA MET A 144 4.138 46.598 -17.104 1.00 31.97 C ATOM 897 C MET A 144 5.252 46.780 -18.129 1.00 30.13 C ATOM 898 O MET A 144 5.031 47.407 -19.169 1.00 31.17 O ATOM 899 CB MET A 144 4.063 47.767 -16.122 1.00 27.31 C ATOM 900 CG MET A 144 2.661 47.880 -15.518 1.00 24.62 C ATOM 901 SD MET A 144 2.440 49.232 -14.370 1.00 29.24 S ATOM 902 CE MET A 144 2.923 50.634 -15.375 1.00 28.11 C ATOM 903 H MET A 144 4.526 45.330 -15.367 1.00 0.00 H ATOM 904 N LYS A 145 6.429 46.195 -17.882 1.00 32.29 N ATOM 905 CA LYS A 145 7.521 46.266 -18.855 1.00 32.47 C ATOM 906 C LYS A 145 7.208 45.505 -20.141 1.00 34.50 C ATOM 907 O LYS A 145 7.721 45.859 -21.206 1.00 33.97 O ATOM 908 CB LYS A 145 8.806 45.717 -18.244 1.00 34.60 C ATOM 909 CG LYS A 145 9.670 46.761 -17.573 1.00 38.43 C ATOM 910 CD LYS A 145 10.599 46.101 -16.557 1.00 41.02 C ATOM 911 CE LYS A 145 11.604 47.076 -15.965 1.00 38.83 C ATOM 912 NZ LYS A 145 12.401 46.349 -14.934 1.00 44.59 N ATOM 913 HZ1 LYS A 145 11.764 45.994 -14.192 1.00 0.00 H ATOM 914 HZ2 LYS A 145 12.895 45.550 -15.380 1.00 0.00 H ATOM 915 HZ3 LYS A 145 13.097 46.998 -14.514 1.00 0.00 H ATOM 916 H LYS A 145 6.570 45.683 -16.988 1.00 0.00 H ATOM 917 N TYR A 146 6.396 44.455 -20.071 1.00 32.33 N ATOM 918 CA TYR A 146 5.993 43.729 -21.262 1.00 32.88 C ATOM 919 C TYR A 146 4.735 44.309 -21.898 1.00 32.56 C ATOM 920 O TYR A 146 4.146 43.665 -22.775 1.00 36.93 O ATOM 921 CB TYR A 146 5.772 42.249 -20.937 1.00 34.08 C ATOM 922 CG TYR A 146 7.038 41.439 -20.718 1.00 37.11 C ATOM 923 CD1 TYR A 146 7.843 41.055 -21.783 1.00 38.48 C ATOM 924 CD2 TYR A 146 7.408 41.029 -19.450 1.00 36.21 C ATOM 925 CE1 TYR A 146 8.997 40.291 -21.584 1.00 37.35 C ATOM 926 CE2 TYR A 146 8.561 40.273 -19.244 1.00 43.17 C ATOM 927 CZ TYR A 146 9.348 39.904 -20.317 1.00 39.47 C ATOM 928 OH TYR A 146 10.492 39.161 -20.102 1.00 43.16 O ATOM 929 HH TYR A 146 10.936 38.983 -20.969 1.00 0.00 H ATOM 930 H TYR A 146 6.042 44.147 -19.143 1.00 0.00 H ATOM 931 N GLY A 147 4.306 45.493 -21.474 1.00 29.38 N ATOM 932 CA GLY A 147 3.182 46.166 -22.098 1.00 29.92 C ATOM 933 C GLY A 147 1.842 46.020 -21.409 1.00 29.54 C ATOM 934 O GLY A 147 0.840 46.497 -21.950 1.00 33.34 O ATOM 935 H GLY A 147 4.789 45.949 -20.674 1.00 0.00 H ATOM 936 N ALA A 148 1.785 45.394 -20.234 1.00 32.27 N ATOM 937 CA ALA A 148 0.515 45.280 -19.518 1.00 29.97 C ATOM 938 C ALA A 148 -0.033 46.667 -19.191 1.00 27.58 C ATOM 939 O ALA A 148 0.705 47.560 -18.764 1.00 26.75 O ATOM 940 CB ALA A 148 0.689 44.455 -18.242 1.00 23.88 C ATOM 941 H ALA A 148 2.648 44.984 -19.824 1.00 0.00 H ATOM 942 N ASP A 149 -1.338 46.842 -19.404 1.00 25.43 N ATOM 943 CA ASP A 149 -1.973 48.148 -19.315 1.00 25.15 C ATOM 944 C ASP A 149 -2.605 48.334 -17.942 1.00 27.39 C ATOM 945 O ASP A 149 -3.682 47.769 -17.692 1.00 27.06 O ATOM 946 CB ASP A 149 -3.027 48.270 -20.406 1.00 28.08 C ATOM 947 CG ASP A 149 -3.741 49.616 -20.417 1.00 29.16 C ATOM 948 OD1 ASP A 149 -3.614 50.446 -19.470 1.00 25.25 O ATOM 949 OD2 ASP A 149 -4.451 49.832 -21.418 1.00 29.24 O ATOM 950 H ASP A 149 -1.922 46.015 -19.642 1.00 0.00 H ATOM 951 N PRO A 150 -2.021 49.146 -17.052 1.00 24.88 N ATOM 952 CA PRO A 150 -2.574 49.280 -15.686 1.00 26.69 C ATOM 953 C PRO A 150 -3.925 49.987 -15.628 1.00 25.00 C ATOM 954 O PRO A 150 -4.584 49.951 -14.580 1.00 26.72 O ATOM 955 CB PRO A 150 -1.493 50.087 -14.951 1.00 26.44 C ATOM 956 CG PRO A 150 -0.869 50.930 -16.024 1.00 27.99 C ATOM 957 CD PRO A 150 -0.885 50.054 -17.285 1.00 28.09 C ATOM 958 N SER A 151 -4.349 50.622 -16.715 1.00 27.77 N ATOM 959 CA SER A 151 -5.618 51.327 -16.794 1.00 27.24 C ATOM 960 C SER A 151 -6.776 50.420 -17.185 1.00 28.15 C ATOM 961 O SER A 151 -7.934 50.848 -17.104 1.00 27.85 O ATOM 962 CB SER A 151 -5.511 52.482 -17.800 1.00 29.12 C ATOM 963 OG SER A 151 -4.610 53.491 -17.360 1.00 28.88 O ATOM 964 HG SER A 151 -4.926 53.860 -16.497 1.00 0.00 H ATOM 965 H SER A 151 -3.739 50.614 -17.557 1.00 0.00 H ATOM 966 N LEU A 152 -6.509 49.185 -17.604 1.00 25.86 N ATOM 967 CA LEU A 152 -7.617 48.288 -17.902 1.00 28.04 C ATOM 968 C LEU A 152 -8.458 48.104 -16.643 1.00 30.40 C ATOM 969 O LEU A 152 -7.957 48.177 -15.518 1.00 26.05 O ATOM 970 CB LEU A 152 -7.090 46.950 -18.430 1.00 26.19 C ATOM 971 CG LEU A 152 -6.419 47.053 -19.817 1.00 27.52 C ATOM 972 CD1 LEU A 152 -5.760 45.743 -20.210 1.00 27.05 C ATOM 973 CD2 LEU A 152 -7.423 47.488 -20.889 1.00 23.75 C ATOM 974 H LEU A 152 -5.526 48.866 -17.717 1.00 0.00 H ATOM 975 N ILE A 153 -9.759 47.922 -16.826 1.00 29.86 N ATOM 976 CA ILE A 153 -10.676 47.779 -15.702 1.00 30.57 C ATOM 977 C ILE A 153 -11.116 46.327 -15.639 1.00 31.32 C ATOM 978 O ILE A 153 -11.252 45.675 -16.682 1.00 31.64 O ATOM 979 CB ILE A 153 -11.886 48.727 -15.822 1.00 32.42 C ATOM 980 CG1 ILE A 153 -12.701 48.404 -17.068 1.00 30.44 C ATOM 981 CG2 ILE A 153 -11.414 50.173 -15.885 1.00 30.13 C ATOM 982 CD1 ILE A 153 -13.897 49.310 -17.235 1.00 37.50 C ATOM 983 H ILE A 153 -10.134 47.880 -17.795 1.00 0.00 H ATOM 984 N ASP A 154 -11.303 45.810 -14.413 1.00 29.56 N ATOM 985 CA ASP A 154 -11.779 44.448 -14.203 1.00 27.71 C ATOM 986 C ASP A 154 -13.299 44.426 -14.062 1.00 29.14 C ATOM 987 O ASP A 154 -13.977 45.450 -14.161 1.00 28.35 O ATOM 988 CB ASP A 154 -11.112 43.798 -12.983 1.00 29.85 C ATOM 989 CG ASP A 154 -11.504 44.461 -11.630 1.00 31.82 C ATOM 990 OD1 ASP A 154 -12.419 45.316 -11.579 1.00 30.20 O ATOM 991 OD2 ASP A 154 -10.854 44.132 -10.606 1.00 28.36 O ATOM 992 H ASP A 154 -11.101 46.403 -13.583 1.00 0.00 H ATOM 993 N GLY A 155 -13.833 43.235 -13.788 1.00 30.18 N ATOM 994 CA GLY A 155 -15.266 43.046 -13.674 1.00 31.20 C ATOM 995 C GLY A 155 -15.912 43.772 -12.515 1.00 35.24 C ATOM 996 O GLY A 155 -17.144 43.854 -12.474 1.00 37.13 O ATOM 997 H GLY A 155 -13.203 42.418 -13.652 1.00 0.00 H ATOM 998 N GLU A 156 -15.128 44.286 -11.571 1.00 29.79 N ATOM 999 CA GLU A 156 -15.671 45.103 -10.499 1.00 28.12 C ATOM 1000 C GLU A 156 -15.570 46.587 -10.818 1.00 31.65 C ATOM 1001 O GLU A 156 -15.859 47.414 -9.955 1.00 39.07 O ATOM 1002 CB GLU A 156 -14.968 44.780 -9.171 1.00 28.57 C ATOM 1003 CG GLU A 156 -14.989 43.291 -8.834 1.00 28.58 C ATOM 1004 CD GLU A 156 -14.825 42.986 -7.357 1.00 32.91 C ATOM 1005 OE1 GLU A 156 -13.812 43.426 -6.776 1.00 33.19 O ATOM 1006 OE2 GLU A 156 -15.708 42.304 -6.780 1.00 33.22 O ATOM 1007 H GLU A 156 -14.105 44.099 -11.601 1.00 0.00 H ATOM 1008 N GLY A 157 -15.159 46.943 -12.037 1.00 32.55 N ATOM 1009 CA GLY A 157 -15.012 48.335 -12.413 1.00 31.29 C ATOM 1010 C GLY A 157 -13.701 48.995 -12.038 1.00 28.02 C ATOM 1011 O GLY A 157 -13.554 50.199 -12.272 1.00 30.70 O ATOM 1012 H GLY A 157 -14.939 46.203 -12.734 1.00 0.00 H ATOM 1013 N CYS A 158 -12.737 48.254 -11.490 1.00 25.15 N ATOM 1014 CA CYS A 158 -11.520 48.843 -10.942 1.00 28.41 C ATOM 1015 C CYS A 158 -10.342 48.671 -11.887 1.00 27.54 C ATOM 1016 O CYS A 158 -10.157 47.599 -12.470 1.00 29.52 O ATOM 1017 CB CYS A 158 -11.159 48.203 -9.601 1.00 31.00 C ATOM 1018 SG CYS A 158 -12.406 48.424 -8.350 1.00 31.31 S ATOM 1019 H CYS A 158 -12.857 47.222 -11.452 1.00 0.00 H ATOM 1020 N SER A 159 -9.525 49.715 -12.009 1.00 24.24 N ATOM 1021 CA SER A 159 -8.237 49.559 -12.659 1.00 27.32 C ATOM 1022 C SER A 159 -7.178 49.364 -11.574 1.00 28.86 C ATOM 1023 O SER A 159 -7.502 49.225 -10.387 1.00 26.79 O ATOM 1024 CB SER A 159 -7.952 50.728 -13.603 1.00 26.11 C ATOM 1025 OG SER A 159 -7.637 51.908 -12.917 1.00 29.60 O ATOM 1026 HG SER A 159 -6.831 51.760 -12.362 1.00 0.00 H ATOM 1027 H SER A 159 -9.810 50.644 -11.638 1.00 0.00 H ATOM 1028 N CYS A 160 -5.900 49.323 -11.978 1.00 28.23 N ATOM 1029 CA CYS A 160 -4.849 48.841 -11.080 1.00 26.06 C ATOM 1030 C CYS A 160 -4.663 49.765 -9.876 1.00 28.05 C ATOM 1031 O CYS A 160 -4.492 49.297 -8.740 1.00 27.74 O ATOM 1032 CB CYS A 160 -3.535 48.696 -11.843 1.00 25.72 C ATOM 1033 SG CYS A 160 -3.382 47.146 -12.781 1.00 33.92 S ATOM 1034 H CYS A 160 -5.653 49.637 -12.938 1.00 0.00 H ATOM 1035 N ILE A 161 -4.699 51.077 -10.098 1.00 26.61 N ATOM 1036 CA ILE A 161 -4.453 51.978 -8.988 1.00 27.56 C ATOM 1037 C ILE A 161 -5.524 51.802 -7.924 1.00 28.17 C ATOM 1038 O ILE A 161 -5.219 51.857 -6.730 1.00 29.61 O ATOM 1039 CB ILE A 161 -4.328 53.435 -9.482 1.00 25.18 C ATOM 1040 CG1 ILE A 161 -3.745 54.310 -8.370 1.00 27.74 C ATOM 1041 CG2 ILE A 161 -5.662 53.980 -9.972 1.00 27.05 C ATOM 1042 CD1 ILE A 161 -3.307 55.680 -8.842 1.00 26.15 C ATOM 1043 H ILE A 161 -4.900 51.449 -11.048 1.00 0.00 H ATOM 1044 N HIS A 162 -6.775 51.517 -8.324 1.00 26.69 N ATOM 1045 CA HIS A 162 -7.829 51.301 -7.337 1.00 24.42 C ATOM 1046 C HIS A 162 -7.644 49.984 -6.605 1.00 27.31 C ATOM 1047 O HIS A 162 -7.867 49.911 -5.391 1.00 26.93 O ATOM 1048 CB HIS A 162 -9.197 51.351 -8.005 1.00 26.46 C ATOM 1049 CG HIS A 162 -9.367 52.539 -8.887 1.00 31.10 C ATOM 1050 ND1 HIS A 162 -9.256 52.464 -10.258 1.00 29.86 N ATOM 1051 CD2 HIS A 162 -9.581 53.845 -8.591 1.00 26.95 C ATOM 1052 CE1 HIS A 162 -9.418 53.674 -10.772 1.00 32.43 C ATOM 1053 NE2 HIS A 162 -9.622 54.527 -9.783 1.00 35.33 N ATOM 1054 H HIS A 162 -6.993 51.450 -9.339 1.00 0.00 H ATOM 1055 N LEU A 163 -7.262 48.927 -7.328 1.00 25.90 N ATOM 1056 CA LEU A 163 -6.961 47.656 -6.676 1.00 27.49 C ATOM 1057 C LEU A 163 -5.837 47.817 -5.655 1.00 29.09 C ATOM 1058 O LEU A 163 -5.926 47.309 -4.531 1.00 28.43 O ATOM 1059 CB LEU A 163 -6.587 46.612 -7.726 1.00 25.50 C ATOM 1060 CG LEU A 163 -7.712 46.240 -8.707 1.00 26.17 C ATOM 1061 CD1 LEU A 163 -7.202 45.323 -9.801 1.00 21.37 C ATOM 1062 CD2 LEU A 163 -8.856 45.595 -7.957 1.00 25.45 C ATOM 1063 H LEU A 163 -7.179 49.010 -8.361 1.00 0.00 H ATOM 1064 N ALA A 164 -4.772 48.531 -6.025 1.00 29.02 N ATOM 1065 CA ALA A 164 -3.673 48.723 -5.087 1.00 27.01 C ATOM 1066 C ALA A 164 -4.127 49.540 -3.877 1.00 26.70 C ATOM 1067 O ALA A 164 -3.800 49.207 -2.737 1.00 28.65 O ATOM 1068 CB ALA A 164 -2.498 49.384 -5.805 1.00 22.71 C ATOM 1069 H ALA A 164 -4.726 48.948 -6.977 1.00 0.00 H ATOM 1070 N ALA A 165 -4.936 50.574 -4.113 1.00 28.04 N ATOM 1071 CA ALA A 165 -5.465 51.404 -3.033 1.00 27.11 C ATOM 1072 C ALA A 165 -6.329 50.600 -2.069 1.00 30.99 C ATOM 1073 O ALA A 165 -6.176 50.699 -0.842 1.00 28.30 O ATOM 1074 CB ALA A 165 -6.276 52.559 -3.624 1.00 23.67 C ATOM 1075 H ALA A 165 -5.198 50.796 -5.095 1.00 0.00 H ATOM 1076 N GLN A 166 -7.268 49.820 -2.599 1.00 27.57 N ATOM 1077 CA GLN A 166 -8.215 49.169 -1.712 1.00 26.87 C ATOM 1078 C GLN A 166 -7.607 47.997 -0.961 1.00 29.08 C ATOM 1079 O GLN A 166 -8.164 47.589 0.063 1.00 27.86 O ATOM 1080 CB GLN A 166 -9.453 48.721 -2.492 1.00 28.85 C ATOM 1081 CG GLN A 166 -9.298 47.457 -3.277 1.00 28.37 C ATOM 1082 CD GLN A 166 -10.475 47.241 -4.220 1.00 31.48 C ATOM 1083 OE1 GLN A 166 -11.191 46.245 -4.116 1.00 32.41 O ATOM 1084 NE2 GLN A 166 -10.698 48.194 -5.125 1.00 30.49 N ATOM 1085 HE22 GLN A 166 -10.067 49.019 -5.178 1.00 0.00 H ATOM 1086 HE21 GLN A 166 -11.503 48.112 -5.778 1.00 0.00 H ATOM 1087 H GLN A 166 -7.322 49.680 -3.628 1.00 0.00 H ATOM 1088 N PHE A 167 -6.477 47.455 -1.416 1.00 25.05 N ATOM 1089 CA PHE A 167 -5.816 46.403 -0.655 1.00 29.85 C ATOM 1090 C PHE A 167 -4.588 46.902 0.119 1.00 30.52 C ATOM 1091 O PHE A 167 -3.798 46.087 0.611 1.00 25.75 O ATOM 1092 CB PHE A 167 -5.459 45.231 -1.576 1.00 27.84 C ATOM 1093 CG PHE A 167 -6.664 44.423 -1.999 1.00 28.00 C ATOM 1094 CD1 PHE A 167 -7.368 43.671 -1.067 1.00 31.51 C ATOM 1095 CD2 PHE A 167 -7.124 44.464 -3.314 1.00 30.76 C ATOM 1096 CE1 PHE A 167 -8.488 42.949 -1.430 1.00 31.45 C ATOM 1097 CE2 PHE A 167 -8.243 43.739 -3.700 1.00 31.49 C ATOM 1098 CZ PHE A 167 -8.927 42.976 -2.755 1.00 34.73 C ATOM 1099 H PHE A 167 -6.067 47.783 -2.314 1.00 0.00 H ATOM 1100 N GLY A 168 -4.407 48.217 0.235 1.00 28.46 N ATOM 1101 CA GLY A 168 -3.385 48.715 1.139 1.00 28.36 C ATOM 1102 C GLY A 168 -1.967 48.594 0.635 1.00 30.72 C ATOM 1103 O GLY A 168 -1.027 48.692 1.433 1.00 28.30 O ATOM 1104 H GLY A 168 -4.991 48.879 -0.315 1.00 0.00 H ATOM 1105 N HIS A 169 -1.785 48.388 -0.674 1.00 30.93 N ATOM 1106 CA HIS A 169 -0.463 48.133 -1.253 1.00 29.54 C ATOM 1107 C HIS A 169 0.193 49.471 -1.593 1.00 30.01 C ATOM 1108 O HIS A 169 0.234 49.916 -2.744 1.00 26.90 O ATOM 1109 CB HIS A 169 -0.591 47.212 -2.461 1.00 29.22 C ATOM 1110 CG HIS A 169 -1.139 45.861 -2.113 1.00 29.14 C ATOM 1111 ND1 HIS A 169 -0.777 45.191 -0.964 1.00 25.59 N ATOM 1112 CD2 HIS A 169 -2.044 45.071 -2.741 1.00 26.96 C ATOM 1113 CE1 HIS A 169 -1.416 44.035 -0.911 1.00 29.04 C ATOM 1114 NE2 HIS A 169 -2.196 43.940 -1.974 1.00 29.06 N ATOM 1115 H HIS A 169 -2.612 48.410 -1.304 1.00 0.00 H ATOM 1116 N THR A 170 0.731 50.113 -0.546 1.00 27.47 N ATOM 1117 CA THR A 170 1.187 51.497 -0.656 1.00 27.18 C ATOM 1118 C THR A 170 2.285 51.669 -1.708 1.00 26.66 C ATOM 1119 O THR A 170 2.289 52.656 -2.455 1.00 25.18 O ATOM 1120 CB THR A 170 1.654 51.975 0.715 1.00 25.61 C ATOM 1121 OG1 THR A 170 0.564 51.837 1.631 1.00 28.74 O ATOM 1122 CG2 THR A 170 2.081 53.436 0.677 1.00 26.28 C ATOM 1123 HG1 THR A 170 0.291 50.887 1.676 1.00 0.00 H ATOM 1124 H THR A 170 0.826 49.616 0.363 1.00 0.00 H ATOM 1125 N SER A 171 3.222 50.719 -1.797 1.00 26.97 N ATOM 1126 CA SER A 171 4.323 50.914 -2.737 1.00 25.48 C ATOM 1127 C SER A 171 3.858 50.771 -4.179 1.00 27.04 C ATOM 1128 O SER A 171 4.398 51.441 -5.069 1.00 27.10 O ATOM 1129 CB SER A 171 5.473 49.948 -2.444 1.00 24.67 C ATOM 1130 OG SER A 171 5.091 48.610 -2.626 1.00 24.25 O ATOM 1131 HG SER A 171 4.342 48.396 -2.015 1.00 0.00 H ATOM 1132 H SER A 171 3.168 49.862 -1.211 1.00 0.00 H ATOM 1133 N ILE A 172 2.852 49.932 -4.432 1.00 23.74 N ATOM 1134 CA ILE A 172 2.343 49.828 -5.792 1.00 25.79 C ATOM 1135 C ILE A 172 1.572 51.086 -6.165 1.00 28.37 C ATOM 1136 O ILE A 172 1.616 51.534 -7.316 1.00 27.48 O ATOM 1137 CB ILE A 172 1.482 48.568 -5.952 1.00 26.99 C ATOM 1138 CG1 ILE A 172 2.311 47.315 -5.653 1.00 24.78 C ATOM 1139 CG2 ILE A 172 0.863 48.517 -7.368 1.00 22.52 C ATOM 1140 CD1 ILE A 172 1.495 46.069 -5.708 1.00 25.65 C ATOM 1141 H ILE A 172 2.437 49.360 -3.669 1.00 0.00 H ATOM 1142 N VAL A 173 0.840 51.666 -5.203 1.00 28.54 N ATOM 1143 CA VAL A 173 0.169 52.940 -5.448 1.00 26.23 C ATOM 1144 C VAL A 173 1.199 54.004 -5.811 1.00 27.90 C ATOM 1145 O VAL A 173 1.054 54.727 -6.809 1.00 28.20 O ATOM 1146 CB VAL A 173 -0.668 53.353 -4.223 1.00 26.14 C ATOM 1147 CG1 VAL A 173 -1.167 54.782 -4.378 1.00 26.31 C ATOM 1148 CG2 VAL A 173 -1.842 52.392 -4.020 1.00 24.82 C ATOM 1149 H VAL A 173 0.749 51.205 -4.275 1.00 0.00 H ATOM 1150 N ALA A 174 2.274 54.090 -5.023 1.00 25.49 N ATOM 1151 CA ALA A 174 3.347 55.030 -5.338 1.00 26.50 C ATOM 1152 C ALA A 174 3.915 54.762 -6.721 1.00 28.42 C ATOM 1153 O ALA A 174 4.203 55.698 -7.469 1.00 27.69 O ATOM 1154 CB ALA A 174 4.460 54.952 -4.292 1.00 25.28 C ATOM 1155 H ALA A 174 2.348 53.485 -4.181 1.00 0.00 H ATOM 1156 N TYR A 175 4.077 53.489 -7.081 1.00 26.86 N ATOM 1157 CA TYR A 175 4.729 53.176 -8.344 1.00 28.82 C ATOM 1158 C TYR A 175 3.852 53.554 -9.526 1.00 30.15 C ATOM 1159 O TYR A 175 4.343 54.102 -10.516 1.00 28.15 O ATOM 1160 CB TYR A 175 5.074 51.697 -8.411 1.00 27.59 C ATOM 1161 CG TYR A 175 5.675 51.306 -9.740 1.00 31.28 C ATOM 1162 CD1 TYR A 175 6.990 51.601 -10.029 1.00 32.33 C ATOM 1163 CD2 TYR A 175 4.926 50.638 -10.702 1.00 29.88 C ATOM 1164 CE1 TYR A 175 7.550 51.239 -11.231 1.00 32.94 C ATOM 1165 CE2 TYR A 175 5.477 50.273 -11.916 1.00 29.52 C ATOM 1166 CZ TYR A 175 6.790 50.578 -12.178 1.00 31.03 C ATOM 1167 OH TYR A 175 7.372 50.226 -13.385 1.00 29.02 O ATOM 1168 HH TYR A 175 8.316 50.525 -13.395 1.00 0.00 H ATOM 1169 H TYR A 175 3.739 52.724 -6.463 1.00 0.00 H ATOM 1170 N LEU A 176 2.554 53.245 -9.443 1.00 28.64 N ATOM 1171 CA LEU A 176 1.641 53.580 -10.528 1.00 26.93 C ATOM 1172 C LEU A 176 1.560 55.083 -10.710 1.00 32.65 C ATOM 1173 O LEU A 176 1.502 55.577 -11.843 1.00 34.03 O ATOM 1174 CB LEU A 176 0.254 53.000 -10.251 1.00 23.65 C ATOM 1175 CG LEU A 176 0.171 51.479 -10.283 1.00 25.76 C ATOM 1176 CD1 LEU A 176 -1.187 50.988 -9.792 1.00 24.06 C ATOM 1177 CD2 LEU A 176 0.477 50.952 -11.670 1.00 25.94 C ATOM 1178 H LEU A 176 2.193 52.761 -8.596 1.00 0.00 H ATOM 1179 N ILE A 177 1.580 55.832 -9.604 1.00 28.96 N ATOM 1180 CA ILE A 177 1.598 57.286 -9.708 1.00 31.96 C ATOM 1181 C ILE A 177 2.899 57.750 -10.356 1.00 30.96 C ATOM 1182 O ILE A 177 2.896 58.638 -11.218 1.00 33.02 O ATOM 1183 CB ILE A 177 1.362 57.931 -8.323 1.00 31.37 C ATOM 1184 CG1 ILE A 177 -0.108 57.772 -7.907 1.00 24.79 C ATOM 1185 CG2 ILE A 177 1.731 59.406 -8.345 1.00 25.22 C ATOM 1186 CD1 ILE A 177 -0.388 58.127 -6.436 1.00 28.34 C ATOM 1187 H ILE A 177 1.583 55.378 -8.668 1.00 0.00 H ATOM 1188 N ALA A 178 4.019 57.112 -10.003 1.00 30.27 N ATOM 1189 CA ALA A 178 5.313 57.460 -10.594 1.00 29.72 C ATOM 1190 C ALA A 178 5.406 57.101 -12.071 1.00 37.07 C ATOM 1191 O ALA A 178 6.257 57.654 -12.781 1.00 40.87 O ATOM 1192 CB ALA A 178 6.445 56.763 -9.843 1.00 29.55 C ATOM 1193 H ALA A 178 3.971 56.353 -9.294 1.00 0.00 H ATOM 1194 N LYS A 179 4.576 56.178 -12.547 1.00 35.61 N ATOM 1195 CA LYS A 179 4.581 55.790 -13.946 1.00 33.76 C ATOM 1196 C LYS A 179 3.540 56.535 -14.774 1.00 35.00 C ATOM 1197 O LYS A 179 3.374 56.233 -15.961 1.00 40.00 O ATOM 1198 CB LYS A 179 4.364 54.284 -14.065 1.00 33.32 C ATOM 1199 CG LYS A 179 5.549 53.470 -13.596 1.00 34.45 C ATOM 1200 CD LYS A 179 6.850 53.928 -14.271 1.00 36.52 C ATOM 1201 CE LYS A 179 7.882 54.417 -13.239 1.00 34.64 C ATOM 1202 NZ LYS A 179 9.279 54.078 -13.651 1.00 38.12 N ATOM 1203 HZ1 LYS A 179 9.371 53.046 -13.744 1.00 0.00 H ATOM 1204 HZ2 LYS A 179 9.489 54.529 -14.564 1.00 0.00 H ATOM 1205 HZ3 LYS A 179 9.945 54.424 -12.931 1.00 0.00 H ATOM 1206 H LYS A 179 3.904 55.721 -11.899 1.00 0.00 H ATOM 1207 N GLY A 180 2.836 57.493 -14.186 1.00 38.70 N ATOM 1208 CA GLY A 180 1.917 58.336 -14.928 1.00 36.68 C ATOM 1209 C GLY A 180 0.451 58.191 -14.574 1.00 38.78 C ATOM 1210 O GLY A 180 -0.368 58.951 -15.115 1.00 42.21 O ATOM 1211 H GLY A 180 2.946 57.644 -13.163 1.00 0.00 H ATOM 1212 N GLN A 181 0.047 57.247 -13.723 1.00 37.01 N ATOM 1213 CA GLN A 181 -1.367 57.146 -13.374 1.00 36.89 C ATOM 1214 C GLN A 181 -1.758 58.359 -12.536 1.00 36.24 C ATOM 1215 O GLN A 181 -1.003 58.780 -11.655 1.00 35.92 O ATOM 1216 CB GLN A 181 -1.665 55.839 -12.623 1.00 36.91 C ATOM 1217 CG GLN A 181 -1.392 54.528 -13.416 1.00 33.92 C ATOM 1218 CD GLN A 181 -2.232 54.389 -14.689 1.00 37.91 C ATOM 1219 OE1 GLN A 181 -3.388 53.962 -14.642 1.00 41.29 O ATOM 1220 NE2 GLN A 181 -1.652 54.758 -15.834 1.00 37.01 N ATOM 1221 HE22 GLN A 181 -0.675 55.113 -15.831 1.00 0.00 H ATOM 1222 HE21 GLN A 181 -2.178 54.690 -16.729 1.00 0.00 H ATOM 1223 H GLN A 181 0.736 56.586 -13.310 1.00 0.00 H ATOM 1224 N ASP A 182 -2.912 58.951 -12.839 1.00 35.01 N ATOM 1225 CA ASP A 182 -3.351 60.132 -12.103 1.00 35.31 C ATOM 1226 C ASP A 182 -3.826 59.738 -10.704 1.00 33.56 C ATOM 1227 O ASP A 182 -4.599 58.786 -10.538 1.00 31.26 O ATOM 1228 CB ASP A 182 -4.465 60.861 -12.861 1.00 35.39 C ATOM 1229 CG ASP A 182 -4.932 62.124 -12.133 1.00 39.54 C ATOM 1230 OD1 ASP A 182 -4.141 63.095 -12.049 1.00 35.06 O ATOM 1231 OD2 ASP A 182 -6.083 62.135 -11.634 1.00 38.08 O ATOM 1232 H ASP A 182 -3.504 58.569 -13.605 1.00 0.00 H ATOM 1233 N VAL A 183 -3.366 60.478 -9.690 1.00 30.87 N ATOM 1234 CA VAL A 183 -3.691 60.124 -8.313 1.00 30.78 C ATOM 1235 C VAL A 183 -5.197 60.128 -8.073 1.00 31.42 C ATOM 1236 O VAL A 183 -5.699 59.376 -7.229 1.00 35.50 O ATOM 1237 CB VAL A 183 -2.958 61.064 -7.340 1.00 31.23 C ATOM 1238 CG1 VAL A 183 -3.379 62.513 -7.580 1.00 35.17 C ATOM 1239 CG2 VAL A 183 -3.204 60.629 -5.884 1.00 32.42 C ATOM 1240 H VAL A 183 -2.773 61.310 -9.884 1.00 0.00 H ATOM 1241 N ASP A 184 -5.947 60.941 -8.810 1.00 30.91 N ATOM 1242 CA ASP A 184 -7.395 60.994 -8.643 1.00 34.53 C ATOM 1243 C ASP A 184 -8.157 60.261 -9.748 1.00 36.06 C ATOM 1244 O ASP A 184 -9.360 60.491 -9.907 1.00 35.45 O ATOM 1245 CB ASP A 184 -7.867 62.444 -8.560 1.00 35.80 C ATOM 1246 CG ASP A 184 -7.814 62.994 -7.133 1.00 41.08 C ATOM 1247 OD1 ASP A 184 -7.887 62.192 -6.166 1.00 40.40 O ATOM 1248 OD2 ASP A 184 -7.687 64.229 -6.986 1.00 40.08 O ATOM 1249 H ASP A 184 -5.493 61.551 -9.519 1.00 0.00 H ATOM 1250 N MET A 185 -7.491 59.379 -10.496 1.00 32.87 N ATOM 1251 CA MET A 185 -8.167 58.545 -11.489 1.00 35.14 C ATOM 1252 C MET A 185 -9.454 57.960 -10.922 1.00 34.50 C ATOM 1253 O MET A 185 -9.464 57.374 -9.834 1.00 34.07 O ATOM 1254 CB MET A 185 -7.238 57.417 -11.938 1.00 34.18 C ATOM 1255 CG MET A 185 -7.464 56.881 -13.344 1.00 34.90 C ATOM 1256 SD MET A 185 -5.947 56.063 -13.900 1.00 47.91 S ATOM 1257 CE MET A 185 -6.510 55.151 -15.353 1.00 37.61 C ATOM 1258 H MET A 185 -6.463 59.282 -10.369 1.00 0.00 H ATOM 1259 N MET A 186 -10.545 58.140 -11.653 1.00 32.22 N ATOM 1260 CA MET A 186 -11.831 57.586 -11.259 1.00 35.80 C ATOM 1261 C MET A 186 -12.062 56.248 -11.949 1.00 33.72 C ATOM 1262 O MET A 186 -11.830 56.119 -13.155 1.00 37.87 O ATOM 1263 CB MET A 186 -12.954 58.564 -11.579 1.00 38.34 C ATOM 1264 CG MET A 186 -13.422 59.308 -10.341 1.00 42.47 C ATOM 1265 SD MET A 186 -14.394 60.749 -10.754 1.00 58.98 S ATOM 1266 CE MET A 186 -15.205 61.055 -9.186 1.00 45.82 C ATOM 1267 H MET A 186 -10.480 58.692 -12.532 1.00 0.00 H ATOM 1268 N ASP A 187 -12.498 55.250 -11.180 1.00 31.38 N ATOM 1269 CA ASP A 187 -12.777 53.942 -11.748 1.00 34.06 C ATOM 1270 C ASP A 187 -14.202 53.955 -12.290 1.00 36.85 C ATOM 1271 O ASP A 187 -14.859 54.994 -12.310 1.00 33.80 O ATOM 1272 CB ASP A 187 -12.505 52.817 -10.730 1.00 35.03 C ATOM 1273 CG ASP A 187 -13.515 52.752 -9.588 1.00 35.16 C ATOM 1274 OD1 ASP A 187 -14.526 53.474 -9.609 1.00 36.83 O ATOM 1275 OD2 ASP A 187 -13.290 51.956 -8.644 1.00 33.74 O ATOM 1276 H ASP A 187 -12.640 55.409 -10.162 1.00 0.00 H ATOM 1277 N GLN A 188 -14.700 52.792 -12.725 1.00 39.12 N ATOM 1278 CA GLN A 188 -16.015 52.746 -13.357 1.00 37.89 C ATOM 1279 C GLN A 188 -17.119 53.132 -12.383 1.00 36.54 C ATOM 1280 O GLN A 188 -18.151 53.661 -12.806 1.00 38.69 O ATOM 1281 CB GLN A 188 -16.269 51.352 -13.942 1.00 41.43 C ATOM 1282 CG GLN A 188 -16.758 51.359 -15.399 1.00 52.29 C ATOM 1283 CD GLN A 188 -17.298 50.002 -15.870 1.00 56.53 C ATOM 1284 OE1 GLN A 188 -17.075 48.961 -15.228 1.00 51.61 O ATOM 1285 NE2 GLN A 188 -18.003 50.011 -17.007 1.00 48.76 N ATOM 1286 HE22 GLN A 188 -18.165 50.906 -17.511 1.00 0.00 H ATOM 1287 HE21 GLN A 188 -18.389 49.123 -17.387 1.00 0.00 H ATOM 1288 H GLN A 188 -14.148 51.918 -12.612 1.00 0.00 H ATOM 1289 N ASN A 189 -16.915 52.887 -11.080 1.00 38.58 N ATOM 1290 CA ASN A 189 -17.830 53.281 -10.006 1.00 40.22 C ATOM 1291 C ASN A 189 -17.713 54.759 -9.618 1.00 37.13 C ATOM 1292 O ASN A 189 -18.401 55.201 -8.693 1.00 36.15 O ATOM 1293 CB ASN A 189 -17.585 52.431 -8.738 1.00 42.06 C ATOM 1294 CG ASN A 189 -17.238 50.955 -9.041 1.00 48.12 C ATOM 1295 OD1 ASN A 189 -18.020 50.244 -9.680 1.00 47.75 O ATOM 1296 ND2 ASN A 189 -16.066 50.495 -8.560 1.00 35.81 N ATOM 1297 HD22 ASN A 189 -15.438 51.130 -8.027 1.00 0.00 H ATOM 1298 HD21 ASN A 189 -15.790 49.505 -8.722 1.00 0.00 H ATOM 1299 H ASN A 189 -16.046 52.382 -10.813 1.00 0.00 H ATOM 1300 N GLY A 190 -16.851 55.532 -10.267 1.00 36.30 N ATOM 1301 CA GLY A 190 -16.612 56.882 -9.801 1.00 35.62 C ATOM 1302 C GLY A 190 -15.780 56.998 -8.540 1.00 38.29 C ATOM 1303 O GLY A 190 -15.757 58.075 -7.942 1.00 41.49 O ATOM 1304 H GLY A 190 -16.351 55.171 -11.104 1.00 0.00 H ATOM 1305 N MET A 191 -15.097 55.930 -8.109 1.00 34.86 N ATOM 1306 CA MET A 191 -14.271 55.956 -6.901 1.00 34.98 C ATOM 1307 C MET A 191 -12.847 56.383 -7.240 1.00 36.92 C ATOM 1308 O MET A 191 -12.257 55.894 -8.216 1.00 33.62 O ATOM 1309 CB MET A 191 -14.227 54.586 -6.216 1.00 30.89 C ATOM 1310 CG MET A 191 -15.571 53.949 -5.943 1.00 33.07 C ATOM 1311 SD MET A 191 -16.207 54.408 -4.335 1.00 41.34 S ATOM 1312 CE MET A 191 -15.104 53.478 -3.258 1.00 36.00 C ATOM 1313 H MET A 191 -15.156 55.047 -8.655 1.00 0.00 H ATOM 1314 N THR A 192 -12.291 57.281 -6.430 1.00 35.34 N ATOM 1315 CA THR A 192 -10.872 57.605 -6.503 1.00 34.36 C ATOM 1316 C THR A 192 -10.080 56.625 -5.659 1.00 30.29 C ATOM 1317 O THR A 192 -10.638 55.902 -4.826 1.00 34.54 O ATOM 1318 CB THR A 192 -10.635 59.028 -6.015 1.00 35.79 C ATOM 1319 OG1 THR A 192 -11.075 59.128 -4.655 1.00 37.61 O ATOM 1320 CG2 THR A 192 -11.382 60.035 -6.877 1.00 34.54 C ATOM 1321 HG1 THR A 192 -10.925 60.050 -4.328 1.00 0.00 H ATOM 1322 H THR A 192 -12.885 57.764 -5.726 1.00 0.00 H ATOM 1323 N PRO A 193 -8.765 56.547 -5.864 1.00 31.56 N ATOM 1324 CA PRO A 193 -7.940 55.785 -4.908 1.00 31.33 C ATOM 1325 C PRO A 193 -8.099 56.260 -3.467 1.00 29.90 C ATOM 1326 O PRO A 193 -8.067 55.438 -2.544 1.00 27.88 O ATOM 1327 CB PRO A 193 -6.515 56.002 -5.427 1.00 28.56 C ATOM 1328 CG PRO A 193 -6.677 56.297 -6.876 1.00 25.88 C ATOM 1329 CD PRO A 193 -8.005 56.962 -7.057 1.00 33.90 C ATOM 1330 N LEU A 194 -8.288 57.562 -3.244 1.00 28.96 N ATOM 1331 CA LEU A 194 -8.452 58.038 -1.873 1.00 33.65 C ATOM 1332 C LEU A 194 -9.770 57.556 -1.279 1.00 32.58 C ATOM 1333 O LEU A 194 -9.819 57.170 -0.106 1.00 31.82 O ATOM 1334 CB LEU A 194 -8.338 59.566 -1.819 1.00 30.23 C ATOM 1335 CG LEU A 194 -8.252 60.250 -0.447 1.00 28.88 C ATOM 1336 CD1 LEU A 194 -6.949 59.951 0.292 1.00 24.56 C ATOM 1337 CD2 LEU A 194 -8.437 61.749 -0.629 1.00 30.20 C ATOM 1338 H LEU A 194 -8.318 58.232 -4.039 1.00 0.00 H ATOM 1339 N MET A 195 -10.846 57.540 -2.069 1.00 30.50 N ATOM 1340 CA MET A 195 -12.097 56.970 -1.573 1.00 30.70 C ATOM 1341 C MET A 195 -11.922 55.498 -1.213 1.00 33.29 C ATOM 1342 O MET A 195 -12.385 55.043 -0.159 1.00 29.40 O ATOM 1343 CB MET A 195 -13.205 57.129 -2.614 1.00 33.62 C ATOM 1344 CG MET A 195 -13.672 58.547 -2.788 1.00 36.20 C ATOM 1345 SD MET A 195 -14.701 58.716 -4.258 1.00 36.87 S ATOM 1346 CE MET A 195 -14.531 60.483 -4.553 1.00 36.45 C ATOM 1347 H MET A 195 -10.794 57.931 -3.031 1.00 0.00 H ATOM 1348 N TRP A 196 -11.277 54.728 -2.097 1.00 31.06 N ATOM 1349 CA TRP A 196 -11.069 53.317 -1.808 1.00 29.87 C ATOM 1350 C TRP A 196 -10.240 53.147 -0.547 1.00 29.48 C ATOM 1351 O TRP A 196 -10.491 52.239 0.250 1.00 30.91 O ATOM 1352 CB TRP A 196 -10.394 52.624 -2.984 1.00 26.59 C ATOM 1353 CG TRP A 196 -11.372 52.076 -3.999 1.00 32.06 C ATOM 1354 CD1 TRP A 196 -11.526 52.479 -5.309 1.00 28.84 C ATOM 1355 CD2 TRP A 196 -12.330 51.030 -3.789 1.00 30.54 C ATOM 1356 NE1 TRP A 196 -12.517 51.740 -5.914 1.00 31.91 N ATOM 1357 CE2 TRP A 196 -13.028 50.848 -5.006 1.00 28.42 C ATOM 1358 CE3 TRP A 196 -12.673 50.237 -2.687 1.00 29.09 C ATOM 1359 CZ2 TRP A 196 -14.032 49.901 -5.154 1.00 26.83 C ATOM 1360 CZ3 TRP A 196 -13.675 49.295 -2.838 1.00 30.72 C ATOM 1361 CH2 TRP A 196 -14.340 49.134 -4.057 1.00 29.34 C ATOM 1362 HE1 TRP A 196 -12.828 51.842 -6.901 1.00 0.00 H ATOM 1363 H TRP A 196 -10.926 55.136 -2.987 1.00 0.00 H ATOM 1364 N ALA A 197 -9.257 54.021 -0.338 1.00 29.97 N ATOM 1365 CA ALA A 197 -8.429 53.923 0.863 1.00 28.57 C ATOM 1366 C ALA A 197 -9.255 54.199 2.116 1.00 30.21 C ATOM 1367 O ALA A 197 -9.165 53.472 3.121 1.00 27.49 O ATOM 1368 CB ALA A 197 -7.255 54.896 0.755 1.00 25.08 C ATOM 1369 H ALA A 197 -9.078 54.775 -1.031 1.00 0.00 H ATOM 1370 N ALA A 198 -10.065 55.257 2.073 1.00 31.20 N ATOM 1371 CA ALA A 198 -10.895 55.615 3.217 1.00 30.67 C ATOM 1372 C ALA A 198 -11.843 54.483 3.574 1.00 33.39 C ATOM 1373 O ALA A 198 -12.080 54.196 4.754 1.00 30.12 O ATOM 1374 CB ALA A 198 -11.677 56.889 2.899 1.00 28.02 C ATOM 1375 H ALA A 198 -10.105 55.836 1.210 1.00 0.00 H ATOM 1376 N TYR A 199 -12.366 53.810 2.559 1.00 31.66 N ATOM 1377 CA TYR A 199 -13.384 52.798 2.755 1.00 31.07 C ATOM 1378 C TYR A 199 -12.785 51.493 3.256 1.00 33.66 C ATOM 1379 O TYR A 199 -13.380 50.826 4.116 1.00 35.78 O ATOM 1380 CB TYR A 199 -14.143 52.591 1.441 1.00 33.46 C ATOM 1381 CG TYR A 199 -15.216 51.547 1.529 1.00 35.14 C ATOM 1382 CD1 TYR A 199 -16.143 51.569 2.564 1.00 37.17 C ATOM 1383 CD2 TYR A 199 -15.306 50.533 0.585 1.00 34.23 C ATOM 1384 CE1 TYR A 199 -17.130 50.610 2.662 1.00 35.11 C ATOM 1385 CE2 TYR A 199 -16.297 49.557 0.675 1.00 36.97 C ATOM 1386 CZ TYR A 199 -17.207 49.604 1.715 1.00 36.92 C ATOM 1387 OH TYR A 199 -18.197 48.647 1.822 1.00 37.48 O ATOM 1388 HH TYR A 199 -18.752 48.836 2.620 1.00 0.00 H ATOM 1389 H TYR A 199 -12.036 54.014 1.594 1.00 0.00 H ATOM 1390 N ARG A 200 -11.590 51.133 2.776 1.00 28.23 N ATOM 1391 CA ARG A 200 -11.098 49.773 2.946 1.00 29.95 C ATOM 1392 C ARG A 200 -9.770 49.624 3.684 1.00 32.91 C ATOM 1393 O ARG A 200 -9.473 48.511 4.135 1.00 33.82 O ATOM 1394 CB ARG A 200 -10.956 49.093 1.572 1.00 31.37 C ATOM 1395 CG ARG A 200 -12.271 48.619 0.996 1.00 33.97 C ATOM 1396 CD ARG A 200 -12.671 47.277 1.594 1.00 37.60 C ATOM 1397 NE ARG A 200 -11.720 46.216 1.249 1.00 44.55 N ATOM 1398 CZ ARG A 200 -11.808 45.442 0.160 1.00 44.78 C ATOM 1399 NH1 ARG A 200 -10.898 44.491 -0.062 1.00 37.77 N ATOM 1400 NH2 ARG A 200 -12.809 45.609 -0.707 1.00 40.28 N ATOM 1401 HE ARG A 200 -10.921 46.053 1.895 1.00 0.00 H ATOM 1402 HH12 ARG A 200 -10.969 43.891 -0.909 1.00 0.00 H ATOM 1403 HH11 ARG A 200 -10.118 44.350 0.612 1.00 0.00 H ATOM 1404 HH22 ARG A 200 -12.872 45.005 -1.551 1.00 0.00 H ATOM 1405 HH21 ARG A 200 -13.526 46.343 -0.538 1.00 0.00 H ATOM 1406 H ARG A 200 -11.005 51.832 2.275 1.00 0.00 H ATOM 1407 N THR A 201 -8.951 50.667 3.804 1.00 29.34 N ATOM 1408 CA THR A 201 -7.644 50.527 4.457 1.00 30.11 C ATOM 1409 C THR A 201 -7.672 51.272 5.790 1.00 28.88 C ATOM 1410 O THR A 201 -7.543 52.500 5.826 1.00 25.30 O ATOM 1411 CB THR A 201 -6.512 51.042 3.571 1.00 30.52 C ATOM 1412 OG1 THR A 201 -6.741 52.420 3.238 1.00 29.44 O ATOM 1413 CG2 THR A 201 -6.363 50.177 2.292 1.00 25.99 C ATOM 1414 HG1 THR A 201 -6.777 52.957 4.069 1.00 0.00 H ATOM 1415 H THR A 201 -9.241 51.593 3.430 1.00 0.00 H ATOM 1416 N HIS A 202 -7.833 50.527 6.887 1.00 27.07 N ATOM 1417 CA HIS A 202 -7.975 51.136 8.218 1.00 27.34 C ATOM 1418 C HIS A 202 -6.594 51.212 8.846 1.00 26.60 C ATOM 1419 O HIS A 202 -6.230 50.445 9.736 1.00 27.78 O ATOM 1420 CB HIS A 202 -8.960 50.354 9.071 1.00 28.12 C ATOM 1421 CG HIS A 202 -10.347 50.341 8.501 1.00 31.70 C ATOM 1422 ND1 HIS A 202 -11.473 50.139 9.270 1.00 33.45 N ATOM 1423 CD2 HIS A 202 -10.786 50.504 7.229 1.00 32.02 C ATOM 1424 CE1 HIS A 202 -12.545 50.175 8.497 1.00 31.95 C ATOM 1425 NE2 HIS A 202 -12.155 50.400 7.255 1.00 33.33 N ATOM 1426 H HIS A 202 -7.859 49.491 6.798 1.00 0.00 H ATOM 1427 N SER A 203 -5.840 52.203 8.378 1.00 28.48 N ATOM 1428 CA SER A 203 -4.385 52.268 8.442 1.00 33.41 C ATOM 1429 C SER A 203 -3.955 53.638 7.944 1.00 31.18 C ATOM 1430 O SER A 203 -4.664 54.282 7.168 1.00 29.59 O ATOM 1431 CB SER A 203 -3.733 51.175 7.581 1.00 34.33 C ATOM 1432 OG SER A 203 -4.227 51.214 6.243 1.00 33.85 O ATOM 1433 HG SER A 203 -3.792 50.501 5.711 1.00 0.00 H ATOM 1434 H SER A 203 -6.331 53.001 7.927 1.00 0.00 H ATOM 1435 N VAL A 204 -2.776 54.074 8.388 1.00 32.54 N ATOM 1436 CA VAL A 204 -2.283 55.386 7.978 1.00 28.81 C ATOM 1437 C VAL A 204 -2.061 55.416 6.475 1.00 32.11 C ATOM 1438 O VAL A 204 -2.441 56.377 5.792 1.00 32.03 O ATOM 1439 CB VAL A 204 -0.995 55.744 8.740 1.00 30.84 C ATOM 1440 CG1 VAL A 204 -0.444 57.073 8.228 1.00 32.35 C ATOM 1441 CG2 VAL A 204 -1.251 55.768 10.268 1.00 29.08 C ATOM 1442 H VAL A 204 -2.208 53.480 9.026 1.00 0.00 H ATOM 1443 N ASP A 205 -1.425 54.365 5.936 1.00 31.30 N ATOM 1444 CA ASP A 205 -1.160 54.230 4.507 1.00 33.60 C ATOM 1445 C ASP A 205 -2.102 53.202 3.892 1.00 34.53 C ATOM 1446 O ASP A 205 -2.480 52.229 4.556 1.00 33.06 O ATOM 1447 CB ASP A 205 0.293 53.815 4.238 1.00 29.52 C ATOM 1448 CG ASP A 205 1.233 55.006 4.226 1.00 33.68 C ATOM 1449 OD1 ASP A 205 0.845 56.063 3.692 1.00 37.38 O ATOM 1450 OD2 ASP A 205 2.353 54.906 4.762 1.00 43.14 O ATOM 1451 H ASP A 205 -1.104 53.606 6.570 1.00 0.00 H ATOM 1452 N PRO A 206 -2.475 53.363 2.610 1.00 32.51 N ATOM 1453 CA PRO A 206 -1.926 54.334 1.651 1.00 28.94 C ATOM 1454 C PRO A 206 -2.533 55.742 1.695 1.00 31.89 C ATOM 1455 O PRO A 206 -2.142 56.558 0.861 1.00 30.24 O ATOM 1456 CB PRO A 206 -2.200 53.668 0.293 1.00 29.35 C ATOM 1457 CG PRO A 206 -3.423 52.839 0.516 1.00 30.83 C ATOM 1458 CD PRO A 206 -3.504 52.498 2.005 1.00 28.35 C ATOM 1459 N THR A 207 -3.414 56.033 2.664 1.00 30.52 N ATOM 1460 CA THR A 207 -4.050 57.351 2.712 1.00 31.42 C ATOM 1461 C THR A 207 -3.014 58.467 2.827 1.00 32.73 C ATOM 1462 O THR A 207 -3.040 59.437 2.057 1.00 32.40 O ATOM 1463 CB THR A 207 -5.048 57.426 3.871 1.00 32.05 C ATOM 1464 OG1 THR A 207 -6.170 56.581 3.588 1.00 29.46 O ATOM 1465 CG2 THR A 207 -5.529 58.864 4.090 1.00 29.49 C ATOM 1466 HG1 THR A 207 -5.859 55.647 3.478 1.00 0.00 H ATOM 1467 H THR A 207 -3.646 55.319 3.384 1.00 0.00 H ATOM 1468 N ARG A 208 -2.086 58.346 3.780 1.00 33.29 N ATOM 1469 CA ARG A 208 -1.075 59.388 3.950 1.00 34.84 C ATOM 1470 C ARG A 208 -0.272 59.615 2.672 1.00 32.88 C ATOM 1471 O ARG A 208 0.001 60.763 2.302 1.00 33.80 O ATOM 1472 CB ARG A 208 -0.132 59.052 5.106 1.00 33.03 C ATOM 1473 CG ARG A 208 0.841 60.192 5.386 1.00 33.50 C ATOM 1474 CD ARG A 208 1.761 59.873 6.537 1.00 39.73 C ATOM 1475 NE ARG A 208 2.399 58.576 6.346 1.00 43.88 N ATOM 1476 CZ ARG A 208 2.897 57.845 7.339 1.00 45.46 C ATOM 1477 NH1 ARG A 208 2.835 58.297 8.594 1.00 39.75 N ATOM 1478 NH2 ARG A 208 3.446 56.659 7.075 1.00 39.69 N ATOM 1479 HE ARG A 208 2.469 58.201 5.378 1.00 0.00 H ATOM 1480 HH12 ARG A 208 3.224 57.727 9.372 1.00 0.00 H ATOM 1481 HH11 ARG A 208 2.398 59.219 8.794 1.00 0.00 H ATOM 1482 HH22 ARG A 208 3.837 56.083 7.848 1.00 0.00 H ATOM 1483 HH21 ARG A 208 3.483 56.310 6.096 1.00 0.00 H ATOM 1484 H ARG A 208 -2.083 57.511 4.400 1.00 0.00 H ATOM 1485 N LEU A 209 0.123 58.536 1.986 1.00 32.92 N ATOM 1486 CA LEU A 209 0.852 58.690 0.728 1.00 34.31 C ATOM 1487 C LEU A 209 0.027 59.455 -0.296 1.00 30.96 C ATOM 1488 O LEU A 209 0.522 60.395 -0.935 1.00 31.41 O ATOM 1489 CB LEU A 209 1.252 57.326 0.162 1.00 34.03 C ATOM 1490 CG LEU A 209 1.817 57.430 -1.261 1.00 30.85 C ATOM 1491 CD1 LEU A 209 3.341 57.666 -1.253 1.00 26.42 C ATOM 1492 CD2 LEU A 209 1.447 56.196 -2.079 1.00 29.89 C ATOM 1493 H LEU A 209 -0.089 57.585 2.349 1.00 0.00 H ATOM 1494 N LEU A 210 -1.237 59.059 -0.474 1.00 30.10 N ATOM 1495 CA LEU A 210 -2.091 59.726 -1.456 1.00 30.84 C ATOM 1496 C LEU A 210 -2.199 61.221 -1.179 1.00 31.66 C ATOM 1497 O LEU A 210 -2.232 62.034 -2.108 1.00 32.71 O ATOM 1498 CB LEU A 210 -3.478 59.082 -1.464 1.00 28.97 C ATOM 1499 CG LEU A 210 -3.513 57.687 -2.071 1.00 28.74 C ATOM 1500 CD1 LEU A 210 -4.793 56.891 -1.678 1.00 25.13 C ATOM 1501 CD2 LEU A 210 -3.356 57.816 -3.586 1.00 26.05 C ATOM 1502 H LEU A 210 -1.616 58.271 0.090 1.00 0.00 H ATOM 1503 N LEU A 211 -2.242 61.607 0.094 1.00 34.14 N ATOM 1504 CA LEU A 211 -2.434 63.012 0.422 1.00 35.84 C ATOM 1505 C LEU A 211 -1.184 63.857 0.188 1.00 35.37 C ATOM 1506 O LEU A 211 -1.273 65.088 0.280 1.00 34.98 O ATOM 1507 CB LEU A 211 -2.903 63.142 1.875 1.00 31.31 C ATOM 1508 CG LEU A 211 -4.317 62.638 2.187 1.00 34.97 C ATOM 1509 CD1 LEU A 211 -4.559 62.653 3.698 1.00 32.52 C ATOM 1510 CD2 LEU A 211 -5.388 63.449 1.475 1.00 29.49 C ATOM 1511 H LEU A 211 -2.138 60.905 0.854 1.00 0.00 H ATOM 1512 N THR A 212 -0.029 63.233 -0.093 1.00 33.74 N ATOM 1513 CA THR A 212 1.181 63.961 -0.471 1.00 34.32 C ATOM 1514 C THR A 212 1.171 64.407 -1.925 1.00 36.70 C ATOM 1515 O THR A 212 2.107 65.091 -2.350 1.00 37.83 O ATOM 1516 CB THR A 212 2.456 63.125 -0.247 1.00 35.06 C ATOM 1517 OG1 THR A 212 2.609 62.174 -1.314 1.00 30.55 O ATOM 1518 CG2 THR A 212 2.443 62.416 1.116 1.00 35.27 C ATOM 1519 HG1 THR A 212 1.822 61.573 -1.334 1.00 0.00 H ATOM 1520 H THR A 212 0.006 62.195 -0.040 1.00 0.00 H ATOM 1521 N PHE A 213 0.165 64.016 -2.699 1.00 38.49 N ATOM 1522 CA PHE A 213 -0.038 64.537 -4.038 1.00 35.20 C ATOM 1523 C PHE A 213 -1.193 65.524 -4.020 1.00 39.81 C ATOM 1524 O PHE A 213 -1.917 65.658 -3.029 1.00 40.66 O ATOM 1525 CB PHE A 213 -0.298 63.403 -5.032 1.00 36.37 C ATOM 1526 CG PHE A 213 0.811 62.399 -5.085 1.00 35.99 C ATOM 1527 CD1 PHE A 213 1.957 62.652 -5.819 1.00 30.00 C ATOM 1528 CD2 PHE A 213 0.727 61.212 -4.367 1.00 34.19 C ATOM 1529 CE1 PHE A 213 3.001 61.731 -5.851 1.00 27.30 C ATOM 1530 CE2 PHE A 213 1.772 60.286 -4.397 1.00 33.24 C ATOM 1531 CZ PHE A 213 2.902 60.552 -5.147 1.00 29.11 C ATOM 1532 H PHE A 213 -0.503 63.309 -2.331 1.00 0.00 H ATOM 1533 N ASN A 214 -1.361 66.221 -5.143 1.00 43.24 N ATOM 1534 CA ASN A 214 -2.364 67.276 -5.256 1.00 45.81 C ATOM 1535 C ASN A 214 -3.751 66.683 -5.535 1.00 44.39 C ATOM 1536 O ASN A 214 -4.376 66.918 -6.569 1.00 49.96 O ATOM 1537 CB ASN A 214 -1.954 68.270 -6.334 1.00 49.31 C ATOM 1538 CG ASN A 214 -2.913 69.445 -6.433 1.00 55.08 C ATOM 1539 OD1 ASN A 214 -3.538 69.839 -5.438 1.00 53.40 O ATOM 1540 ND2 ASN A 214 -3.049 70.001 -7.641 1.00 58.09 N ATOM 1541 HD22 ASN A 214 -2.502 69.635 -8.446 1.00 0.00 H ATOM 1542 HD21 ASN A 214 -3.701 70.800 -7.775 1.00 0.00 H ATOM 1543 H ASN A 214 -0.759 66.007 -5.964 1.00 0.00 H ATOM 1544 N VAL A 215 -4.239 65.907 -4.568 1.00 42.74 N ATOM 1545 CA VAL A 215 -5.582 65.348 -4.658 1.00 42.03 C ATOM 1546 C VAL A 215 -6.616 66.445 -4.446 1.00 43.97 C ATOM 1547 O VAL A 215 -6.379 67.439 -3.744 1.00 47.22 O ATOM 1548 CB VAL A 215 -5.793 64.220 -3.633 1.00 43.44 C ATOM 1549 CG1 VAL A 215 -4.861 63.078 -3.916 1.00 41.90 C ATOM 1550 CG2 VAL A 215 -5.591 64.748 -2.221 1.00 41.36 C ATOM 1551 H VAL A 215 -3.652 65.697 -3.736 1.00 0.00 H ATOM 1552 N SER A 216 -7.782 66.259 -5.059 1.00 43.39 N ATOM 1553 CA SER A 216 -8.943 67.106 -4.808 1.00 42.55 C ATOM 1554 C SER A 216 -9.738 66.432 -3.702 1.00 43.61 C ATOM 1555 O SER A 216 -10.621 65.606 -3.949 1.00 42.86 O ATOM 1556 CB SER A 216 -9.766 67.287 -6.075 1.00 46.10 C ATOM 1557 OG SER A 216 -11.050 67.800 -5.763 1.00 49.49 O ATOM 1558 HG SER A 216 -11.519 67.169 -5.161 1.00 0.00 H ATOM 1559 H SER A 216 -7.869 65.480 -5.743 1.00 0.00 H ATOM 1560 N VAL A 217 -9.425 66.801 -2.458 1.00 41.39 N ATOM 1561 CA VAL A 217 -9.841 65.994 -1.322 1.00 35.88 C ATOM 1562 C VAL A 217 -11.354 65.917 -1.198 1.00 39.72 C ATOM 1563 O VAL A 217 -11.879 64.967 -0.611 1.00 38.56 O ATOM 1564 CB VAL A 217 -9.177 66.542 -0.038 1.00 36.61 C ATOM 1565 CG1 VAL A 217 -9.770 67.867 0.345 1.00 35.87 C ATOM 1566 CG2 VAL A 217 -9.293 65.542 1.097 1.00 37.01 C ATOM 1567 H VAL A 217 -8.879 67.672 -2.300 1.00 0.00 H ATOM 1568 N ASN A 218 -12.083 66.864 -1.780 1.00 41.44 N ATOM 1569 CA ASN A 218 -13.520 66.934 -1.567 1.00 38.40 C ATOM 1570 C ASN A 218 -14.322 66.448 -2.771 1.00 42.43 C ATOM 1571 O ASN A 218 -15.506 66.783 -2.889 1.00 42.14 O ATOM 1572 CB ASN A 218 -13.917 68.362 -1.170 1.00 41.27 C ATOM 1573 CG ASN A 218 -13.539 68.695 0.288 1.00 42.15 C ATOM 1574 OD1 ASN A 218 -13.785 67.904 1.204 1.00 41.59 O ATOM 1575 ND2 ASN A 218 -12.931 69.860 0.498 1.00 42.97 N ATOM 1576 HD22 ASN A 218 -12.741 70.499 -0.300 1.00 0.00 H ATOM 1577 HD21 ASN A 218 -12.645 70.131 1.460 1.00 0.00 H ATOM 1578 H ASN A 218 -11.620 67.563 -2.395 1.00 0.00 H ATOM 1579 N LEU A 219 -13.711 65.654 -3.660 1.00 41.85 N ATOM 1580 CA LEU A 219 -14.468 64.961 -4.702 1.00 36.89 C ATOM 1581 C LEU A 219 -15.426 63.957 -4.076 1.00 36.60 C ATOM 1582 O LEU A 219 -15.196 63.451 -2.980 1.00 40.52 O ATOM 1583 CB LEU A 219 -13.543 64.206 -5.659 1.00 37.30 C ATOM 1584 CG LEU A 219 -12.643 64.888 -6.690 1.00 43.59 C ATOM 1585 CD1 LEU A 219 -11.780 63.838 -7.379 1.00 39.45 C ATOM 1586 CD2 LEU A 219 -13.423 65.701 -7.712 1.00 35.46 C ATOM 1587 H LEU A 219 -12.680 65.528 -3.608 1.00 0.00 H ATOM 1588 N GLY A 220 -16.503 63.659 -4.793 1.00 36.80 N ATOM 1589 CA GLY A 220 -17.447 62.640 -4.382 1.00 37.51 C ATOM 1590 C GLY A 220 -17.578 61.612 -5.494 1.00 42.07 C ATOM 1591 O GLY A 220 -17.353 61.921 -6.666 1.00 41.89 O ATOM 1592 H GLY A 220 -16.675 64.175 -5.680 1.00 0.00 H ATOM 1593 N ASP A 221 -17.921 60.384 -5.116 1.00 38.88 N ATOM 1594 CA ASP A 221 -18.016 59.359 -6.146 1.00 43.45 C ATOM 1595 C ASP A 221 -19.230 59.623 -7.038 1.00 46.21 C ATOM 1596 O ASP A 221 -20.073 60.477 -6.749 1.00 44.75 O ATOM 1597 CB ASP A 221 -18.101 57.967 -5.531 1.00 38.73 C ATOM 1598 CG ASP A 221 -19.358 57.772 -4.751 1.00 43.31 C ATOM 1599 OD1 ASP A 221 -19.415 58.307 -3.628 1.00 42.47 O ATOM 1600 OD2 ASP A 221 -20.292 57.112 -5.275 1.00 43.91 O ATOM 1601 H ASP A 221 -18.115 60.163 -4.118 1.00 0.00 H ATOM 1602 N LYS A 222 -19.325 58.856 -8.127 1.00 42.00 N ATOM 1603 CA LYS A 222 -20.255 59.214 -9.195 1.00 44.26 C ATOM 1604 C LYS A 222 -21.699 58.914 -8.815 1.00 42.86 C ATOM 1605 O LYS A 222 -22.605 59.685 -9.155 1.00 44.29 O ATOM 1606 CB LYS A 222 -19.877 58.489 -10.487 1.00 39.59 C ATOM 1607 H LYS A 222 -18.736 58.003 -8.215 1.00 0.00 H ATOM 1608 N TYR A 223 -21.944 57.803 -8.127 1.00 40.49 N ATOM 1609 CA TYR A 223 -23.319 57.430 -7.808 1.00 44.87 C ATOM 1610 C TYR A 223 -23.808 57.944 -6.447 1.00 47.74 C ATOM 1611 O TYR A 223 -24.994 58.269 -6.307 1.00 46.14 O ATOM 1612 CB TYR A 223 -23.474 55.905 -7.875 1.00 44.01 C ATOM 1613 H TYR A 223 -21.156 57.200 -7.816 1.00 0.00 H ATOM 1614 N HIS A 224 -22.946 58.025 -5.430 1.00 46.16 N ATOM 1615 CA HIS A 224 -23.390 58.465 -4.113 1.00 42.62 C ATOM 1616 C HIS A 224 -22.992 59.895 -3.783 1.00 43.50 C ATOM 1617 O HIS A 224 -23.555 60.474 -2.845 1.00 42.49 O ATOM 1618 CB HIS A 224 -22.828 57.552 -3.018 1.00 40.46 C ATOM 1619 CG HIS A 224 -23.190 56.110 -3.179 1.00 42.86 C ATOM 1620 ND1 HIS A 224 -24.421 55.607 -2.819 1.00 42.49 N ATOM 1621 CD2 HIS A 224 -22.476 55.059 -3.651 1.00 42.66 C ATOM 1622 CE1 HIS A 224 -24.451 54.309 -3.063 1.00 40.97 C ATOM 1623 NE2 HIS A 224 -23.285 53.952 -3.572 1.00 40.14 N ATOM 1624 H HIS A 224 -21.948 57.772 -5.579 1.00 0.00 H ATOM 1625 N LYS A 225 -22.031 60.461 -4.519 1.00 43.88 N ATOM 1626 CA LYS A 225 -21.407 61.743 -4.185 1.00 41.89 C ATOM 1627 C LYS A 225 -20.862 61.753 -2.758 1.00 41.00 C ATOM 1628 O LYS A 225 -20.883 62.788 -2.092 1.00 44.79 O ATOM 1629 CB LYS A 225 -22.367 62.915 -4.403 1.00 37.95 C ATOM 1630 H LYS A 225 -21.709 59.965 -5.374 1.00 0.00 H ATOM 1631 N ASN A 226 -20.384 60.599 -2.274 1.00 40.73 N ATOM 1632 CA ASN A 226 -19.697 60.506 -0.985 1.00 38.31 C ATOM 1633 C ASN A 226 -18.245 60.931 -1.154 1.00 36.56 C ATOM 1634 O ASN A 226 -17.529 60.361 -1.982 1.00 35.66 O ATOM 1635 CB ASN A 226 -19.735 59.079 -0.447 1.00 37.28 C ATOM 1636 CG ASN A 226 -21.079 58.693 0.091 1.00 39.70 C ATOM 1637 OD1 ASN A 226 -21.834 59.540 0.576 1.00 40.68 O ATOM 1638 ND2 ASN A 226 -21.393 57.400 0.018 1.00 36.08 N ATOM 1639 HD22 ASN A 226 -20.722 56.725 -0.400 1.00 0.00 H ATOM 1640 HD21 ASN A 226 -22.309 57.066 0.379 1.00 0.00 H ATOM 1641 H ASN A 226 -20.506 59.733 -2.837 1.00 0.00 H ATOM 1642 N THR A 227 -17.803 61.922 -0.380 1.00 36.39 N ATOM 1643 CA THR A 227 -16.381 62.229 -0.378 1.00 36.14 C ATOM 1644 C THR A 227 -15.625 61.149 0.396 1.00 34.34 C ATOM 1645 O THR A 227 -16.215 60.303 1.073 1.00 33.06 O ATOM 1646 CB THR A 227 -16.101 63.596 0.247 1.00 35.07 C ATOM 1647 OG1 THR A 227 -16.365 63.526 1.654 1.00 37.87 O ATOM 1648 CG2 THR A 227 -16.944 64.686 -0.387 1.00 34.44 C ATOM 1649 HG1 THR A 227 -17.313 63.279 1.799 1.00 0.00 H ATOM 1650 H THR A 227 -18.463 62.466 0.212 1.00 0.00 H ATOM 1651 N ALA A 228 -14.296 61.184 0.280 1.00 37.18 N ATOM 1652 CA ALA A 228 -13.465 60.263 1.050 1.00 34.66 C ATOM 1653 C ALA A 228 -13.792 60.336 2.534 1.00 31.75 C ATOM 1654 O ALA A 228 -13.844 59.303 3.217 1.00 33.39 O ATOM 1655 CB ALA A 228 -11.984 60.557 0.806 1.00 32.90 C ATOM 1656 H ALA A 228 -13.850 61.870 -0.362 1.00 0.00 H ATOM 1657 N LEU A 229 -14.057 61.542 3.047 1.00 34.27 N ATOM 1658 CA LEU A 229 -14.432 61.662 4.456 1.00 35.64 C ATOM 1659 C LEU A 229 -15.729 60.916 4.744 1.00 33.94 C ATOM 1660 O LEU A 229 -15.834 60.212 5.764 1.00 34.47 O ATOM 1661 CB LEU A 229 -14.555 63.133 4.860 1.00 33.44 C ATOM 1662 CG LEU A 229 -14.788 63.415 6.347 1.00 33.08 C ATOM 1663 CD1 LEU A 229 -13.611 62.935 7.183 1.00 30.74 C ATOM 1664 CD2 LEU A 229 -14.998 64.887 6.524 1.00 33.67 C ATOM 1665 H LEU A 229 -13.997 62.390 2.448 1.00 0.00 H ATOM 1666 N HIS A 230 -16.725 61.059 3.855 1.00 33.55 N ATOM 1667 CA HIS A 230 -17.967 60.292 3.961 1.00 34.81 C ATOM 1668 C HIS A 230 -17.673 58.806 4.086 1.00 34.19 C ATOM 1669 O HIS A 230 -18.217 58.116 4.957 1.00 33.76 O ATOM 1670 CB HIS A 230 -18.857 60.522 2.730 1.00 35.26 C ATOM 1671 CG HIS A 230 -19.632 61.803 2.742 1.00 35.55 C ATOM 1672 ND1 HIS A 230 -19.165 62.957 2.150 1.00 34.98 N ATOM 1673 CD2 HIS A 230 -20.865 62.098 3.224 1.00 37.97 C ATOM 1674 CE1 HIS A 230 -20.066 63.916 2.296 1.00 39.00 C ATOM 1675 NE2 HIS A 230 -21.101 63.423 2.953 1.00 36.57 N ATOM 1676 H HIS A 230 -16.611 61.732 3.071 1.00 0.00 H ATOM 1677 N TRP A 231 -16.813 58.299 3.199 1.00 35.54 N ATOM 1678 CA TRP A 231 -16.492 56.878 3.179 1.00 35.06 C ATOM 1679 C TRP A 231 -15.820 56.438 4.469 1.00 34.82 C ATOM 1680 O TRP A 231 -16.133 55.362 5.008 1.00 34.11 O ATOM 1681 CB TRP A 231 -15.593 56.586 1.983 1.00 37.35 C ATOM 1682 CG TRP A 231 -16.344 56.589 0.704 1.00 37.16 C ATOM 1683 CD1 TRP A 231 -16.375 57.575 -0.224 1.00 34.72 C ATOM 1684 CD2 TRP A 231 -17.188 55.542 0.215 1.00 36.89 C ATOM 1685 NE1 TRP A 231 -17.171 57.206 -1.271 1.00 36.25 N ATOM 1686 CE2 TRP A 231 -17.687 55.963 -1.027 1.00 34.88 C ATOM 1687 CE3 TRP A 231 -17.558 54.283 0.707 1.00 38.04 C ATOM 1688 CZ2 TRP A 231 -18.550 55.180 -1.791 1.00 38.80 C ATOM 1689 CZ3 TRP A 231 -18.410 53.501 -0.049 1.00 43.02 C ATOM 1690 CH2 TRP A 231 -18.900 53.953 -1.290 1.00 41.63 C ATOM 1691 HE1 TRP A 231 -17.355 57.779 -2.119 1.00 0.00 H ATOM 1692 H TRP A 231 -16.363 58.932 2.508 1.00 0.00 H ATOM 1693 N ALA A 232 -14.891 57.260 4.981 1.00 33.60 N ATOM 1694 CA ALA A 232 -14.200 56.926 6.228 1.00 33.54 C ATOM 1695 C ALA A 232 -15.161 56.913 7.421 1.00 33.54 C ATOM 1696 O ALA A 232 -15.060 56.035 8.290 1.00 32.85 O ATOM 1697 CB ALA A 232 -13.042 57.897 6.464 1.00 31.46 C ATOM 1698 H ALA A 232 -14.659 58.145 4.486 1.00 0.00 H ATOM 1699 N VAL A 233 -16.113 57.855 7.471 1.00 31.54 N ATOM 1700 CA VAL A 233 -17.124 57.830 8.532 1.00 38.01 C ATOM 1701 C VAL A 233 -18.023 56.605 8.380 1.00 35.88 C ATOM 1702 O VAL A 233 -18.250 55.857 9.337 1.00 32.45 O ATOM 1703 CB VAL A 233 -17.939 59.139 8.535 1.00 35.71 C ATOM 1704 CG1 VAL A 233 -19.063 59.061 9.519 1.00 31.42 C ATOM 1705 CG2 VAL A 233 -17.044 60.345 8.866 1.00 33.94 C ATOM 1706 H VAL A 233 -16.135 58.607 6.753 1.00 0.00 H ATOM 1707 N LEU A 234 -18.544 56.387 7.168 1.00 35.64 N ATOM 1708 CA LEU A 234 -19.346 55.202 6.867 1.00 34.64 C ATOM 1709 C LEU A 234 -18.694 53.932 7.380 1.00 31.21 C ATOM 1710 O LEU A 234 -19.381 53.011 7.835 1.00 32.17 O ATOM 1711 CB LEU A 234 -19.535 55.072 5.348 1.00 38.74 C ATOM 1712 CG LEU A 234 -20.718 55.764 4.686 1.00 45.20 C ATOM 1713 CD1 LEU A 234 -20.898 55.268 3.255 1.00 39.11 C ATOM 1714 CD2 LEU A 234 -21.978 55.527 5.503 1.00 45.65 C ATOM 1715 H LEU A 234 -18.373 57.083 6.415 1.00 0.00 H ATOM 1716 N ALA A 235 -17.373 53.834 7.241 1.00 32.89 N ATOM 1717 CA ALA A 235 -16.642 52.611 7.533 1.00 30.78 C ATOM 1718 C ALA A 235 -16.063 52.588 8.934 1.00 34.32 C ATOM 1719 O ALA A 235 -15.430 51.589 9.302 1.00 33.28 O ATOM 1720 CB ALA A 235 -15.510 52.403 6.514 1.00 29.28 C ATOM 1721 H ALA A 235 -16.843 54.665 6.910 1.00 0.00 H ATOM 1722 N GLY A 236 -16.263 53.649 9.719 1.00 28.77 N ATOM 1723 CA GLY A 236 -15.639 53.738 11.028 1.00 27.80 C ATOM 1724 C GLY A 236 -14.125 53.773 10.987 1.00 33.48 C ATOM 1725 O GLY A 236 -13.466 53.297 11.921 1.00 35.90 O ATOM 1726 H GLY A 236 -16.874 54.423 9.389 1.00 0.00 H ATOM 1727 N ASN A 237 -13.553 54.327 9.921 1.00 32.10 N ATOM 1728 CA ASN A 237 -12.106 54.316 9.705 1.00 33.95 C ATOM 1729 C ASN A 237 -11.483 55.510 10.430 1.00 32.32 C ATOM 1730 O ASN A 237 -11.106 56.522 9.829 1.00 30.21 O ATOM 1731 CB ASN A 237 -11.803 54.334 8.209 1.00 29.99 C ATOM 1732 CG ASN A 237 -10.351 54.036 7.908 1.00 33.72 C ATOM 1733 OD1 ASN A 237 -9.509 54.056 8.810 1.00 28.66 O ATOM 1734 ND2 ASN A 237 -10.044 53.755 6.636 1.00 28.84 N ATOM 1735 HD22 ASN A 237 -10.789 53.750 5.910 1.00 0.00 H ATOM 1736 HD21 ASN A 237 -9.061 53.541 6.373 1.00 0.00 H ATOM 1737 H ASN A 237 -14.159 54.787 9.212 1.00 0.00 H ATOM 1738 N THR A 238 -11.341 55.370 11.755 1.00 33.39 N ATOM 1739 CA THR A 238 -10.897 56.507 12.566 1.00 33.38 C ATOM 1740 C THR A 238 -9.483 56.960 12.214 1.00 34.55 C ATOM 1741 O THR A 238 -9.198 58.163 12.267 1.00 33.58 O ATOM 1742 CB THR A 238 -10.971 56.173 14.048 1.00 30.35 C ATOM 1743 OG1 THR A 238 -10.071 55.100 14.324 1.00 37.95 O ATOM 1744 CG2 THR A 238 -12.349 55.736 14.416 1.00 35.04 C ATOM 1745 HG1 THR A 238 -10.112 54.876 15.287 1.00 0.00 H ATOM 1746 H THR A 238 -11.546 54.456 12.207 1.00 0.00 H ATOM 1747 N THR A 239 -8.584 56.029 11.856 1.00 32.53 N ATOM 1748 CA THR A 239 -7.232 56.432 11.459 1.00 37.06 C ATOM 1749 C THR A 239 -7.267 57.424 10.300 1.00 37.18 C ATOM 1750 O THR A 239 -6.514 58.404 10.280 1.00 41.36 O ATOM 1751 CB THR A 239 -6.389 55.222 11.045 1.00 35.05 C ATOM 1752 OG1 THR A 239 -6.398 54.222 12.069 1.00 38.77 O ATOM 1753 CG2 THR A 239 -4.959 55.666 10.751 1.00 34.48 C ATOM 1754 HG1 THR A 239 -5.848 53.451 11.781 1.00 0.00 H ATOM 1755 H THR A 239 -8.847 55.023 11.860 1.00 0.00 H ATOM 1756 N VAL A 240 -8.122 57.171 9.314 1.00 32.69 N ATOM 1757 CA VAL A 240 -8.132 57.997 8.114 1.00 33.26 C ATOM 1758 C VAL A 240 -8.830 59.333 8.364 1.00 35.09 C ATOM 1759 O VAL A 240 -8.459 60.352 7.764 1.00 35.24 O ATOM 1760 CB VAL A 240 -8.785 57.195 6.972 1.00 31.45 C ATOM 1761 CG1 VAL A 240 -9.144 58.077 5.786 1.00 32.73 C ATOM 1762 CG2 VAL A 240 -7.854 56.074 6.542 1.00 35.32 C ATOM 1763 H VAL A 240 -8.789 56.377 9.400 1.00 0.00 H ATOM 1764 N ILE A 241 -9.833 59.356 9.249 1.00 37.43 N ATOM 1765 CA ILE A 241 -10.628 60.565 9.455 1.00 39.49 C ATOM 1766 C ILE A 241 -9.732 61.741 9.822 1.00 37.72 C ATOM 1767 O ILE A 241 -9.840 62.830 9.249 1.00 38.63 O ATOM 1768 CB ILE A 241 -11.703 60.323 10.522 1.00 35.98 C ATOM 1769 CG1 ILE A 241 -12.734 59.333 9.984 1.00 37.11 C ATOM 1770 CG2 ILE A 241 -12.347 61.647 10.901 1.00 35.58 C ATOM 1771 CD1 ILE A 241 -13.830 58.986 10.943 1.00 37.59 C ATOM 1772 H ILE A 241 -10.050 58.500 9.799 1.00 0.00 H ATOM 1773 N SER A 242 -8.796 61.524 10.741 1.00 37.64 N ATOM 1774 CA SER A 242 -7.919 62.611 11.165 1.00 38.56 C ATOM 1775 C SER A 242 -7.028 63.088 10.026 1.00 38.02 C ATOM 1776 O SER A 242 -6.787 64.296 9.877 1.00 42.75 O ATOM 1777 CB SER A 242 -7.083 62.156 12.360 1.00 39.31 C ATOM 1778 OG SER A 242 -7.862 61.305 13.188 1.00 38.33 O ATOM 1779 HG SER A 242 -7.318 61.011 13.962 1.00 0.00 H ATOM 1780 H SER A 242 -8.688 60.578 11.159 1.00 0.00 H ATOM 1781 N LEU A 243 -6.530 62.158 9.206 1.00 40.06 N ATOM 1782 CA LEU A 243 -5.695 62.542 8.064 1.00 40.78 C ATOM 1783 C LEU A 243 -6.458 63.419 7.075 1.00 36.59 C ATOM 1784 O LEU A 243 -5.901 64.381 6.533 1.00 35.92 O ATOM 1785 CB LEU A 243 -5.158 61.293 7.361 1.00 36.96 C ATOM 1786 CG LEU A 243 -4.039 60.577 8.110 1.00 38.73 C ATOM 1787 CD1 LEU A 243 -3.967 59.139 7.695 1.00 35.10 C ATOM 1788 CD2 LEU A 243 -2.723 61.280 7.827 1.00 44.61 C ATOM 1789 H LEU A 243 -6.736 61.154 9.379 1.00 0.00 H ATOM 1790 N LEU A 244 -7.729 63.099 6.818 1.00 37.56 N ATOM 1791 CA LEU A 244 -8.486 63.837 5.810 1.00 34.65 C ATOM 1792 C LEU A 244 -8.872 65.224 6.314 1.00 38.78 C ATOM 1793 O LEU A 244 -8.755 66.213 5.577 1.00 37.41 O ATOM 1794 CB LEU A 244 -9.732 63.053 5.405 1.00 32.64 C ATOM 1795 CG LEU A 244 -9.479 61.741 4.677 1.00 34.18 C ATOM 1796 CD1 LEU A 244 -10.782 60.978 4.501 1.00 28.34 C ATOM 1797 CD2 LEU A 244 -8.786 62.020 3.331 1.00 32.50 C ATOM 1798 H LEU A 244 -8.182 62.321 7.338 1.00 0.00 H ATOM 1799 N LEU A 245 -9.382 65.304 7.552 1.00 34.53 N ATOM 1800 CA LEU A 245 -9.606 66.597 8.194 1.00 35.99 C ATOM 1801 C LEU A 245 -8.351 67.457 8.131 1.00 39.53 C ATOM 1802 O LEU A 245 -8.390 68.604 7.676 1.00 43.96 O ATOM 1803 CB LEU A 245 -10.029 66.394 9.645 1.00 37.76 C ATOM 1804 CG LEU A 245 -11.354 65.669 9.834 1.00 41.11 C ATOM 1805 CD1 LEU A 245 -11.544 65.314 11.288 1.00 42.97 C ATOM 1806 CD2 LEU A 245 -12.491 66.536 9.306 1.00 42.07 C ATOM 1807 H LEU A 245 -9.622 64.431 8.063 1.00 0.00 H ATOM 1808 N GLU A 246 -7.213 66.893 8.547 1.00 41.26 N ATOM 1809 CA GLU A 246 -5.943 67.613 8.482 1.00 43.77 C ATOM 1810 C GLU A 246 -5.571 68.004 7.053 1.00 39.81 C ATOM 1811 O GLU A 246 -4.832 68.972 6.855 1.00 53.49 O ATOM 1812 CB GLU A 246 -4.855 66.754 9.124 1.00 48.90 C ATOM 1813 CG GLU A 246 -3.438 67.273 9.019 1.00 54.04 C ATOM 1814 CD GLU A 246 -2.428 66.160 9.287 1.00 64.71 C ATOM 1815 OE1 GLU A 246 -1.512 65.953 8.456 1.00 65.34 O ATOM 1816 OE2 GLU A 246 -2.573 65.471 10.325 1.00 71.73 O ATOM 1817 H GLU A 246 -7.232 65.924 8.924 1.00 0.00 H ATOM 1818 N ALA A 247 -6.079 67.291 6.047 1.00 40.58 N ATOM 1819 CA ALA A 247 -5.831 67.631 4.647 1.00 39.58 C ATOM 1820 C ALA A 247 -6.923 68.509 4.037 1.00 37.96 C ATOM 1821 O ALA A 247 -6.933 68.706 2.819 1.00 43.01 O ATOM 1822 CB ALA A 247 -5.666 66.360 3.808 1.00 36.15 C ATOM 1823 H ALA A 247 -6.672 66.465 6.266 1.00 0.00 H ATOM 1824 N GLY A 248 -7.842 69.030 4.838 1.00 39.83 N ATOM 1825 CA GLY A 248 -8.820 69.973 4.346 1.00 38.94 C ATOM 1826 C GLY A 248 -10.167 69.408 3.951 1.00 41.23 C ATOM 1827 O GLY A 248 -10.910 70.089 3.237 1.00 43.55 O ATOM 1828 H GLY A 248 -7.859 68.754 5.841 1.00 0.00 H ATOM 1829 N ALA A 249 -10.509 68.197 4.384 1.00 38.46 N ATOM 1830 CA ALA A 249 -11.818 67.648 4.067 1.00 36.86 C ATOM 1831 C ALA A 249 -12.925 68.527 4.653 1.00 42.15 C ATOM 1832 O ALA A 249 -12.865 68.936 5.818 1.00 42.92 O ATOM 1833 CB ALA A 249 -11.923 66.216 4.596 1.00 33.83 C ATOM 1834 H ALA A 249 -9.838 67.641 4.951 1.00 0.00 H ATOM 1835 N ASN A 250 -13.942 68.813 3.841 1.00 42.25 N ATOM 1836 CA ASN A 250 -15.091 69.595 4.287 1.00 43.22 C ATOM 1837 C ASN A 250 -16.089 68.680 4.996 1.00 44.17 C ATOM 1838 O ASN A 250 -16.650 67.769 4.374 1.00 44.07 O ATOM 1839 CB ASN A 250 -15.730 70.287 3.082 1.00 44.83 C ATOM 1840 CG ASN A 250 -17.028 71.035 3.421 1.00 47.50 C ATOM 1841 OD1 ASN A 250 -17.437 71.135 4.575 1.00 50.01 O ATOM 1842 ND2 ASN A 250 -17.679 71.565 2.388 1.00 55.54 N ATOM 1843 HD22 ASN A 250 -17.301 71.459 1.425 1.00 0.00 H ATOM 1844 HD21 ASN A 250 -18.566 72.085 2.544 1.00 0.00 H ATOM 1845 H ASN A 250 -13.916 68.469 2.860 1.00 0.00 H ATOM 1846 N VAL A 251 -16.341 68.941 6.286 1.00 41.09 N ATOM 1847 CA VAL A 251 -17.241 68.077 7.060 1.00 42.22 C ATOM 1848 C VAL A 251 -18.711 68.353 6.779 1.00 40.10 C ATOM 1849 O VAL A 251 -19.564 67.526 7.132 1.00 38.63 O ATOM 1850 CB VAL A 251 -16.999 68.185 8.582 1.00 42.50 C ATOM 1851 CG1 VAL A 251 -15.515 68.065 8.889 1.00 41.41 C ATOM 1852 CG2 VAL A 251 -17.581 69.475 9.162 1.00 41.44 C ATOM 1853 H VAL A 251 -15.895 69.762 6.743 1.00 0.00 H ATOM 1854 N ASP A 252 -19.028 69.472 6.125 1.00 40.97 N ATOM 1855 CA ASP A 252 -20.409 69.831 5.820 1.00 46.44 C ATOM 1856 C ASP A 252 -20.851 69.492 4.398 1.00 47.08 C ATOM 1857 O ASP A 252 -22.061 69.392 4.166 1.00 45.94 O ATOM 1858 CB ASP A 252 -20.625 71.328 6.048 1.00 46.23 C ATOM 1859 CG ASP A 252 -20.593 71.702 7.512 1.00 44.09 C ATOM 1860 OD1 ASP A 252 -21.134 70.925 8.329 1.00 44.58 O ATOM 1861 OD2 ASP A 252 -20.038 72.774 7.828 1.00 43.26 O ATOM 1862 H ASP A 252 -18.265 70.110 5.822 1.00 0.00 H ATOM 1863 N ALA A 253 -19.921 69.340 3.447 1.00 43.93 N ATOM 1864 CA ALA A 253 -20.273 69.015 2.063 1.00 44.13 C ATOM 1865 C ALA A 253 -21.173 67.786 1.988 1.00 45.11 C ATOM 1866 O ALA A 253 -20.865 66.745 2.575 1.00 43.74 O ATOM 1867 CB ALA A 253 -19.000 68.780 1.251 1.00 46.36 C ATOM 1868 H ALA A 253 -18.919 69.456 3.699 1.00 0.00 H ATOM 1869 N GLN A 254 -22.287 67.903 1.258 1.00 46.54 N ATOM 1870 CA GLN A 254 -23.333 66.882 1.292 1.00 46.45 C ATOM 1871 C GLN A 254 -23.271 65.961 0.077 1.00 43.97 C ATOM 1872 O GLN A 254 -22.910 66.374 -1.025 1.00 42.39 O ATOM 1873 CB GLN A 254 -24.728 67.515 1.370 1.00 44.97 C ATOM 1874 CG GLN A 254 -24.772 68.850 2.085 1.00 45.30 C ATOM 1875 CD GLN A 254 -26.131 69.536 1.983 1.00 51.19 C ATOM 1876 OE1 GLN A 254 -27.147 68.909 1.658 1.00 48.79 O ATOM 1877 NE2 GLN A 254 -26.151 70.832 2.266 1.00 51.57 N ATOM 1878 HE22 GLN A 254 -25.272 71.319 2.535 1.00 0.00 H ATOM 1879 HE21 GLN A 254 -27.045 71.361 2.219 1.00 0.00 H ATOM 1880 H GLN A 254 -22.412 68.739 0.652 1.00 0.00 H ATOM 1881 N ASN A 255 -23.660 64.705 0.288 1.00 46.97 N ATOM 1882 CA ASN A 255 -23.667 63.715 -0.778 1.00 44.35 C ATOM 1883 C ASN A 255 -24.994 63.799 -1.536 1.00 44.33 C ATOM 1884 O ASN A 255 -25.695 64.813 -1.482 1.00 43.98 O ATOM 1885 CB ASN A 255 -23.416 62.317 -0.207 1.00 40.94 C ATOM 1886 CG ASN A 255 -24.444 61.925 0.827 1.00 45.82 C ATOM 1887 OD1 ASN A 255 -25.439 62.628 1.020 1.00 44.71 O ATOM 1888 ND2 ASN A 255 -24.213 60.800 1.506 1.00 45.89 N ATOM 1889 HD22 ASN A 255 -23.360 60.239 1.309 1.00 0.00 H ATOM 1890 HD21 ASN A 255 -24.886 60.484 2.233 1.00 0.00 H ATOM 1891 H ASN A 255 -23.967 64.424 1.241 1.00 0.00 H ATOM 1892 N ILE A 256 -25.361 62.725 -2.236 1.00 45.32 N ATOM 1893 CA ILE A 256 -26.519 62.793 -3.119 1.00 49.31 C ATOM 1894 C ILE A 256 -27.818 62.737 -2.335 1.00 49.30 C ATOM 1895 O ILE A 256 -28.848 63.204 -2.834 1.00 51.52 O ATOM 1896 CB ILE A 256 -26.465 61.687 -4.191 1.00 45.30 C ATOM 1897 CG1 ILE A 256 -27.324 62.080 -5.393 1.00 46.83 C ATOM 1898 CG2 ILE A 256 -26.896 60.334 -3.625 1.00 42.93 C ATOM 1899 CD1 ILE A 256 -27.131 63.523 -5.838 1.00 46.83 C ATOM 1900 H ILE A 256 -24.822 61.840 -2.152 1.00 0.00 H ATOM 1901 N LYS A 257 -27.797 62.190 -1.121 1.00 47.12 N ATOM 1902 CA LYS A 257 -28.933 62.263 -0.219 1.00 42.18 C ATOM 1903 C LYS A 257 -28.887 63.493 0.674 1.00 44.13 C ATOM 1904 O LYS A 257 -29.644 63.559 1.646 1.00 44.53 O ATOM 1905 CB LYS A 257 -29.008 61.019 0.672 1.00 44.87 C ATOM 1906 CG LYS A 257 -28.836 59.684 -0.013 1.00 45.15 C ATOM 1907 CD LYS A 257 -29.167 58.579 0.983 1.00 42.59 C ATOM 1908 CE LYS A 257 -28.200 57.419 0.898 1.00 47.26 C ATOM 1909 NZ LYS A 257 -28.146 56.663 2.185 1.00 53.94 N ATOM 1910 HZ1 LYS A 257 -27.835 57.299 2.947 1.00 0.00 H ATOM 1911 HZ2 LYS A 257 -29.091 56.291 2.407 1.00 0.00 H ATOM 1912 HZ3 LYS A 257 -27.474 55.874 2.094 1.00 0.00 H ATOM 1913 H LYS A 257 -26.938 61.694 -0.808 1.00 0.00 H ATOM 1914 N GLY A 258 -27.992 64.443 0.404 1.00 45.27 N ATOM 1915 CA GLY A 258 -27.917 65.633 1.237 1.00 44.48 C ATOM 1916 C GLY A 258 -27.369 65.440 2.638 1.00 46.40 C ATOM 1917 O GLY A 258 -27.503 66.350 3.461 1.00 44.25 O ATOM 1918 H GLY A 258 -27.346 64.333 -0.404 1.00 0.00 H ATOM 1919 N GLU A 259 -26.766 64.287 2.941 1.00 44.45 N ATOM 1920 CA GLU A 259 -26.076 64.062 4.209 1.00 42.55 C ATOM 1921 C GLU A 259 -24.617 64.486 4.093 1.00 45.86 C ATOM 1922 O GLU A 259 -23.911 64.049 3.175 1.00 47.89 O ATOM 1923 CB GLU A 259 -26.124 62.592 4.613 1.00 41.31 C ATOM 1924 CG GLU A 259 -27.495 61.990 4.718 1.00 39.82 C ATOM 1925 CD GLU A 259 -27.459 60.496 4.512 1.00 46.27 C ATOM 1926 OE1 GLU A 259 -26.535 60.012 3.810 1.00 47.31 O ATOM 1927 OE2 GLU A 259 -28.346 59.801 5.059 1.00 52.38 O ATOM 1928 H GLU A 259 -26.789 63.516 2.244 1.00 0.00 H ATOM 1929 N SER A 260 -24.172 65.331 5.021 1.00 39.74 N ATOM 1930 CA SER A 260 -22.759 65.632 5.191 1.00 39.88 C ATOM 1931 C SER A 260 -22.053 64.502 5.944 1.00 37.73 C ATOM 1932 O SER A 260 -22.675 63.578 6.479 1.00 37.08 O ATOM 1933 CB SER A 260 -22.575 66.937 5.963 1.00 42.86 C ATOM 1934 OG SER A 260 -22.774 66.727 7.359 1.00 40.18 O ATOM 1935 HG SER A 260 -23.692 66.389 7.513 1.00 0.00 H ATOM 1936 H SER A 260 -24.861 65.793 5.648 1.00 0.00 H ATOM 1937 N ALA A 261 -20.724 64.600 6.010 1.00 38.57 N ATOM 1938 CA ALA A 261 -19.969 63.637 6.805 1.00 37.77 C ATOM 1939 C ALA A 261 -20.278 63.795 8.295 1.00 40.99 C ATOM 1940 O ALA A 261 -20.334 62.803 9.034 1.00 37.22 O ATOM 1941 CB ALA A 261 -18.470 63.785 6.538 1.00 30.16 C ATOM 1942 H ALA A 261 -20.229 65.358 5.498 1.00 0.00 H ATOM 1943 N LEU A 262 -20.479 65.034 8.755 1.00 39.70 N ATOM 1944 CA LEU A 262 -20.937 65.227 10.125 1.00 39.65 C ATOM 1945 C LEU A 262 -22.284 64.560 10.335 1.00 36.89 C ATOM 1946 O LEU A 262 -22.509 63.905 11.360 1.00 42.57 O ATOM 1947 CB LEU A 262 -21.006 66.718 10.460 1.00 41.25 C ATOM 1948 CG LEU A 262 -21.327 67.135 11.902 1.00 42.80 C ATOM 1949 CD1 LEU A 262 -20.654 66.232 12.939 1.00 41.43 C ATOM 1950 CD2 LEU A 262 -20.917 68.582 12.115 1.00 46.28 C ATOM 1951 H LEU A 262 -20.310 65.855 8.139 1.00 0.00 H ATOM 1952 N ASP A 263 -23.185 64.686 9.360 1.00 39.08 N ATOM 1953 CA ASP A 263 -24.494 64.052 9.499 1.00 41.62 C ATOM 1954 C ASP A 263 -24.345 62.548 9.683 1.00 41.11 C ATOM 1955 O ASP A 263 -25.006 61.950 10.543 1.00 38.02 O ATOM 1956 CB ASP A 263 -25.371 64.359 8.280 1.00 45.72 C ATOM 1957 CG ASP A 263 -25.879 65.807 8.254 1.00 47.71 C ATOM 1958 OD1 ASP A 263 -26.253 66.338 9.328 1.00 45.68 O ATOM 1959 OD2 ASP A 263 -25.911 66.407 7.147 1.00 49.19 O ATOM 1960 H ASP A 263 -22.957 65.233 8.505 1.00 0.00 H ATOM 1961 N LEU A 264 -23.469 61.926 8.885 1.00 39.57 N ATOM 1962 CA LEU A 264 -23.243 60.490 8.991 1.00 37.62 C ATOM 1963 C LEU A 264 -22.658 60.139 10.343 1.00 38.54 C ATOM 1964 O LEU A 264 -23.033 59.123 10.940 1.00 40.90 O ATOM 1965 CB LEU A 264 -22.311 60.010 7.878 1.00 37.51 C ATOM 1966 CG LEU A 264 -22.895 59.952 6.463 1.00 40.02 C ATOM 1967 CD1 LEU A 264 -21.785 59.696 5.431 1.00 36.44 C ATOM 1968 CD2 LEU A 264 -24.005 58.894 6.372 1.00 39.33 C ATOM 1969 H LEU A 264 -22.941 62.476 8.178 1.00 0.00 H ATOM 1970 N ALA A 265 -21.731 60.969 10.837 1.00 39.20 N ATOM 1971 CA ALA A 265 -21.178 60.775 12.178 1.00 40.34 C ATOM 1972 C ALA A 265 -22.272 60.836 13.234 1.00 35.38 C ATOM 1973 O ALA A 265 -22.417 59.922 14.051 1.00 37.99 O ATOM 1974 CB ALA A 265 -20.100 61.825 12.458 1.00 36.22 C ATOM 1975 H ALA A 265 -21.398 61.766 10.258 1.00 0.00 H ATOM 1976 N LYS A 266 -23.064 61.907 13.222 1.00 39.70 N ATOM 1977 CA LYS A 266 -24.194 62.000 14.139 1.00 37.30 C ATOM 1978 C LYS A 266 -25.116 60.802 13.990 1.00 36.80 C ATOM 1979 O LYS A 266 -25.600 60.254 14.983 1.00 38.66 O ATOM 1980 CB LYS A 266 -24.955 63.302 13.898 1.00 36.29 C ATOM 1981 CG LYS A 266 -24.154 64.549 14.239 1.00 39.90 C ATOM 1982 CD LYS A 266 -24.854 65.808 13.769 1.00 42.08 C ATOM 1983 CE LYS A 266 -24.212 67.034 14.376 1.00 44.93 C ATOM 1984 NZ LYS A 266 -24.531 68.233 13.555 1.00 44.98 N ATOM 1985 HZ1 LYS A 266 -24.168 68.097 12.590 1.00 0.00 H ATOM 1986 HZ2 LYS A 266 -25.562 68.366 13.523 1.00 0.00 H ATOM 1987 HZ3 LYS A 266 -24.085 69.071 13.980 1.00 0.00 H ATOM 1988 H LYS A 266 -22.875 62.682 12.554 1.00 0.00 H ATOM 1989 N GLN A 267 -25.346 60.363 12.753 1.00 38.02 N ATOM 1990 CA GLN A 267 -26.205 59.207 12.521 1.00 40.41 C ATOM 1991 C GLN A 267 -25.705 57.988 13.282 1.00 43.24 C ATOM 1992 O GLN A 267 -26.481 57.304 13.963 1.00 40.21 O ATOM 1993 CB GLN A 267 -26.280 58.903 11.025 1.00 42.98 C ATOM 1994 CG GLN A 267 -27.327 59.690 10.264 1.00 43.48 C ATOM 1995 CD GLN A 267 -27.394 59.277 8.809 1.00 52.22 C ATOM 1996 OE1 GLN A 267 -27.260 58.092 8.488 1.00 48.18 O ATOM 1997 NE2 GLN A 267 -27.583 60.253 7.915 1.00 50.57 N ATOM 1998 HE22 GLN A 267 -27.691 61.237 8.234 1.00 0.00 H ATOM 1999 HE21 GLN A 267 -27.622 60.028 6.900 1.00 0.00 H ATOM 2000 H GLN A 267 -24.909 60.850 11.945 1.00 0.00 H ATOM 2001 N ARG A 268 -24.406 57.696 13.171 1.00 43.91 N ATOM 2002 CA ARG A 268 -23.821 56.511 13.786 1.00 42.76 C ATOM 2003 C ARG A 268 -23.607 56.669 15.294 1.00 46.41 C ATOM 2004 O ARG A 268 -23.038 55.767 15.921 1.00 47.72 O ATOM 2005 CB ARG A 268 -22.505 56.159 13.071 1.00 38.80 C ATOM 2006 H ARG A 268 -23.792 58.336 12.628 1.00 0.00 H ATOM 2007 N LYS A 269 -24.054 57.784 15.887 1.00 44.55 N ATOM 2008 CA LYS A 269 -23.999 58.006 17.334 1.00 44.22 C ATOM 2009 C LYS A 269 -22.589 57.802 17.893 1.00 47.25 C ATOM 2010 O LYS A 269 -22.418 57.396 19.047 1.00 50.19 O ATOM 2011 CB LYS A 269 -25.010 57.115 18.066 1.00 43.57 C ATOM 2012 H LYS A 269 -24.461 58.531 15.289 1.00 0.00 H ATOM 2013 N ASN A 270 -21.564 58.088 17.083 1.00 40.98 N ATOM 2014 CA ASN A 270 -20.170 57.861 17.472 1.00 38.58 C ATOM 2015 C ASN A 270 -19.605 59.154 18.059 1.00 42.18 C ATOM 2016 O ASN A 270 -19.237 60.077 17.327 1.00 41.43 O ATOM 2017 CB ASN A 270 -19.365 57.384 16.271 1.00 41.91 C ATOM 2018 CG ASN A 270 -17.928 57.035 16.617 1.00 44.85 C ATOM 2019 OD1 ASN A 270 -17.324 57.607 17.525 1.00 45.96 O ATOM 2020 ND2 ASN A 270 -17.366 56.092 15.874 1.00 49.01 N ATOM 2021 HD22 ASN A 270 -17.911 55.633 15.116 1.00 0.00 H ATOM 2022 HD21 ASN A 270 -16.380 55.811 16.049 1.00 0.00 H ATOM 2023 H ASN A 270 -21.764 58.486 16.143 1.00 0.00 H ATOM 2024 N VAL A 271 -19.489 59.203 19.389 1.00 44.21 N ATOM 2025 CA VAL A 271 -19.144 60.451 20.073 1.00 42.68 C ATOM 2026 C VAL A 271 -17.782 60.972 19.607 1.00 40.87 C ATOM 2027 O VAL A 271 -17.615 62.169 19.323 1.00 33.06 O ATOM 2028 CB VAL A 271 -19.193 60.244 21.600 1.00 41.13 C ATOM 2029 CG1 VAL A 271 -18.363 61.284 22.307 1.00 40.14 C ATOM 2030 CG2 VAL A 271 -20.639 60.286 22.093 1.00 38.48 C ATOM 2031 H VAL A 271 -19.646 58.340 19.948 1.00 0.00 H ATOM 2032 N TRP A 272 -16.786 60.084 19.524 1.00 38.23 N ATOM 2033 CA TRP A 272 -15.453 60.494 19.086 1.00 39.62 C ATOM 2034 C TRP A 272 -15.503 61.125 17.696 1.00 42.79 C ATOM 2035 O TRP A 272 -14.912 62.186 17.459 1.00 43.84 O ATOM 2036 CB TRP A 272 -14.498 59.293 19.103 1.00 43.65 C ATOM 2037 CG TRP A 272 -13.091 59.656 18.748 1.00 43.42 C ATOM 2038 CD1 TRP A 272 -12.080 59.951 19.610 1.00 42.91 C ATOM 2039 CD2 TRP A 272 -12.549 59.797 17.431 1.00 44.46 C ATOM 2040 NE1 TRP A 272 -10.935 60.255 18.914 1.00 44.32 N ATOM 2041 CE2 TRP A 272 -11.199 60.171 17.572 1.00 45.06 C ATOM 2042 CE3 TRP A 272 -13.072 59.628 16.146 1.00 41.09 C ATOM 2043 CZ2 TRP A 272 -10.364 60.391 16.475 1.00 42.88 C ATOM 2044 CZ3 TRP A 272 -12.238 59.852 15.054 1.00 47.25 C ATOM 2045 CH2 TRP A 272 -10.900 60.228 15.228 1.00 44.49 C ATOM 2046 HE1 TRP A 272 -10.019 60.507 19.336 1.00 0.00 H ATOM 2047 H TRP A 272 -16.962 59.090 19.774 1.00 0.00 H ATOM 2048 N MET A 273 -16.223 60.490 16.767 1.00 42.95 N ATOM 2049 CA MET A 273 -16.316 61.021 15.411 1.00 40.89 C ATOM 2050 C MET A 273 -17.032 62.367 15.379 1.00 40.32 C ATOM 2051 O MET A 273 -16.594 63.288 14.680 1.00 40.91 O ATOM 2052 CB MET A 273 -17.026 60.018 14.497 1.00 41.90 C ATOM 2053 CG MET A 273 -16.089 59.192 13.638 1.00 45.52 C ATOM 2054 SD MET A 273 -16.865 57.714 12.928 1.00 58.55 S ATOM 2055 CE MET A 273 -18.581 58.202 12.898 1.00 50.03 C ATOM 2056 H MET A 273 -16.721 59.611 17.012 1.00 0.00 H ATOM 2057 N ILE A 274 -18.139 62.505 16.110 1.00 39.63 N ATOM 2058 CA ILE A 274 -18.863 63.772 16.070 1.00 36.85 C ATOM 2059 C ILE A 274 -17.995 64.894 16.613 1.00 37.92 C ATOM 2060 O ILE A 274 -17.935 65.983 16.036 1.00 37.67 O ATOM 2061 CB ILE A 274 -20.189 63.672 16.836 1.00 40.30 C ATOM 2062 CG1 ILE A 274 -21.042 62.533 16.285 1.00 40.73 C ATOM 2063 CG2 ILE A 274 -20.940 64.995 16.756 1.00 39.92 C ATOM 2064 CD1 ILE A 274 -22.241 62.245 17.131 1.00 37.52 C ATOM 2065 H ILE A 274 -18.482 61.721 16.701 1.00 0.00 H ATOM 2066 N ASN A 275 -17.294 64.645 17.720 1.00 40.10 N ATOM 2067 CA ASN A 275 -16.457 65.690 18.305 1.00 43.16 C ATOM 2068 C ASN A 275 -15.350 66.111 17.342 1.00 43.15 C ATOM 2069 O ASN A 275 -15.136 67.309 17.100 1.00 44.75 O ATOM 2070 CB ASN A 275 -15.867 65.210 19.636 1.00 41.61 C ATOM 2071 CG ASN A 275 -14.938 66.233 20.257 1.00 42.53 C ATOM 2072 OD1 ASN A 275 -15.382 67.254 20.792 1.00 43.66 O ATOM 2073 ND2 ASN A 275 -13.639 65.979 20.169 1.00 45.62 N ATOM 2074 HD22 ASN A 275 -13.310 65.106 19.710 1.00 0.00 H ATOM 2075 HD21 ASN A 275 -12.950 66.653 20.559 1.00 0.00 H ATOM 2076 H ASN A 275 -17.343 63.707 18.167 1.00 0.00 H ATOM 2077 N HIS A 276 -14.649 65.129 16.770 1.00 41.69 N ATOM 2078 CA HIS A 276 -13.501 65.412 15.912 1.00 42.59 C ATOM 2079 C HIS A 276 -13.908 66.198 14.664 1.00 46.81 C ATOM 2080 O HIS A 276 -13.196 67.124 14.244 1.00 45.59 O ATOM 2081 CB HIS A 276 -12.819 64.092 15.541 1.00 47.19 C ATOM 2082 CG HIS A 276 -11.322 64.167 15.460 1.00 53.97 C ATOM 2083 ND1 HIS A 276 -10.648 64.364 14.271 1.00 52.62 N ATOM 2084 CD2 HIS A 276 -10.368 64.047 16.416 1.00 53.58 C ATOM 2085 CE1 HIS A 276 -9.346 64.370 14.496 1.00 50.18 C ATOM 2086 NE2 HIS A 276 -9.150 64.186 15.791 1.00 61.03 N ATOM 2087 H HIS A 276 -14.926 64.141 16.939 1.00 0.00 H ATOM 2088 N LEU A 277 -15.053 65.846 14.056 1.00 44.19 N ATOM 2089 CA LEU A 277 -15.514 66.564 12.867 1.00 45.27 C ATOM 2090 C LEU A 277 -15.991 67.964 13.223 1.00 46.20 C ATOM 2091 O LEU A 277 -15.693 68.930 12.508 1.00 48.41 O ATOM 2092 CB LEU A 277 -16.637 65.794 12.165 1.00 41.23 C ATOM 2093 CG LEU A 277 -16.334 64.494 11.419 1.00 37.63 C ATOM 2094 CD1 LEU A 277 -17.371 64.246 10.326 1.00 41.63 C ATOM 2095 CD2 LEU A 277 -14.963 64.520 10.822 1.00 38.90 C ATOM 2096 H LEU A 277 -15.616 65.057 14.433 1.00 0.00 H ATOM 2097 N GLN A 278 -16.744 68.085 14.320 1.00 44.46 N ATOM 2098 CA GLN A 278 -17.249 69.387 14.741 1.00 48.75 C ATOM 2099 C GLN A 278 -16.110 70.356 15.012 1.00 49.55 C ATOM 2100 O GLN A 278 -16.187 71.533 14.644 1.00 52.03 O ATOM 2101 CB GLN A 278 -18.138 69.232 15.976 1.00 45.14 C ATOM 2102 CG GLN A 278 -19.615 69.321 15.642 1.00 46.21 C ATOM 2103 CD GLN A 278 -20.522 68.784 16.735 1.00 48.17 C ATOM 2104 OE1 GLN A 278 -20.074 68.436 17.834 1.00 43.92 O ATOM 2105 NE2 GLN A 278 -21.812 68.702 16.428 1.00 47.11 N ATOM 2106 HE22 GLN A 278 -22.144 69.007 15.491 1.00 0.00 H ATOM 2107 HE21 GLN A 278 -22.490 68.333 17.125 1.00 0.00 H ATOM 2108 H GLN A 278 -16.973 67.240 14.881 1.00 0.00 H ATOM 2109 N GLU A 279 -15.033 69.878 15.619 1.00 49.57 N ATOM 2110 CA GLU A 279 -13.931 70.772 15.923 1.00 50.51 C ATOM 2111 C GLU A 279 -13.055 71.080 14.716 1.00 52.96 C ATOM 2112 O GLU A 279 -12.042 71.769 14.874 1.00 58.52 O ATOM 2113 CB GLU A 279 -13.108 70.195 17.069 1.00 50.66 C ATOM 2114 CG GLU A 279 -13.832 70.346 18.384 1.00 50.47 C ATOM 2115 CD GLU A 279 -12.968 69.997 19.571 1.00 62.20 C ATOM 2116 OE1 GLU A 279 -12.511 68.833 19.647 1.00 61.87 O ATOM 2117 OE2 GLU A 279 -12.746 70.883 20.433 1.00 63.70 O ATOM 2118 H GLU A 279 -14.978 68.872 15.875 1.00 0.00 H ATOM 2119 N ALA A 280 -13.420 70.620 13.518 1.00 53.42 N ATOM 2120 CA ALA A 280 -12.678 70.957 12.311 1.00 50.34 C ATOM 2121 C ALA A 280 -13.378 72.015 11.467 1.00 55.92 C ATOM 2122 O ALA A 280 -13.058 72.157 10.282 1.00 63.71 O ATOM 2123 CB ALA A 280 -12.418 69.706 11.471 1.00 46.57 C ATOM 2124 H ALA A 280 -14.256 70.005 13.444 1.00 0.00 H ATOM 2125 N ARG A 281 -14.327 72.754 12.042 1.00 59.01 N ATOM 2126 CA ARG A 281 -14.930 73.898 11.345 1.00 54.97 C ATOM 2127 C ARG A 281 -14.475 75.219 11.963 1.00 56.86 C ATOM 2128 O ARG A 281 -14.293 75.319 13.180 1.00 63.34 O ATOM 2129 CB ARG A 281 -16.455 73.814 11.366 1.00 47.69 C ATOM 2130 CG ARG A 281 -16.992 72.410 11.425 1.00 48.48 C ATOM 2131 CD ARG A 281 -18.337 72.381 12.120 1.00 53.63 C ATOM 2132 NE ARG A 281 -19.436 72.682 11.208 1.00 55.01 N ATOM 2133 CZ ARG A 281 -20.720 72.457 11.484 1.00 59.79 C ATOM 2134 NH1 ARG A 281 -21.655 72.760 10.585 1.00 58.73 N ATOM 2135 NH2 ARG A 281 -21.073 71.926 12.658 1.00 55.11 N ATOM 2136 HE ARG A 281 -19.202 73.098 10.284 1.00 0.00 H ATOM 2137 HH12 ARG A 281 -22.658 72.585 10.798 1.00 0.00 H ATOM 2138 HH11 ARG A 281 -21.382 73.171 9.670 1.00 0.00 H ATOM 2139 HH22 ARG A 281 -22.076 71.752 12.869 1.00 0.00 H ATOM 2140 HH21 ARG A 281 -20.344 71.687 13.361 1.00 0.00 H ATOM 2141 H ARG A 281 -14.647 72.516 13.003 1.00 0.00 H TER 2142 ARG A 281 HETATM 2143 O HOH 1 6.927 41.452 -6.185 1.00 41.51 O HETATM 2144 O HOH 2 -15.027 46.260 -0.464 1.00 41.76 O HETATM 2145 O HOH 3 11.366 43.846 -13.944 1.00 39.02 O HETATM 2146 O HOH 4 0.711 60.448 -11.785 1.00 28.83 O HETATM 2147 O HOH 5 9.789 35.162 -8.510 1.00 34.56 O HETATM 2148 O HOH 6 -9.072 42.494 -10.561 1.00 27.37 O HETATM 2149 O HOH 7 -13.191 63.026 -1.648 1.00 36.57 O HETATM 2150 O HOH 8 -23.024 69.933 14.522 1.00 53.85 O HETATM 2151 O HOH 9 -9.183 33.814 -19.954 1.00 39.28 O HETATM 2152 O HOH 10 -19.213 66.111 4.340 1.00 40.68 O HETATM 2153 O HOH 11 -13.987 31.283 -13.004 1.00 45.38 O HETATM 2154 O HOH 12 9.562 26.198 -24.658 1.00 49.11 O HETATM 2155 O HOH 13 -0.952 28.858 -28.776 1.00 49.67 O HETATM 2156 O HOH 14 2.848 48.625 -19.628 1.00 29.04 O HETATM 2157 O HOH 15 -1.237 22.991 -2.817 1.00 38.73 O HETATM 2158 O HOH 16 0.321 62.979 3.530 1.00 37.80 O HETATM 2159 O HOH 17 -11.635 44.128 -2.757 1.00 42.97 O HETATM 2160 O HOH 18 -11.829 68.795 -3.452 1.00 42.85 O HETATM 2161 O HOH 19 -4.868 48.290 -23.430 1.00 27.33 O HETATM 2162 O HOH 20 -3.153 29.547 -20.196 1.00 34.09 O HETATM 2163 O HOH 21 3.416 36.735 -25.629 1.00 33.25 O HETATM 2164 O HOH 22 5.879 40.176 -3.266 1.00 33.14 O HETATM 2165 O HOH 23 -5.079 54.335 4.216 1.00 30.43 O HETATM 2166 O HOH 24 -22.753 70.171 0.112 1.00 47.94 O HETATM 2167 O HOH 25 -4.498 28.189 -15.905 1.00 36.51 O HETATM 2168 O HOH 26 7.357 48.520 -15.338 1.00 32.66 O HETATM 2169 O HOH 27 1.792 43.386 -23.921 1.00 34.85 O HETATM 2170 O HOH 28 -1.712 41.691 -17.501 1.00 23.08 O HETATM 2171 O HOH 29 6.838 52.442 -5.167 1.00 27.02 O HETATM 2172 O HOH 30 -7.354 59.522 -4.763 1.00 31.88 O HETATM 2173 O HOH 31 2.782 47.356 -2.198 1.00 30.29 O HETATM 2174 O HOH 32 -3.041 67.050 0.617 1.00 41.42 O HETATM 2175 O HOH 33 -10.162 45.953 3.865 1.00 30.68 O HETATM 2176 O HOH 34 -8.405 45.521 1.729 1.00 36.93 O HETATM 2177 O HOH 35 -24.472 67.804 10.674 1.00 44.30 O HETATM 2178 O HOH 36 -15.909 42.747 -4.153 1.00 34.82 O HETATM 2179 O HOH 37 13.230 32.021 -10.495 1.00 29.03 O HETATM 2180 O HOH 38 6.576 29.773 -3.037 1.00 30.81 O HETATM 2181 O HOH 39 -9.375 39.204 -22.914 1.00 31.42 O HETATM 2182 O HOH 40 -1.436 48.482 4.108 1.00 36.73 O HETATM 2183 O HOH 41 -25.913 57.335 3.577 1.00 41.86 O HETATM 2184 O HOH 42 -3.198 64.401 6.830 1.00 45.56 O HETATM 2185 O HOH 43 -2.409 34.900 -20.656 1.00 27.03 O HETATM 2186 O HOH 44 -0.234 40.006 -25.250 1.00 31.18 O HETATM 2187 O HOH 45 -3.751 44.916 -17.092 1.00 25.87 O HETATM 2188 O HOH 46 -0.891 19.782 -16.802 1.00 36.32 O HETATM 2189 O HOH 47 -10.361 37.419 -12.329 1.00 27.58 O HETATM 2190 O HOH 48 -15.030 65.905 2.632 1.00 35.90 O HETATM 2191 O HOH 49 9.965 51.122 -13.681 1.00 34.70 O HETATM 2192 O HOH 50 -13.110 35.756 -17.440 1.00 40.59 O HETATM 2193 O HOH 51 -3.986 23.853 -7.873 1.00 42.50 O HETATM 2194 O HOH 52 4.268 55.298 -18.432 1.00 42.82 O HETATM 2195 O HOH 53 5.823 43.722 -3.452 1.00 34.76 O HETATM 2196 O HOH 54 -2.643 33.775 -22.904 1.00 30.81 O HETATM 2197 O HOH 55 0.989 45.441 1.200 1.00 38.87 O HETATM 2198 O HOH 56 -9.536 62.666 -3.941 1.00 35.32 O HETATM 2199 O HOH 57 -0.526 52.158 7.429 1.00 34.50 O HETATM 2200 O HOH 58 4.079 49.144 0.373 1.00 29.13 O HETATM 2201 O HOH 59 9.007 31.589 -11.972 1.00 27.18 O HETATM 2202 O HOH 60 -9.719 53.050 -16.925 1.00 32.71 O HETATM 2203 O HOH 61 -13.081 64.008 1.971 1.00 36.05 O HETATM 2204 O HOH 62 -13.136 43.398 -17.225 1.00 30.87 O HETATM 2205 O HOH 63 -0.350 17.406 -7.001 1.00 40.45 O HETATM 2206 O HOH 64 -4.782 52.336 -12.675 1.00 25.34 O HETATM 2207 O HOH 65 -12.614 42.381 -4.383 1.00 37.23 O HETATM 2208 O HOH 66 -9.140 39.587 -4.367 1.00 33.94 O HETATM 2209 O HOH 67 -25.429 59.176 -1.083 1.00 40.94 O HETATM 2210 O HOH 68 8.170 43.330 -4.945 1.00 34.40 O HETATM 2211 O HOH 69 -1.521 52.178 10.184 1.00 32.86 O HETATM 2212 O HOH 70 9.529 28.067 -6.613 1.00 21.63 O HETATM 2213 O HOH 71 10.682 43.662 -11.118 1.00 37.97 O HETATM 2214 O HOH 72 -0.821 32.368 -20.169 1.00 25.38 O HETATM 2215 O HOH 73 10.362 29.378 -11.524 1.00 29.91 O HETATM 2216 O HOH 74 -4.045 45.784 -23.370 1.00 22.44 O HETATM 2217 O HOH 75 -7.760 47.547 6.720 1.00 29.85 O HETATM 2218 O HOH 76 -3.824 48.423 5.154 1.00 28.78 O HETATM 2219 O HOH 77 9.037 29.673 -3.926 1.00 33.60 O HETATM 2220 O HOH 78 -2.259 41.606 -24.296 1.00 26.71 O HETATM 2221 O HOH 79 -0.996 44.063 -23.530 1.00 28.06 O HETATM 2222 O HOH 80 2.600 44.998 -0.924 1.00 39.53 O HETATM 2223 O HOH 81 -24.376 57.459 1.121 1.00 43.34 O HETATM 2224 O HOH 82 -6.070 47.389 8.673 1.00 35.03 O HETATM 2225 O HOH 83 3.796 57.200 2.981 1.00 37.81 O HETATM 2226 O HOH 84 -14.667 71.509 7.358 1.00 43.06 O HETATM 2227 O HOH 85 9.898 44.943 -5.720 1.00 38.84 O HETATM 2228 O HOH 86 -0.093 49.978 5.983 1.00 35.56 O HETATM 2229 O HOH 87 -1.216 62.765 5.582 1.00 37.96 O HETATM 2230 O HOH 88 -4.727 41.748 -24.901 1.00 30.10 O HETATM 2231 O HOH 89 1.975 41.583 -25.822 1.00 34.68 O HETATM 2232 O HOH 90 3.901 39.377 -26.041 1.00 33.68 O HETATM 2233 O HOH 91 -11.568 35.812 -10.337 1.00 31.78 O HETATM 2234 O HOH 92 3.549 33.036 0.420 1.00 30.93 O HETATM 2235 O HOH 93 -6.245 26.118 -8.264 1.00 40.35 O HETATM 2236 N GLY A 94 1.569 30.272 2.536 1.00 0.24 N HETATM 2237 CA GLY A 94 1.191 29.434 1.414 1.00 0.05 C HETATM 2238 C GLY A 94 1.249 30.147 0.073 1.00 0.22 C HETATM 2239 O GLY A 94 1.460 31.362 0.002 1.00 -0.39 O HETATM 2240 N GLY A 94 1.084 29.383 -0.999 1.00 -0.26 N HETATM 2241 CA GLY A 94 0.995 29.950 -2.330 1.00 0.13 C HETATM 2242 C GLY A 94 -0.471 30.249 -2.624 1.00 0.20 C HETATM 2243 O GLY A 94 -1.377 29.769 -1.934 1.00 -0.39 O HETATM 2244 N GLY A 94 -0.720 31.072 -3.639 1.00 -0.26 N HETATM 2245 CA GLY A 94 -2.087 31.418 -4.034 1.00 0.13 C HETATM 2246 C GLY A 94 -2.577 30.367 -5.021 1.00 0.20 C HETATM 2247 O GLY A 94 -2.062 30.264 -6.141 1.00 -0.39 O HETATM 2248 N GLY A 94 -3.577 29.584 -4.616 1.00 -0.26 N HETATM 2249 CA GLY A 94 -4.140 28.582 -5.513 1.00 0.13 C HETATM 2250 C GLY A 94 -5.641 28.750 -5.664 1.00 0.20 C HETATM 2251 O GLY A 94 -6.322 27.818 -6.098 1.00 -0.39 O HETATM 2252 N GLY A 94 -6.154 29.938 -5.331 1.00 -0.26 N HETATM 2253 CA GLY A 94 -7.559 30.292 -5.464 1.00 0.15 C HETATM 2254 C GLY A 94 -7.660 31.629 -6.178 1.00 0.21 C HETATM 2255 O GLY A 94 -6.918 32.557 -5.868 1.00 -0.39 O HETATM 2256 N GLY A 94 -8.592 31.742 -7.106 1.00 -0.26 N HETATM 2257 CA GLY A 94 -8.717 32.979 -7.856 1.00 0.13 C HETATM 2258 C GLY A 94 -9.326 34.089 -6.993 1.00 0.21 C HETATM 2259 O GLY A 94 -10.119 33.818 -6.091 1.00 -0.39 O HETATM 2260 N GLY A 94 -8.985 35.353 -7.270 1.00 -0.25 N HETATM 2261 CA GLY A 94 -9.611 36.471 -6.549 1.00 0.13 C HETATM 2262 C GLY A 94 -11.130 36.407 -6.623 1.00 0.20 C HETATM 2263 O GLY A 94 -11.702 36.042 -7.645 1.00 -0.39 O HETATM 2264 N GLY A 94 -11.791 36.768 -5.530 1.00 -0.26 N HETATM 2265 CA GLY A 94 -13.246 36.697 -5.476 1.00 0.13 C HETATM 2266 C GLY A 94 -13.833 38.021 -5.000 1.00 0.20 C HETATM 2267 O GLY A 94 -13.129 38.894 -4.481 1.00 -0.39 O HETATM 2268 N GLY A 94 -15.144 38.159 -5.204 1.00 -0.26 N HETATM 2269 CA GLY A 94 -15.899 39.270 -4.639 1.00 0.13 C HETATM 2270 C GLY A 94 -15.735 39.288 -3.119 1.00 0.20 C HETATM 2271 O GLY A 94 -15.473 38.261 -2.486 1.00 -0.39 O HETATM 2272 N GLY A 94 -15.851 40.473 -2.531 1.00 -0.27 N HETATM 2273 CA GLY A 94 -15.753 40.591 -1.084 1.00 0.10 C HETATM 2274 C GLY A 94 -17.054 40.104 -0.470 1.00 0.06 C HETATM 2275 O GLY A 94 -18.132 40.351 -1.014 1.00 -0.57 O HETATM 2276 OXT GLY A 94 -17.053 39.442 0.573 1.00 -0.57 O HETATM 2277 CB GLY A 94 -15.439 42.023 -0.648 1.00 -0.01 C HETATM 2278 CG1 GLY A 94 -15.485 42.128 0.867 1.00 -0.06 C HETATM 2279 H62 GLY A 94 -15.258 43.161 1.170 1.00 0.02 H HETATM 2280 H63 GLY A 94 -14.741 41.446 1.305 1.00 0.02 H HETATM 2281 H64 GLY A 94 -16.489 41.854 1.223 1.00 0.02 H HETATM 2282 CG2 GLY A 94 -14.071 42.435 -1.173 1.00 -0.06 C HETATM 2283 H65 GLY A 94 -14.059 42.352 -2.270 1.00 0.02 H HETATM 2284 H66 GLY A 94 -13.301 41.775 -0.747 1.00 0.02 H HETATM 2285 H67 GLY A 94 -13.865 43.475 -0.882 1.00 0.02 H HETATM 2286 H61 GLY A 94 -16.198 42.698 -1.071 1.00 0.03 H HETATM 2287 H60 GLY A 94 -14.935 39.943 -0.736 1.00 0.07 H HETATM 2288 H59 GLY A 94 -16.007 41.290 -3.086 1.00 0.19 H HETATM 2289 CB GLY A 94 -17.379 39.158 -5.024 1.00 -0.02 C HETATM 2290 H56 GLY A 94 -17.935 40.002 -4.591 1.00 0.03 H HETATM 2291 H57 GLY A 94 -17.788 38.213 -4.638 1.00 0.03 H HETATM 2292 H58 GLY A 94 -17.476 39.179 -6.120 1.00 0.03 H HETATM 2293 H55 GLY A 94 -15.502 40.211 -5.047 1.00 0.08 H HETATM 2294 H54 GLY A 94 -15.623 37.480 -5.761 1.00 0.19 H HETATM 2295 CB GLY A 94 -13.718 35.553 -4.572 1.00 -0.02 C HETATM 2296 H51 GLY A 94 -14.818 35.529 -4.555 1.00 0.03 H HETATM 2297 H52 GLY A 94 -13.339 35.712 -3.552 1.00 0.03 H HETATM 2298 H53 GLY A 94 -13.337 34.597 -4.961 1.00 0.03 H HETATM 2299 H50 GLY A 94 -13.615 36.503 -6.494 1.00 0.08 H HETATM 2300 H49 GLY A 94 -11.284 37.093 -4.732 1.00 0.19 H HETATM 2301 CB GLY A 94 -9.068 37.706 -7.274 1.00 -0.01 C HETATM 2302 CG GLY A 94 -7.769 37.265 -7.854 1.00 -0.03 C HETATM 2303 CD GLY A 94 -7.977 35.816 -8.240 1.00 0.04 C HETATM 2304 H47 GLY A 94 -8.353 35.732 -9.270 1.00 0.05 H HETATM 2305 H48 GLY A 94 -7.043 35.243 -8.142 1.00 0.05 H HETATM 2306 H45 GLY A 94 -6.964 37.354 -7.109 1.00 0.03 H HETATM 2307 H46 GLY A 94 -7.518 37.867 -8.739 1.00 0.03 H HETATM 2308 H43 GLY A 94 -8.915 38.535 -6.567 1.00 0.03 H HETATM 2309 H44 GLY A 94 -9.759 38.024 -8.068 1.00 0.03 H HETATM 2310 H42 GLY A 94 -9.303 36.473 -5.493 1.00 0.08 H HETATM 2311 CB GLY A 94 -9.579 32.746 -9.087 1.00 0.00 C HETATM 2312 CG GLY A 94 -10.970 32.237 -8.778 1.00 0.04 C HETATM 2313 CD GLY A 94 -11.845 32.161 -10.029 1.00 0.17 C HETATM 2314 OE1 GLY A 94 -11.995 33.149 -10.765 1.00 -0.40 O HETATM 2315 NE2 GLY A 94 -12.409 30.977 -10.288 1.00 -0.30 N HETATM 2316 H40 GLY A 94 -12.992 30.866 -11.093 1.00 0.18 H HETATM 2317 H41 GLY A 94 -12.248 30.202 -9.677 1.00 0.18 H HETATM 2318 H38 GLY A 94 -11.444 32.917 -8.054 1.00 0.05 H HETATM 2319 H39 GLY A 94 -10.890 31.232 -8.339 1.00 0.05 H HETATM 2320 H36 GLY A 94 -9.075 32.007 -9.727 1.00 0.03 H HETATM 2321 H37 GLY A 94 -9.672 33.699 -9.629 1.00 0.03 H HETATM 2322 H35 GLY A 94 -7.715 33.297 -8.179 1.00 0.08 H HETATM 2323 H34 GLY A 94 -9.210 30.978 -7.292 1.00 0.19 H HETATM 2324 CB GLY A 94 -8.240 30.411 -4.099 1.00 0.08 C HETATM 2325 OG GLY A 94 -7.729 29.452 -3.188 1.00 -0.39 O HETATM 2326 H33 GLY A 94 -8.167 29.547 -2.351 1.00 0.21 H HETATM 2327 H31 GLY A 94 -9.321 30.250 -4.222 1.00 0.06 H HETATM 2328 H32 GLY A 94 -8.063 31.419 -3.696 1.00 0.06 H HETATM 2329 H30 GLY A 94 -8.070 29.518 -6.055 1.00 0.08 H HETATM 2330 H29 GLY A 94 -5.531 30.630 -4.966 1.00 0.19 H HETATM 2331 CB GLY A 94 -3.806 27.167 -5.050 1.00 -0.02 C HETATM 2332 H26 GLY A 94 -4.245 26.439 -5.748 1.00 0.03 H HETATM 2333 H27 GLY A 94 -4.218 27.004 -4.043 1.00 0.03 H HETATM 2334 H28 GLY A 94 -2.714 27.038 -5.025 1.00 0.03 H HETATM 2335 H25 GLY A 94 -3.684 28.728 -6.503 1.00 0.08 H HETATM 2336 H24 GLY A 94 -3.943 29.685 -3.691 1.00 0.19 H HETATM 2337 CB GLY A 94 -2.177 32.817 -4.654 1.00 -0.01 C HETATM 2338 CG1 GLY A 94 -3.630 33.130 -4.983 1.00 -0.06 C HETATM 2339 H18 GLY A 94 -3.697 34.134 -5.428 1.00 0.02 H HETATM 2340 H19 GLY A 94 -4.230 33.097 -4.062 1.00 0.02 H HETATM 2341 H20 GLY A 94 -4.013 32.386 -5.697 1.00 0.02 H HETATM 2342 CG2 GLY A 94 -1.570 33.878 -3.723 1.00 -0.06 C HETATM 2343 H21 GLY A 94 -0.523 33.620 -3.507 1.00 0.02 H HETATM 2344 H22 GLY A 94 -2.141 33.911 -2.783 1.00 0.02 H HETATM 2345 H23 GLY A 94 -1.612 34.862 -4.212 1.00 0.02 H HETATM 2346 H17 GLY A 94 -1.602 32.819 -5.591 1.00 0.03 H HETATM 2347 H16 GLY A 94 -2.728 31.396 -3.140 1.00 0.08 H HETATM 2348 H15 GLY A 94 0.047 31.465 -4.146 1.00 0.19 H HETATM 2349 CB GLY A 94 1.622 28.999 -3.379 1.00 -0.01 C HETATM 2350 CG1 GLY A 94 3.005 28.571 -2.935 1.00 -0.06 C HETATM 2351 H9 GLY A 94 3.439 27.896 -3.688 1.00 0.02 H HETATM 2352 H10 GLY A 94 2.935 28.047 -1.970 1.00 0.02 H HETATM 2353 H11 GLY A 94 3.646 29.458 -2.825 1.00 0.02 H HETATM 2354 CG2 GLY A 94 0.776 27.781 -3.586 1.00 -0.06 C HETATM 2355 H12 GLY A 94 -0.231 28.084 -3.909 1.00 0.02 H HETATM 2356 H13 GLY A 94 0.705 27.219 -2.643 1.00 0.02 H HETATM 2357 H14 GLY A 94 1.232 27.145 -4.358 1.00 0.02 H HETATM 2358 H8 GLY A 94 1.704 29.538 -4.334 1.00 0.03 H HETATM 2359 H7 GLY A 94 1.556 30.896 -2.351 1.00 0.08 H HETATM 2360 H6 GLY A 94 1.019 28.392 -0.886 1.00 0.19 H HETATM 2361 H4 GLY A 94 0.162 29.081 1.575 1.00 0.11 H HETATM 2362 H5 GLY A 94 1.873 28.572 1.379 1.00 0.11 H HETATM 2363 H1 GLY A 94 1.508 29.739 3.389 1.00 0.20 H HETATM 2364 H2 GLY A 94 0.947 31.063 2.589 1.00 0.20 H HETATM 2365 H3 GLY A 94 2.515 30.597 2.409 1.00 0.20 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 2236 2237 2363 2364 2365 CONECT 2237 2236 2238 2361 2362 CONECT 2238 2237 2239 2240 CONECT 2239 2238 CONECT 2240 2238 2241 2360 CONECT 2241 2240 2242 2349 2359 CONECT 2242 2241 2243 2244 CONECT 2243 2242 CONECT 2244 2242 2245 2348 CONECT 2245 2244 2246 2337 2347 CONECT 2246 2245 2247 2248 CONECT 2247 2246 CONECT 2248 2246 2249 2336 CONECT 2249 2248 2250 2331 2335 CONECT 2250 2249 2251 2252 CONECT 2251 2250 CONECT 2252 2250 2253 2330 CONECT 2253 2252 2254 2324 2329 CONECT 2254 2253 2255 2256 CONECT 2255 2254 CONECT 2256 2254 2257 2323 CONECT 2257 2256 2258 2311 2322 CONECT 2258 2257 2259 2260 CONECT 2259 2258 CONECT 2260 2258 2261 2303 CONECT 2261 2260 2262 2301 2310 CONECT 2262 2261 2263 2264 CONECT 2263 2262 CONECT 2264 2262 2265 2300 CONECT 2265 2264 2266 2295 2299 CONECT 2266 2265 2267 2268 CONECT 2267 2266 CONECT 2268 2266 2269 2294 CONECT 2269 2268 2270 2289 2293 CONECT 2270 2269 2271 2272 CONECT 2271 2270 CONECT 2272 2270 2273 2288 CONECT 2273 2272 2274 2277 2287 CONECT 2274 2273 2275 2276 CONECT 2275 2274 CONECT 2276 2274 CONECT 2277 2273 2278 2282 2286 CONECT 2278 2277 2279 2280 2281 CONECT 2279 2278 CONECT 2280 2278 CONECT 2281 2278 CONECT 2282 2277 2283 2284 2285 CONECT 2283 2282 CONECT 2284 2282 CONECT 2285 2282 CONECT 2286 2277 CONECT 2287 2273 CONECT 2288 2272 CONECT 2289 2269 2290 2291 2292 CONECT 2290 2289 CONECT 2291 2289 CONECT 2292 2289 CONECT 2293 2269 CONECT 2294 2268 CONECT 2295 2265 2296 2297 2298 CONECT 2296 2295 CONECT 2297 2295 CONECT 2298 2295 CONECT 2299 2265 CONECT 2300 2264 CONECT 2301 2261 2302 2308 2309 CONECT 2302 2301 2303 2306 2307 CONECT 2303 2260 2302 2304 2305 CONECT 2304 2303 CONECT 2305 2303 CONECT 2306 2302 CONECT 2307 2302 CONECT 2308 2301 CONECT 2309 2301 CONECT 2310 2261 CONECT 2311 2257 2312 2320 2321 CONECT 2312 2311 2313 2318 2319 CONECT 2313 2312 2314 2315 CONECT 2314 2313 CONECT 2315 2313 2316 2317 CONECT 2316 2315 CONECT 2317 2315 CONECT 2318 2312 CONECT 2319 2312 CONECT 2320 2311 CONECT 2321 2311 CONECT 2322 2257 CONECT 2323 2256 CONECT 2324 2253 2325 2327 2328 CONECT 2325 2324 2326 CONECT 2326 2325 CONECT 2327 2324 CONECT 2328 2324 CONECT 2329 2253 CONECT 2330 2252 CONECT 2331 2249 2332 2333 2334 CONECT 2332 2331 CONECT 2333 2331 CONECT 2334 2331 CONECT 2335 2249 CONECT 2336 2248 CONECT 2337 2245 2338 2342 2346 CONECT 2338 2337 2339 2340 2341 CONECT 2339 2338 CONECT 2340 2338 CONECT 2341 2338 CONECT 2342 2337 2343 2344 2345 CONECT 2343 2342 CONECT 2344 2342 CONECT 2345 2342 CONECT 2346 2337 CONECT 2347 2245 CONECT 2348 2244 CONECT 2349 2241 2350 2354 2358 CONECT 2350 2349 2351 2352 2353 CONECT 2351 2350 CONECT 2352 2350 CONECT 2353 2350 CONECT 2354 2349 2355 2356 2357 CONECT 2355 2354 CONECT 2356 2354 CONECT 2357 2354 CONECT 2358 2349 CONECT 2359 2241 CONECT 2360 2240 CONECT 2361 2237 CONECT 2362 2237 CONECT 2363 2236 CONECT 2364 2236 CONECT 2365 2236 MASTER 0 0 0 0 0 0 0 0 2364 1 134 18 END
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RCSB PDB
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PDBbind
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RCSB PDB
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PDBbind
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PDBbind
10-mer
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RCSB PDB
PDBbind
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PDBbind
10-mer
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Entry Information
PDB ID
5w7i
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Palmitoyltransferase ZDHHC17
Ligand Name
10-mer
EC.Number
E.C.-.-.-.-
Resolution
2.11(Å)
Affinity (Kd/Ki/IC50)
Kd=11.2uM
Release Year
2017
Protein/NA Sequence
Check fasta file
Primary Reference
(2017) Structure Vol. 25: pp. 1337-1347.e6
Ligand Properties
Formula
C
3
9
H
6
8
N
1
1
O
1
3
Molecular Weight
899.023
Exact Mass
898.500
No. of atoms
131
No. of bonds
131
Polar Surface Area
381.37
LOGP Value
-3.81 (
Computed with XLOGP3
)
-1.77 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 11
No. of Hydrogen Bond Acceptors: 13
No. of Rotatable Bonds: 34
No. of Nitrogen and Oxygen Atoms: 24
No. of Rings: 1
Canonical SMILES
[NH3+]CC(=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)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)C)C)CCC(=O)N)CO)C)C(C)C)C(C)C
InChI String
InChI=1S/C39H67N11O13/c1-17(2)28(47-27(53)15-40)37(60)48-29(18(3)4)36(59)44-21(8)32(55)46-24(16-51)34(57)45-23(12-13-26(41)52)38(61)50-14-10-11-25(50)35(58)43-20(7)31(54)42-22(9)33(56)49-30(19(5)6)39(62)63/h17-25,28-30,51H,10-16,40H2,1-9H3,(H2,41,52)(H,42,54)(H,43,58)(H,44,59)(H,45,57)(H,46,55)(H,47,53)(H,48,60)(H,49,56)(H,62,63)/p+1/t20-,21-,22-,23-,24-,25-,28-,29-,30-/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):
Q8IUH5
P60880
Entrez Gene ID
NCBI Entrez Gene ID:
23390
6616
ASD
Information of known allosteric effects of PDB entries
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