Browse entries in the PDBbind-CN Database
HEADER 5TO8_COMPLEX COMPND 5TO8_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 45 ILE ALA ARG GLU ASP VAL VAL LEU ASN ARG ILE LEU GLY SEQRES 2 A 45 GLU GLY PHE PHE GLY GLU VAL TYR GLU GLY VAL TYR THR SEQRES 3 A 45 ASN HIS LYS GLY GLU LYS ILE ASN VAL ALA VAL LYS THR SEQRES 4 A 45 CYS LYS LYS ASP CYS THR SEQRES 1 A 28 ASN LYS GLU LYS PHE MET SER GLU ALA VAL ILE MET LYS SEQRES 2 A 28 ASN LEU ASP HIS PRO HIS ILE VAL LYS LEU ILE GLY ILE SEQRES 3 A 28 ILE GLU SEQRES 1 A 46 PRO THR TRP ILE ILE MET GLU LEU TYR PRO TYR GLY GLU SEQRES 2 A 46 LEU GLY HIS TYR LEU GLU ARG ASN LYS ASN SER LEU LYS SEQRES 3 A 46 VAL LEU THR LEU VAL LEU TYR SER LEU GLN ILE CYS LYS SEQRES 4 A 46 ALA MET ALA TYR LEU GLU SER SEQRES 1 A 28 CYS VAL HIS ARG ASP ILE ALA VAL ARG ASN ILE LEU VAL SEQRES 2 A 28 ALA SER PRO GLU CYS VAL LYS LEU GLY ASP PHE GLY LEU SEQRES 3 A 28 SER ARG SEQRES 1 A 103 ILE LYS TRP MET SER PRO GLU SER ILE ASN PHE ARG ARG SEQRES 2 A 103 PHE THR THR ALA SER ASP VAL TRP MET PHE ALA VAL CYS SEQRES 3 A 103 MET TRP GLU ILE LEU SER PHE GLY LYS GLN PRO PHE PHE SEQRES 4 A 103 TRP LEU GLU ASN LYS ASP VAL ILE GLY VAL LEU GLU LYS SEQRES 5 A 103 GLY ASP ARG LEU PRO LYS PRO ASP LEU CYS PRO PRO VAL SEQRES 6 A 103 LEU TYR THR LEU MET THR ARG CYS TRP ASP TYR ASP PRO SEQRES 7 A 103 SER ASP ARG PRO ARG PHE THR GLU LEU VAL CYS SER LEU SEQRES 8 A 103 SER ASP VAL TYR GLN MET GLU LYS ASP ILE ALA MET HET UNN A 334 63 ATOM 1 N ILE A 420 20.239 -15.374 40.226 1.00 47.52 N ATOM 2 CA ILE A 420 19.438 -16.107 41.203 1.00 42.23 C ATOM 3 C ILE A 420 19.501 -17.598 40.889 1.00 39.16 C ATOM 4 O ILE A 420 19.382 -17.999 39.731 1.00 42.69 O ATOM 5 CB ILE A 420 17.958 -15.634 41.215 1.00 43.26 C ATOM 6 CG1 ILE A 420 17.867 -14.148 41.564 1.00 38.98 C ATOM 7 CG2 ILE A 420 17.118 -16.461 42.195 1.00 40.43 C ATOM 8 CD1 ILE A 420 18.693 -13.757 42.771 1.00 45.71 C ATOM 9 HN3 ILE A 420 19.862 -15.546 39.272 1.00 0.00 H ATOM 10 HN2 ILE A 420 21.226 -15.699 40.274 1.00 0.00 H ATOM 11 HN1 ILE A 420 20.197 -14.357 40.439 1.00 0.00 H ATOM 12 N ALA A 421 19.708 -18.419 41.913 1.00 38.13 N ATOM 13 CA ALA A 421 19.715 -19.867 41.716 1.00 42.24 C ATOM 14 C ALA A 421 18.313 -20.444 41.925 1.00 39.56 C ATOM 15 O ALA A 421 17.592 -20.029 42.835 1.00 37.27 O ATOM 16 CB ALA A 421 20.721 -20.535 42.645 1.00 40.65 C ATOM 17 H ALA A 421 19.866 -18.028 42.863 1.00 0.00 H ATOM 18 N ARG A 422 17.939 -21.405 41.086 1.00 40.37 N ATOM 19 CA ARG A 422 16.588 -21.953 41.101 1.00 40.29 C ATOM 20 C ARG A 422 16.169 -22.513 42.460 1.00 39.14 C ATOM 21 O ARG A 422 15.002 -22.410 42.838 1.00 39.09 O ATOM 22 CB ARG A 422 16.419 -23.003 39.999 1.00 34.47 C ATOM 23 CG ARG A 422 14.982 -23.166 39.527 1.00 35.81 C ATOM 24 CD ARG A 422 14.866 -24.145 38.378 1.00 37.16 C ATOM 25 NE ARG A 422 15.671 -23.755 37.225 1.00 35.58 N ATOM 26 CZ ARG A 422 15.233 -23.011 36.215 1.00 40.33 C ATOM 27 NH1 ARG A 422 13.988 -22.553 36.212 1.00 36.62 N ATOM 28 NH2 ARG A 422 16.045 -22.718 35.206 1.00 41.75 N ATOM 29 HE ARG A 422 16.657 -24.083 37.191 1.00 0.00 H ATOM 30 HH12 ARG A 422 13.650 -21.971 35.419 1.00 0.00 H ATOM 31 HH11 ARG A 422 13.350 -22.776 37.003 1.00 0.00 H ATOM 32 HH22 ARG A 422 15.703 -22.136 34.415 1.00 0.00 H ATOM 33 HH21 ARG A 422 17.023 -23.071 35.207 1.00 0.00 H ATOM 34 H ARG A 422 18.628 -21.776 40.401 1.00 0.00 H ATOM 35 N GLU A 423 17.120 -23.074 43.205 1.00 37.55 N ATOM 36 CA GLU A 423 16.818 -23.675 44.503 1.00 37.84 C ATOM 37 C GLU A 423 16.287 -22.641 45.500 1.00 36.82 C ATOM 38 O GLU A 423 15.601 -22.985 46.465 1.00 35.53 O ATOM 39 CB GLU A 423 18.036 -24.440 45.076 1.00 40.28 C ATOM 40 CG GLU A 423 19.203 -23.563 45.549 1.00 42.89 C ATOM 41 CD GLU A 423 20.168 -24.302 46.475 1.00 53.02 C ATOM 42 OE1 GLU A 423 20.198 -23.978 47.682 1.00 52.22 O ATOM 43 OE2 GLU A 423 20.904 -25.196 45.998 1.00 52.33 O ATOM 44 H GLU A 423 18.099 -23.085 42.855 1.00 0.00 H ATOM 45 N ASP A 424 16.582 -21.372 45.248 1.00 36.18 N ATOM 46 CA ASP A 424 16.149 -20.295 46.136 1.00 36.47 C ATOM 47 C ASP A 424 14.726 -19.799 45.834 1.00 30.22 C ATOM 48 O ASP A 424 14.209 -18.927 46.530 1.00 35.11 O ATOM 49 CB ASP A 424 17.144 -19.124 46.076 1.00 41.15 C ATOM 50 CG ASP A 424 18.573 -19.547 46.414 1.00 41.77 C ATOM 51 OD1 ASP A 424 18.868 -19.733 47.614 1.00 39.21 O ATOM 52 OD2 ASP A 424 19.393 -19.689 45.481 1.00 44.35 O ATOM 53 H ASP A 424 17.134 -21.138 44.398 1.00 0.00 H ATOM 54 N VAL A 425 14.102 -20.359 44.801 1.00 26.87 N ATOM 55 CA VAL A 425 12.729 -20.001 44.441 1.00 27.99 C ATOM 56 C VAL A 425 11.807 -21.214 44.450 1.00 28.30 C ATOM 57 O VAL A 425 11.989 -22.133 43.658 1.00 25.29 O ATOM 58 CB VAL A 425 12.658 -19.363 43.043 1.00 31.94 C ATOM 59 CG1 VAL A 425 11.215 -19.006 42.696 1.00 30.78 C ATOM 60 CG2 VAL A 425 13.553 -18.132 42.968 1.00 29.41 C ATOM 61 H VAL A 425 14.604 -21.071 44.233 1.00 0.00 H ATOM 62 N VAL A 426 10.815 -21.209 45.338 1.00 24.22 N ATOM 63 CA VAL A 426 9.847 -22.312 45.416 1.00 26.39 C ATOM 64 C VAL A 426 8.506 -21.870 44.835 1.00 23.70 C ATOM 65 O VAL A 426 8.007 -20.801 45.189 1.00 23.62 O ATOM 66 CB VAL A 426 9.591 -22.741 46.874 1.00 26.61 C ATOM 67 H VAL A 426 10.723 -20.406 45.992 1.00 0.00 H ATOM 68 N LEU A 427 7.917 -22.687 43.964 1.00 23.06 N ATOM 69 CA LEU A 427 6.594 -22.384 43.410 1.00 21.02 C ATOM 70 C LEU A 427 5.473 -22.986 44.255 1.00 24.97 C ATOM 71 O LEU A 427 5.480 -24.188 44.556 1.00 22.86 O ATOM 72 CB LEU A 427 6.482 -22.885 41.970 1.00 22.32 C ATOM 73 CG LEU A 427 7.599 -22.476 41.019 1.00 20.40 C ATOM 74 CD1 LEU A 427 7.303 -22.963 39.612 1.00 23.30 C ATOM 75 CD2 LEU A 427 7.769 -20.976 41.030 1.00 21.95 C ATOM 76 H LEU A 427 8.405 -23.557 43.671 1.00 0.00 H ATOM 77 N ASN A 428 4.504 -22.150 44.617 1.00 20.70 N ATOM 78 CA ASN A 428 3.404 -22.561 45.482 1.00 24.10 C ATOM 79 C ASN A 428 2.110 -22.879 44.738 1.00 25.73 C ATOM 80 O ASN A 428 1.476 -23.892 44.995 1.00 24.09 O ATOM 81 CB ASN A 428 3.145 -21.499 46.553 1.00 21.62 C ATOM 82 CG ASN A 428 4.279 -21.400 47.544 1.00 26.39 C ATOM 83 OD1 ASN A 428 5.050 -22.347 47.710 1.00 27.08 O ATOM 84 ND2 ASN A 428 4.392 -20.252 48.209 1.00 29.32 N ATOM 85 HD22 ASN A 428 3.716 -19.481 48.034 1.00 0.00 H ATOM 86 HD21 ASN A 428 5.156 -20.126 48.903 1.00 0.00 H ATOM 87 H ASN A 428 4.532 -21.169 44.271 1.00 0.00 H ATOM 88 N ARG A 429 1.720 -22.000 43.821 1.00 23.54 N ATOM 89 CA ARG A 429 0.517 -22.216 43.030 1.00 22.23 C ATOM 90 C ARG A 429 0.542 -21.435 41.723 1.00 22.63 C ATOM 91 O ARG A 429 1.413 -20.590 41.499 1.00 19.62 O ATOM 92 CB ARG A 429 -0.747 -21.864 43.834 1.00 27.11 C ATOM 93 CG ARG A 429 -0.776 -20.445 44.375 1.00 27.94 C ATOM 94 CD ARG A 429 -2.084 -20.165 45.128 1.00 35.19 C ATOM 95 NE ARG A 429 -3.255 -20.223 44.247 1.00 48.07 N ATOM 96 CZ ARG A 429 -4.519 -20.244 44.671 1.00 53.33 C ATOM 97 NH1 ARG A 429 -4.794 -20.216 45.969 1.00 51.76 N ATOM 98 NH2 ARG A 429 -5.515 -20.300 43.796 1.00 57.57 N ATOM 99 HE ARG A 429 -3.088 -20.250 43.221 1.00 0.00 H ATOM 100 HH12 ARG A 429 -5.783 -20.233 46.292 1.00 0.00 H ATOM 101 HH11 ARG A 429 -4.021 -20.177 46.664 1.00 0.00 H ATOM 102 HH22 ARG A 429 -6.500 -20.316 44.130 1.00 0.00 H ATOM 103 HH21 ARG A 429 -5.311 -20.328 42.777 1.00 0.00 H ATOM 104 H ARG A 429 2.285 -21.141 43.665 1.00 0.00 H ATOM 105 N ILE A 430 -0.421 -21.749 40.867 1.00 16.92 N ATOM 106 CA ILE A 430 -0.671 -21.014 39.640 1.00 18.99 C ATOM 107 C ILE A 430 -1.139 -19.612 40.008 1.00 20.34 C ATOM 108 O ILE A 430 -1.939 -19.451 40.923 1.00 20.59 O ATOM 109 CB ILE A 430 -1.811 -21.681 38.850 1.00 20.01 C ATOM 110 CG1 ILE A 430 -1.415 -23.096 38.419 1.00 25.07 C ATOM 111 CG2 ILE A 430 -2.222 -20.849 37.667 1.00 22.66 C ATOM 112 CD1 ILE A 430 -0.140 -23.148 37.716 1.00 28.28 C ATOM 113 H ILE A 430 -1.029 -22.564 41.086 1.00 0.00 H ATOM 114 N LEU A 431 -0.627 -18.600 39.309 1.00 18.31 N ATOM 115 CA LEU A 431 -1.199 -17.255 39.384 1.00 19.07 C ATOM 116 C LEU A 431 -2.112 -17.058 38.176 1.00 16.94 C ATOM 117 O LEU A 431 -3.253 -16.639 38.315 1.00 17.79 O ATOM 118 CB LEU A 431 -0.088 -16.202 39.408 1.00 20.51 C ATOM 119 CG LEU A 431 -0.498 -14.749 39.641 1.00 21.80 C ATOM 120 CD1 LEU A 431 -1.426 -14.611 40.843 1.00 21.05 C ATOM 121 CD2 LEU A 431 0.760 -13.897 39.839 1.00 19.78 C ATOM 122 H LEU A 431 0.197 -18.769 38.697 1.00 0.00 H ATOM 123 N GLY A 432 -1.602 -17.369 36.988 1.00 17.01 N ATOM 124 CA GLY A 432 -2.393 -17.284 35.777 1.00 21.63 C ATOM 125 C GLY A 432 -1.597 -17.492 34.502 1.00 21.91 C ATOM 126 O GLY A 432 -0.393 -17.755 34.538 1.00 21.50 O ATOM 127 H GLY A 432 -0.612 -17.681 36.927 1.00 0.00 H ATOM 128 N GLU A 433 -2.267 -17.366 33.363 1.00 23.49 N ATOM 129 CA GLU A 433 -1.581 -17.526 32.084 1.00 25.60 C ATOM 130 C GLU A 433 -1.085 -16.176 31.586 1.00 27.04 C ATOM 131 O GLU A 433 -1.882 -15.303 31.246 1.00 28.43 O ATOM 132 CB GLU A 433 -2.496 -18.167 31.035 1.00 33.26 C ATOM 133 CG GLU A 433 -1.806 -18.464 29.709 1.00 35.48 C ATOM 134 CD GLU A 433 -2.715 -19.175 28.718 1.00 49.37 C ATOM 135 OE1 GLU A 433 -3.336 -18.483 27.880 1.00 55.67 O ATOM 136 OE2 GLU A 433 -2.802 -20.423 28.773 1.00 50.08 O ATOM 137 H GLU A 433 -3.285 -17.152 33.382 1.00 0.00 H ATOM 138 N GLY A 434 0.234 -15.999 31.566 1.00 26.72 N ATOM 139 CA GLY A 434 0.825 -14.790 31.027 1.00 24.99 C ATOM 140 C GLY A 434 0.844 -14.874 29.513 1.00 31.45 C ATOM 141 O GLY A 434 0.302 -15.814 28.921 1.00 32.03 O ATOM 142 H GLY A 434 0.853 -16.743 31.945 1.00 0.00 H ATOM 143 N PHE A 435 1.477 -13.896 28.878 1.00 35.65 N ATOM 144 CA PHE A 435 1.546 -13.862 27.424 1.00 38.42 C ATOM 145 C PHE A 435 2.408 -14.981 26.841 1.00 32.30 C ATOM 146 O PHE A 435 2.072 -15.555 25.810 1.00 33.26 O ATOM 147 CB PHE A 435 2.067 -12.504 26.947 1.00 40.10 C ATOM 148 CG PHE A 435 2.111 -12.371 25.452 1.00 37.08 C ATOM 149 CD1 PHE A 435 0.975 -12.010 24.745 1.00 42.26 C ATOM 150 CD2 PHE A 435 3.285 -12.616 24.754 1.00 41.42 C ATOM 151 CE1 PHE A 435 1.007 -11.892 23.364 1.00 44.10 C ATOM 152 CE2 PHE A 435 3.329 -12.500 23.371 1.00 43.86 C ATOM 153 CZ PHE A 435 2.185 -12.139 22.676 1.00 44.07 C ATOM 154 H PHE A 435 1.932 -13.140 29.429 1.00 0.00 H ATOM 155 N PHE A 436 3.522 -15.278 27.501 1.00 33.43 N ATOM 156 CA PHE A 436 4.486 -16.256 26.995 1.00 33.66 C ATOM 157 C PHE A 436 4.341 -17.627 27.646 1.00 35.35 C ATOM 158 O PHE A 436 4.949 -18.608 27.202 1.00 32.32 O ATOM 159 CB PHE A 436 5.917 -15.757 27.229 1.00 35.59 C ATOM 160 CG PHE A 436 6.256 -14.501 26.472 1.00 40.08 C ATOM 161 CD1 PHE A 436 6.173 -13.257 27.086 1.00 40.38 C ATOM 162 CD2 PHE A 436 6.665 -14.565 25.148 1.00 43.65 C ATOM 163 CE1 PHE A 436 6.488 -12.095 26.388 1.00 43.13 C ATOM 164 CE2 PHE A 436 6.981 -13.407 24.445 1.00 46.48 C ATOM 165 CZ PHE A 436 6.891 -12.171 25.069 1.00 40.21 C ATOM 166 H PHE A 436 3.715 -14.801 28.405 1.00 0.00 H ATOM 167 N GLY A 437 3.565 -17.689 28.719 1.00 28.70 N ATOM 168 CA GLY A 437 3.451 -18.926 29.463 1.00 27.07 C ATOM 169 C GLY A 437 2.916 -18.680 30.854 1.00 27.08 C ATOM 170 O GLY A 437 2.570 -17.556 31.215 1.00 21.80 O ATOM 171 H GLY A 437 3.037 -16.848 29.027 1.00 0.00 H ATOM 172 N GLU A 438 2.860 -19.743 31.641 1.00 22.81 N ATOM 173 CA GLU A 438 2.228 -19.678 32.938 1.00 20.44 C ATOM 174 C GLU A 438 3.027 -18.767 33.862 1.00 18.89 C ATOM 175 O GLU A 438 4.242 -18.640 33.726 1.00 20.26 O ATOM 176 CB GLU A 438 2.107 -21.095 33.518 1.00 21.13 C ATOM 177 CG GLU A 438 1.041 -21.253 34.574 1.00 25.30 C ATOM 178 CD GLU A 438 -0.376 -21.057 34.044 1.00 25.61 C ATOM 179 OE1 GLU A 438 -0.584 -20.984 32.816 1.00 21.71 O ATOM 180 OE2 GLU A 438 -1.298 -20.991 34.870 1.00 25.85 O ATOM 181 H GLU A 438 3.278 -20.640 31.320 1.00 0.00 H ATOM 182 N VAL A 439 2.314 -18.111 34.767 1.00 19.76 N ATOM 183 CA VAL A 439 2.888 -17.326 35.843 1.00 17.78 C ATOM 184 C VAL A 439 2.477 -17.987 37.167 1.00 17.66 C ATOM 185 O VAL A 439 1.313 -18.325 37.352 1.00 17.80 O ATOM 186 CB VAL A 439 2.326 -15.890 35.828 1.00 19.60 C ATOM 187 CG1 VAL A 439 2.955 -15.060 36.946 1.00 18.99 C ATOM 188 CG2 VAL A 439 2.552 -15.216 34.454 1.00 17.45 C ATOM 189 H VAL A 439 1.277 -18.163 34.701 1.00 0.00 H ATOM 190 N TYR A 440 3.430 -18.134 38.080 1.00 13.50 N ATOM 191 CA TYR A 440 3.240 -18.848 39.338 1.00 17.49 C ATOM 192 C TYR A 440 3.442 -17.914 40.519 1.00 20.39 C ATOM 193 O TYR A 440 4.195 -16.934 40.435 1.00 18.67 O ATOM 194 CB TYR A 440 4.247 -20.015 39.438 1.00 17.72 C ATOM 195 CG TYR A 440 4.133 -20.984 38.292 1.00 20.01 C ATOM 196 CD1 TYR A 440 4.899 -20.840 37.157 1.00 16.58 C ATOM 197 CD2 TYR A 440 3.231 -22.031 38.341 1.00 21.01 C ATOM 198 CE1 TYR A 440 4.779 -21.727 36.094 1.00 19.84 C ATOM 199 CE2 TYR A 440 3.105 -22.911 37.296 1.00 19.50 C ATOM 200 CZ TYR A 440 3.870 -22.759 36.175 1.00 21.53 C ATOM 201 OH TYR A 440 3.722 -23.650 35.143 1.00 19.76 O ATOM 202 HH TYR A 440 4.341 -23.408 34.409 1.00 0.00 H ATOM 203 H TYR A 440 4.363 -17.717 37.888 1.00 0.00 H ATOM 204 N GLU A 441 2.772 -18.225 41.622 1.00 15.65 N ATOM 205 CA GLU A 441 3.037 -17.545 42.878 1.00 20.25 C ATOM 206 C GLU A 441 4.046 -18.416 43.580 1.00 24.82 C ATOM 207 O GLU A 441 3.920 -19.653 43.589 1.00 17.97 O ATOM 208 CB GLU A 441 1.790 -17.437 43.754 1.00 23.73 C ATOM 209 CG GLU A 441 0.833 -16.324 43.391 1.00 28.25 C ATOM 210 CD GLU A 441 -0.302 -16.187 44.395 1.00 31.63 C ATOM 211 OE1 GLU A 441 -0.489 -17.108 45.227 1.00 34.73 O ATOM 212 OE2 GLU A 441 -1.006 -15.155 44.356 1.00 35.56 O ATOM 213 H GLU A 441 2.045 -18.968 41.586 1.00 0.00 H ATOM 214 N GLY A 442 5.045 -17.771 44.164 1.00 19.01 N ATOM 215 CA GLY A 442 6.106 -18.486 44.832 1.00 22.23 C ATOM 216 C GLY A 442 6.763 -17.665 45.923 1.00 26.52 C ATOM 217 O GLY A 442 6.272 -16.596 46.307 1.00 24.80 O ATOM 218 H GLY A 442 5.065 -16.731 44.141 1.00 0.00 H ATOM 219 N VAL A 443 7.884 -18.178 46.418 1.00 25.80 N ATOM 220 CA VAL A 443 8.617 -17.555 47.504 1.00 27.38 C ATOM 221 C VAL A 443 10.098 -17.622 47.177 1.00 28.66 C ATOM 222 O VAL A 443 10.630 -18.691 46.895 1.00 26.53 O ATOM 223 CB VAL A 443 8.329 -18.254 48.854 1.00 27.17 C ATOM 224 CG1 VAL A 443 9.275 -17.746 49.936 1.00 33.54 C ATOM 225 CG2 VAL A 443 6.897 -18.023 49.271 1.00 30.40 C ATOM 226 H VAL A 443 8.251 -19.062 46.011 1.00 0.00 H ATOM 227 N TYR A 444 10.745 -16.465 47.178 1.00 28.96 N ATOM 228 CA TYR A 444 12.182 -16.381 46.962 1.00 29.77 C ATOM 229 C TYR A 444 12.860 -16.100 48.303 1.00 33.61 C ATOM 230 O TYR A 444 12.404 -15.245 49.071 1.00 29.60 O ATOM 231 CB TYR A 444 12.498 -15.288 45.932 1.00 32.30 C ATOM 232 CG TYR A 444 13.946 -14.850 45.882 1.00 34.66 C ATOM 233 CD1 TYR A 444 14.954 -15.744 45.552 1.00 35.81 C ATOM 234 CD2 TYR A 444 14.301 -13.532 46.146 1.00 39.08 C ATOM 235 CE1 TYR A 444 16.285 -15.342 45.501 1.00 37.53 C ATOM 236 CE2 TYR A 444 15.627 -13.119 46.098 1.00 33.48 C ATOM 237 CZ TYR A 444 16.613 -14.032 45.774 1.00 43.66 C ATOM 238 OH TYR A 444 17.932 -13.633 45.725 1.00 42.88 O ATOM 239 HH TYR A 444 18.500 -14.406 45.480 1.00 0.00 H ATOM 240 H TYR A 444 10.208 -15.589 47.338 1.00 0.00 H ATOM 241 N THR A 445 13.923 -16.847 48.595 1.00 37.70 N ATOM 242 CA THR A 445 14.665 -16.665 49.842 1.00 40.39 C ATOM 243 C THR A 445 16.042 -16.055 49.549 1.00 42.87 C ATOM 244 O THR A 445 16.816 -16.606 48.763 1.00 38.68 O ATOM 245 CB THR A 445 14.815 -17.983 50.643 1.00 44.04 C ATOM 246 OG1 THR A 445 13.570 -18.695 50.660 1.00 36.56 O ATOM 247 CG2 THR A 445 15.226 -17.692 52.076 1.00 45.58 C ATOM 248 HG1 THR A 445 13.300 -18.908 49.732 1.00 0.00 H ATOM 249 H THR A 445 14.232 -17.576 47.921 1.00 0.00 H ATOM 250 N ASN A 446 16.329 -14.914 50.182 1.00 44.14 N ATOM 251 CA ASN A 446 17.571 -14.156 49.962 1.00 52.50 C ATOM 252 C ASN A 446 18.855 -14.958 50.120 1.00 53.95 C ATOM 253 O ASN A 446 18.865 -16.014 50.749 1.00 56.75 O ATOM 254 CB ASN A 446 17.645 -12.958 50.922 1.00 53.14 C ATOM 255 CG ASN A 446 17.070 -11.688 50.324 1.00 57.72 C ATOM 256 OD1 ASN A 446 16.909 -11.574 49.105 1.00 61.83 O ATOM 257 ND2 ASN A 446 16.769 -10.718 51.180 1.00 56.95 N ATOM 258 HD22 ASN A 446 16.921 -10.858 52.199 1.00 0.00 H ATOM 259 HD21 ASN A 446 16.381 -9.818 50.831 1.00 0.00 H ATOM 260 H ASN A 446 15.639 -14.542 50.866 1.00 0.00 H ATOM 261 N HIS A 447 19.947 -14.430 49.566 1.00 59.62 N ATOM 262 CA HIS A 447 21.284 -14.937 49.868 1.00 60.94 C ATOM 263 C HIS A 447 21.615 -14.580 51.314 1.00 60.55 C ATOM 264 O HIS A 447 22.569 -15.102 51.892 1.00 61.54 O ATOM 265 CB HIS A 447 22.324 -14.344 48.915 1.00 57.93 C ATOM 266 H HIS A 447 19.845 -13.637 48.902 1.00 0.00 H ATOM 267 N LYS A 448 20.811 -13.680 51.881 1.00 56.99 N ATOM 268 CA LYS A 448 20.825 -13.381 53.307 1.00 55.47 C ATOM 269 C LYS A 448 19.654 -14.079 54.001 1.00 56.58 C ATOM 270 O LYS A 448 19.368 -13.823 55.172 1.00 55.74 O ATOM 271 CB LYS A 448 20.754 -11.871 53.541 1.00 58.90 C ATOM 272 H LYS A 448 20.140 -13.166 51.275 1.00 0.00 H ATOM 273 N GLY A 449 18.962 -14.942 53.262 1.00 61.39 N ATOM 274 CA GLY A 449 17.976 -15.844 53.840 1.00 55.72 C ATOM 275 C GLY A 449 16.612 -15.312 54.253 1.00 53.59 C ATOM 276 O GLY A 449 15.918 -15.967 55.033 1.00 52.98 O ATOM 277 H GLY A 449 19.131 -14.973 52.236 1.00 0.00 H ATOM 278 N GLU A 450 16.217 -14.146 53.742 1.00 53.49 N ATOM 279 CA GLU A 450 14.885 -13.604 54.022 1.00 47.72 C ATOM 280 C GLU A 450 13.896 -14.048 52.942 1.00 48.16 C ATOM 281 O GLU A 450 14.287 -14.240 51.791 1.00 45.57 O ATOM 282 CB GLU A 450 14.928 -12.079 54.097 1.00 52.38 C ATOM 283 H GLU A 450 16.867 -13.610 53.132 1.00 0.00 H ATOM 284 N LYS A 451 12.627 -14.219 53.314 1.00 46.37 N ATOM 285 CA LYS A 451 11.616 -14.719 52.381 1.00 45.61 C ATOM 286 C LYS A 451 10.833 -13.591 51.706 1.00 42.75 C ATOM 287 O LYS A 451 10.365 -12.662 52.370 1.00 40.97 O ATOM 288 CB LYS A 451 10.653 -15.687 53.082 1.00 43.42 C ATOM 289 CG LYS A 451 11.314 -16.942 53.639 1.00 46.00 C ATOM 290 CD LYS A 451 10.290 -18.039 53.930 1.00 51.66 C ATOM 291 CE LYS A 451 10.947 -19.303 54.497 1.00 58.90 C ATOM 292 NZ LYS A 451 11.970 -19.899 53.575 1.00 57.15 N ATOM 293 HZ1 LYS A 451 11.516 -20.156 52.675 1.00 0.00 H ATOM 294 HZ2 LYS A 451 12.723 -19.204 53.399 1.00 0.00 H ATOM 295 HZ3 LYS A 451 12.377 -20.749 54.014 1.00 0.00 H ATOM 296 H LYS A 451 12.349 -13.992 54.290 1.00 0.00 H ATOM 297 N ILE A 452 10.696 -13.675 50.384 1.00 33.49 N ATOM 298 CA ILE A 452 9.935 -12.679 49.626 1.00 31.91 C ATOM 299 C ILE A 452 8.901 -13.337 48.704 1.00 32.44 C ATOM 300 O ILE A 452 9.240 -14.210 47.898 1.00 29.16 O ATOM 301 CB ILE A 452 10.864 -11.784 48.768 1.00 29.98 C ATOM 302 H ILE A 452 11.140 -14.467 49.877 1.00 0.00 H ATOM 303 N ASN A 453 7.645 -12.919 48.816 1.00 29.02 N ATOM 304 CA ASN A 453 6.611 -13.443 47.934 1.00 27.53 C ATOM 305 C ASN A 453 6.848 -12.939 46.511 1.00 27.41 C ATOM 306 O ASN A 453 7.067 -11.742 46.296 1.00 24.90 O ATOM 307 CB ASN A 453 5.217 -13.060 48.450 1.00 29.99 C ATOM 308 CG ASN A 453 4.807 -13.865 49.678 1.00 36.63 C ATOM 309 OD1 ASN A 453 5.065 -15.063 49.755 1.00 40.86 O ATOM 310 ND2 ASN A 453 4.177 -13.204 50.647 1.00 40.52 N ATOM 311 HD22 ASN A 453 3.979 -12.189 50.540 1.00 0.00 H ATOM 312 HD21 ASN A 453 3.883 -13.703 51.511 1.00 0.00 H ATOM 313 H ASN A 453 7.398 -12.213 49.538 1.00 0.00 H ATOM 314 N VAL A 454 6.839 -13.853 45.545 1.00 26.02 N ATOM 315 CA VAL A 454 7.193 -13.502 44.175 1.00 19.95 C ATOM 316 C VAL A 454 6.192 -14.023 43.161 1.00 20.82 C ATOM 317 O VAL A 454 5.440 -14.966 43.431 1.00 20.56 O ATOM 318 CB VAL A 454 8.592 -14.022 43.782 1.00 22.89 C ATOM 319 CG1 VAL A 454 9.685 -13.312 44.591 1.00 18.51 C ATOM 320 CG2 VAL A 454 8.665 -15.564 43.955 1.00 21.51 C ATOM 321 H VAL A 454 6.575 -14.833 45.770 1.00 0.00 H ATOM 322 N ALA A 455 6.189 -13.385 41.995 1.00 20.47 N ATOM 323 CA ALA A 455 5.477 -13.888 40.833 1.00 17.67 C ATOM 324 C ALA A 455 6.520 -14.337 39.833 1.00 16.06 C ATOM 325 O ALA A 455 7.427 -13.575 39.458 1.00 19.09 O ATOM 326 CB ALA A 455 4.570 -12.832 40.236 1.00 18.40 C ATOM 327 H ALA A 455 6.716 -12.492 41.911 1.00 0.00 H ATOM 328 N VAL A 456 6.398 -15.583 39.408 1.00 14.92 N ATOM 329 CA VAL A 456 7.398 -16.206 38.564 1.00 16.62 C ATOM 330 C VAL A 456 6.832 -16.387 37.162 1.00 19.86 C ATOM 331 O VAL A 456 5.888 -17.162 36.951 1.00 19.01 O ATOM 332 CB VAL A 456 7.849 -17.569 39.122 1.00 17.52 C ATOM 333 CG1 VAL A 456 8.924 -18.164 38.235 1.00 20.20 C ATOM 334 CG2 VAL A 456 8.369 -17.417 40.547 1.00 21.87 C ATOM 335 H VAL A 456 5.560 -16.132 39.687 1.00 0.00 H ATOM 336 N LYS A 457 7.401 -15.651 36.215 1.00 15.81 N ATOM 337 CA LYS A 457 6.986 -15.716 34.823 1.00 19.52 C ATOM 338 C LYS A 457 7.832 -16.759 34.115 1.00 23.44 C ATOM 339 O LYS A 457 9.058 -16.761 34.241 1.00 23.24 O ATOM 340 CB LYS A 457 7.163 -14.356 34.130 1.00 21.81 C ATOM 341 CG LYS A 457 6.478 -13.194 34.825 1.00 23.87 C ATOM 342 CD LYS A 457 6.719 -11.896 34.066 1.00 32.10 C ATOM 343 CE LYS A 457 5.857 -11.800 32.819 1.00 34.11 C ATOM 344 NZ LYS A 457 4.592 -11.073 33.094 1.00 37.49 N ATOM 345 HZ1 LYS A 457 4.057 -11.577 33.830 1.00 0.00 H ATOM 346 HZ2 LYS A 457 4.811 -10.110 33.421 1.00 0.00 H ATOM 347 HZ3 LYS A 457 4.025 -11.024 32.223 1.00 0.00 H ATOM 348 H LYS A 457 8.172 -15.004 36.478 1.00 0.00 H ATOM 349 N THR A 458 7.171 -17.648 33.374 1.00 22.16 N ATOM 350 CA THR A 458 7.861 -18.672 32.601 1.00 22.90 C ATOM 351 C THR A 458 7.519 -18.526 31.125 1.00 25.99 C ATOM 352 O THR A 458 6.588 -17.793 30.758 1.00 21.79 O ATOM 353 CB THR A 458 7.482 -20.087 33.062 1.00 25.54 C ATOM 354 OG1 THR A 458 6.114 -20.350 32.718 1.00 23.79 O ATOM 355 CG2 THR A 458 7.668 -20.226 34.569 1.00 24.19 C ATOM 356 HG1 THR A 458 5.529 -19.688 33.166 1.00 0.00 H ATOM 357 H THR A 458 6.132 -17.610 33.347 1.00 0.00 H ATOM 358 N CYS A 459 8.264 -19.251 30.295 1.00 23.83 N ATOM 359 CA CYS A 459 8.030 -19.328 28.855 1.00 32.53 C ATOM 360 C CYS A 459 7.576 -20.752 28.509 1.00 40.83 C ATOM 361 O CYS A 459 8.132 -21.722 29.035 1.00 41.06 O ATOM 362 CB CYS A 459 9.335 -19.019 28.113 1.00 36.96 C ATOM 363 SG CYS A 459 9.185 -18.037 26.598 1.00 49.69 S ATOM 364 H CYS A 459 9.057 -19.793 30.693 1.00 0.00 H ATOM 365 N LYS A 460 6.561 -20.890 27.653 1.00 40.43 N ATOM 366 CA LYS A 460 6.140 -22.218 27.188 1.00 40.19 C ATOM 367 C LYS A 460 7.290 -22.917 26.457 1.00 45.44 C ATOM 368 O LYS A 460 8.104 -22.262 25.806 1.00 42.06 O ATOM 369 CB LYS A 460 4.930 -22.115 26.249 1.00 43.63 C ATOM 370 CG LYS A 460 3.588 -22.018 26.946 1.00 38.75 C ATOM 371 CD LYS A 460 2.443 -21.921 25.943 1.00 41.09 C ATOM 372 CE LYS A 460 2.535 -20.644 25.123 1.00 47.10 C ATOM 373 NZ LYS A 460 1.296 -19.812 25.230 1.00 45.98 N ATOM 374 HZ1 LYS A 460 0.482 -20.359 24.886 1.00 0.00 H ATOM 375 HZ2 LYS A 460 1.142 -19.548 26.224 1.00 0.00 H ATOM 376 HZ3 LYS A 460 1.406 -18.953 24.654 1.00 0.00 H ATOM 377 H LYS A 460 6.061 -20.045 27.310 1.00 0.00 H ATOM 378 N LYS A 461 7.351 -24.242 26.554 1.00 50.59 N ATOM 379 CA LYS A 461 8.398 -25.000 25.870 1.00 50.25 C ATOM 380 C LYS A 461 8.177 -25.015 24.358 1.00 50.78 C ATOM 381 O LYS A 461 9.079 -25.357 23.593 1.00 53.56 O ATOM 382 CB LYS A 461 8.475 -26.430 26.414 1.00 44.95 C ATOM 383 H LYS A 461 6.643 -24.747 27.125 1.00 0.00 H ATOM 384 N ASP A 462 6.975 -24.630 23.940 1.00 42.09 N ATOM 385 CA ASP A 462 6.604 -24.583 22.531 1.00 48.13 C ATOM 386 C ASP A 462 6.952 -23.253 21.871 1.00 50.81 C ATOM 387 O ASP A 462 6.797 -23.096 20.662 1.00 50.39 O ATOM 388 CB ASP A 462 5.102 -24.839 22.390 1.00 42.76 C ATOM 389 CG ASP A 462 4.718 -26.243 22.783 1.00 46.58 C ATOM 390 OD1 ASP A 462 5.525 -26.933 23.441 1.00 45.07 O ATOM 391 OD2 ASP A 462 3.603 -26.665 22.432 1.00 46.92 O ATOM 392 H ASP A 462 6.268 -24.350 24.650 1.00 0.00 H ATOM 393 N CYS A 463 7.425 -22.299 22.668 1.00 53.25 N ATOM 394 CA CYS A 463 7.673 -20.939 22.186 1.00 52.74 C ATOM 395 C CYS A 463 8.682 -20.852 21.044 1.00 54.10 C ATOM 396 O CYS A 463 9.680 -21.574 21.022 1.00 49.30 O ATOM 397 CB CYS A 463 8.129 -20.033 23.332 1.00 50.47 C ATOM 398 SG CYS A 463 6.769 -19.287 24.269 1.00 58.60 S ATOM 399 H CYS A 463 7.625 -22.526 23.663 1.00 0.00 H ATOM 400 N THR A 464 8.406 -19.959 20.097 1.00 53.81 N ATOM 401 CA THR A 464 9.342 -19.654 19.023 1.00 58.48 C ATOM 402 C THR A 464 10.366 -18.645 19.517 1.00 56.91 C ATOM 403 O THR A 464 10.012 -17.518 19.860 1.00 62.18 O ATOM 404 CB THR A 464 8.628 -19.061 17.792 1.00 59.17 C ATOM 405 OG1 THR A 464 8.365 -17.668 18.004 1.00 59.76 O ATOM 406 CG2 THR A 464 7.321 -19.789 17.528 1.00 58.79 C ATOM 407 HG1 THR A 464 9.220 -17.190 18.148 1.00 0.00 H ATOM 408 H THR A 464 7.493 -19.463 20.124 1.00 0.00 H TER 409 THR A 464 ATOM 410 N ASN A 467 10.057 -15.098 19.952 1.00 59.44 N ATOM 411 CA ASN A 467 9.294 -14.775 21.154 1.00 55.66 C ATOM 412 C ASN A 467 10.007 -15.181 22.440 1.00 46.62 C ATOM 413 O ASN A 467 9.865 -14.521 23.465 1.00 45.70 O ATOM 414 CB ASN A 467 7.894 -15.397 21.091 1.00 55.39 C ATOM 415 CG ASN A 467 6.915 -14.551 20.307 1.00 57.44 C ATOM 416 OD1 ASN A 467 7.294 -13.563 19.678 1.00 58.64 O ATOM 417 ND2 ASN A 467 5.642 -14.937 20.341 1.00 61.71 N ATOM 418 HD22 ASN A 467 5.368 -15.779 20.886 1.00 0.00 H ATOM 419 HD21 ASN A 467 4.921 -14.397 19.822 1.00 0.00 H ATOM 420 HN3 ASN A 467 10.221 -16.124 19.912 1.00 0.00 H ATOM 421 HN2 ASN A 467 10.970 -14.600 19.978 1.00 0.00 H ATOM 422 HN1 ASN A 467 9.522 -14.799 19.112 1.00 0.00 H ATOM 423 N LYS A 468 10.779 -16.262 22.384 1.00 44.69 N ATOM 424 CA LYS A 468 11.610 -16.651 23.516 1.00 42.45 C ATOM 425 C LYS A 468 12.679 -15.583 23.758 1.00 48.46 C ATOM 426 O LYS A 468 13.160 -15.406 24.882 1.00 45.20 O ATOM 427 CB LYS A 468 12.254 -18.016 23.269 1.00 44.80 C ATOM 428 H LYS A 468 10.790 -16.839 21.519 1.00 0.00 H ATOM 429 N GLU A 469 13.025 -14.863 22.692 1.00 48.78 N ATOM 430 CA GLU A 469 14.017 -13.794 22.744 1.00 47.11 C ATOM 431 C GLU A 469 13.381 -12.463 23.135 1.00 46.85 C ATOM 432 O GLU A 469 14.005 -11.650 23.814 1.00 48.22 O ATOM 433 CB GLU A 469 14.734 -13.665 21.397 1.00 43.25 C ATOM 434 H GLU A 469 12.568 -15.072 21.782 1.00 0.00 H ATOM 435 N LYS A 470 12.140 -12.240 22.710 1.00 42.76 N ATOM 436 CA LYS A 470 11.399 -11.057 23.137 1.00 44.74 C ATOM 437 C LYS A 470 11.112 -11.152 24.632 1.00 47.46 C ATOM 438 O LYS A 470 11.106 -10.150 25.341 1.00 41.47 O ATOM 439 CB LYS A 470 10.082 -10.941 22.373 1.00 44.78 C ATOM 440 H LYS A 470 11.691 -12.919 22.063 1.00 0.00 H ATOM 441 N PHE A 471 10.873 -12.377 25.087 1.00 44.01 N ATOM 442 CA PHE A 471 10.591 -12.674 26.486 1.00 44.30 C ATOM 443 C PHE A 471 11.780 -12.299 27.370 1.00 42.74 C ATOM 444 O PHE A 471 11.612 -11.736 28.450 1.00 39.52 O ATOM 445 CB PHE A 471 10.246 -14.163 26.626 1.00 41.15 C ATOM 446 CG PHE A 471 10.181 -14.653 28.046 1.00 36.00 C ATOM 447 CD1 PHE A 471 9.068 -14.394 28.834 1.00 38.44 C ATOM 448 CD2 PHE A 471 11.218 -15.403 28.577 1.00 35.57 C ATOM 449 CE1 PHE A 471 9.001 -14.855 30.144 1.00 33.66 C ATOM 450 CE2 PHE A 471 11.164 -15.864 29.881 1.00 37.17 C ATOM 451 CZ PHE A 471 10.055 -15.596 30.665 1.00 32.38 C ATOM 452 H PHE A 471 10.888 -13.166 24.409 1.00 0.00 H ATOM 453 N MET A 472 12.986 -12.602 26.914 1.00 40.69 N ATOM 454 CA MET A 472 14.167 -12.232 27.686 1.00 46.59 C ATOM 455 C MET A 472 14.459 -10.739 27.553 1.00 43.78 C ATOM 456 O MET A 472 14.830 -10.086 28.523 1.00 41.73 O ATOM 457 CB MET A 472 15.385 -13.069 27.280 1.00 45.64 C ATOM 458 H MET A 472 13.091 -13.102 26.008 1.00 0.00 H ATOM 459 N SER A 473 14.267 -10.195 26.357 1.00 41.99 N ATOM 460 CA SER A 473 14.576 -8.788 26.118 1.00 42.50 C ATOM 461 C SER A 473 13.561 -7.835 26.764 1.00 41.39 C ATOM 462 O SER A 473 13.887 -6.680 27.045 1.00 38.21 O ATOM 463 CB SER A 473 14.758 -8.501 24.620 1.00 41.03 C ATOM 464 OG SER A 473 13.518 -8.340 23.963 1.00 50.97 O ATOM 465 HG SER A 473 12.985 -9.169 24.059 1.00 0.00 H ATOM 466 H SER A 473 13.892 -10.778 25.581 1.00 0.00 H ATOM 467 N GLU A 474 12.341 -8.308 27.013 1.00 36.79 N ATOM 468 CA GLU A 474 11.384 -7.513 27.791 1.00 36.29 C ATOM 469 C GLU A 474 11.766 -7.577 29.268 1.00 31.71 C ATOM 470 O GLU A 474 11.483 -6.663 30.041 1.00 31.25 O ATOM 471 CB GLU A 474 9.948 -8.008 27.589 1.00 36.64 C ATOM 472 H GLU A 474 12.066 -9.245 26.655 1.00 0.00 H ATOM 473 N ALA A 475 12.430 -8.665 29.641 1.00 34.40 N ATOM 474 CA ALA A 475 12.904 -8.853 31.002 1.00 33.04 C ATOM 475 C ALA A 475 14.137 -7.987 31.274 1.00 29.90 C ATOM 476 O ALA A 475 14.311 -7.493 32.391 1.00 28.37 O ATOM 477 CB ALA A 475 13.208 -10.314 31.261 1.00 28.58 C ATOM 478 H ALA A 475 12.617 -9.407 28.936 1.00 0.00 H ATOM 479 N VAL A 476 14.995 -7.824 30.266 1.00 33.95 N ATOM 480 CA VAL A 476 16.162 -6.950 30.392 1.00 33.53 C ATOM 481 C VAL A 476 15.693 -5.524 30.627 1.00 26.13 C ATOM 482 O VAL A 476 16.227 -4.812 31.481 1.00 29.17 O ATOM 483 CB VAL A 476 17.052 -6.950 29.133 1.00 36.85 C ATOM 484 CG1 VAL A 476 18.325 -6.125 29.383 1.00 25.99 C ATOM 485 CG2 VAL A 476 17.421 -8.355 28.727 1.00 41.12 C ATOM 486 H VAL A 476 14.831 -8.329 29.372 1.00 0.00 H ATOM 487 N ILE A 477 14.691 -5.103 29.864 1.00 25.52 N ATOM 488 CA ILE A 477 14.108 -3.783 30.064 1.00 24.53 C ATOM 489 C ILE A 477 13.615 -3.591 31.495 1.00 24.87 C ATOM 490 O ILE A 477 13.977 -2.620 32.159 1.00 25.25 O ATOM 491 CB ILE A 477 12.995 -3.492 29.043 1.00 28.62 C ATOM 492 CG1 ILE A 477 13.618 -3.156 27.683 1.00 35.58 C ATOM 493 CG2 ILE A 477 12.141 -2.339 29.508 1.00 30.56 C ATOM 494 CD1 ILE A 477 12.614 -2.869 26.581 1.00 37.57 C ATOM 495 H ILE A 477 14.319 -5.722 29.116 1.00 0.00 H ATOM 496 N MET A 478 12.814 -4.533 31.986 1.00 27.78 N ATOM 497 CA MET A 478 12.293 -4.449 33.347 1.00 24.78 C ATOM 498 C MET A 478 13.436 -4.411 34.360 1.00 23.78 C ATOM 499 O MET A 478 13.370 -3.702 35.363 1.00 19.37 O ATOM 500 CB MET A 478 11.356 -5.637 33.647 1.00 24.96 C ATOM 501 CG MET A 478 10.048 -5.643 32.853 1.00 24.98 C ATOM 502 SD MET A 478 9.126 -4.072 32.913 1.00 34.26 S ATOM 503 CE MET A 478 8.931 -3.857 34.682 1.00 23.80 C ATOM 504 H MET A 478 12.554 -5.344 31.389 1.00 0.00 H ATOM 505 N LYS A 479 14.487 -5.178 34.092 1.00 21.27 N ATOM 506 CA LYS A 479 15.652 -5.219 34.969 1.00 24.61 C ATOM 507 C LYS A 479 16.285 -3.836 35.109 1.00 22.19 C ATOM 508 O LYS A 479 16.835 -3.497 36.152 1.00 20.98 O ATOM 509 CB LYS A 479 16.690 -6.207 34.419 1.00 24.07 C ATOM 510 H LYS A 479 14.479 -5.765 33.234 1.00 0.00 H ATOM 511 N ASN A 480 16.197 -3.033 34.053 1.00 18.72 N ATOM 512 CA ASN A 480 16.811 -1.706 34.062 1.00 20.93 C ATOM 513 C ASN A 480 15.907 -0.583 34.542 1.00 24.19 C ATOM 514 O ASN A 480 16.355 0.546 34.702 1.00 22.64 O ATOM 515 CB ASN A 480 17.387 -1.362 32.686 1.00 19.35 C ATOM 516 CG ASN A 480 18.688 -2.083 32.413 1.00 26.54 C ATOM 517 OD1 ASN A 480 19.739 -1.721 32.953 1.00 24.36 O ATOM 518 ND2 ASN A 480 18.627 -3.110 31.577 1.00 21.81 N ATOM 519 HD22 ASN A 480 17.719 -3.377 31.147 1.00 0.00 H ATOM 520 HD21 ASN A 480 19.488 -3.649 31.351 1.00 0.00 H ATOM 521 H ASN A 480 15.683 -3.354 33.207 1.00 0.00 H ATOM 522 N LEU A 481 14.636 -0.893 34.774 1.00 24.38 N ATOM 523 CA LEU A 481 13.699 0.091 35.301 1.00 21.52 C ATOM 524 C LEU A 481 13.712 0.096 36.830 1.00 27.97 C ATOM 525 O LEU A 481 13.795 -0.953 37.470 1.00 28.96 O ATOM 526 CB LEU A 481 12.287 -0.221 34.812 1.00 24.59 C ATOM 527 CG LEU A 481 12.111 -0.160 33.301 1.00 25.17 C ATOM 528 CD1 LEU A 481 10.699 -0.606 32.906 1.00 30.34 C ATOM 529 CD2 LEU A 481 12.379 1.243 32.835 1.00 24.46 C ATOM 530 H LEU A 481 14.303 -1.858 34.575 1.00 0.00 H ATOM 531 N ASP A 482 13.637 1.283 37.417 1.00 27.41 N ATOM 532 CA ASP A 482 13.437 1.389 38.853 1.00 29.15 C ATOM 533 C ASP A 482 12.575 2.595 39.145 1.00 27.33 C ATOM 534 O ASP A 482 12.973 3.735 38.930 1.00 27.27 O ATOM 535 CB ASP A 482 14.750 1.505 39.622 1.00 34.66 C ATOM 536 CG ASP A 482 14.537 1.469 41.133 1.00 42.33 C ATOM 537 OD1 ASP A 482 13.701 0.660 41.611 1.00 43.67 O ATOM 538 OD2 ASP A 482 15.191 2.257 41.844 1.00 46.47 O ATOM 539 H ASP A 482 13.722 2.147 36.844 1.00 0.00 H ATOM 540 N HIS A 483 11.382 2.333 39.635 1.00 24.48 N ATOM 541 CA HIS A 483 10.458 3.407 39.927 1.00 21.68 C ATOM 542 C HIS A 483 9.472 2.862 40.913 1.00 16.42 C ATOM 543 O HIS A 483 9.067 1.711 40.789 1.00 19.33 O ATOM 544 CB HIS A 483 9.758 3.860 38.648 1.00 19.82 C ATOM 545 CG HIS A 483 8.959 5.121 38.825 1.00 17.49 C ATOM 546 ND1 HIS A 483 7.653 5.107 39.238 1.00 17.13 N ATOM 547 CD2 HIS A 483 9.311 6.413 38.687 1.00 18.03 C ATOM 548 CE1 HIS A 483 7.209 6.357 39.329 1.00 18.07 C ATOM 549 NE2 HIS A 483 8.211 7.170 38.998 1.00 16.58 N ATOM 550 H HIS A 483 11.102 1.347 39.813 1.00 0.00 H ATOM 551 N PRO A 484 9.088 3.682 41.909 1.00 19.94 N ATOM 552 CA PRO A 484 8.195 3.236 42.979 1.00 18.84 C ATOM 553 C PRO A 484 6.838 2.822 42.453 1.00 20.60 C ATOM 554 O PRO A 484 6.081 2.150 43.174 1.00 20.27 O ATOM 555 CB PRO A 484 8.022 4.492 43.857 1.00 21.03 C ATOM 556 CG PRO A 484 9.141 5.405 43.485 1.00 21.11 C ATOM 557 CD PRO A 484 9.509 5.088 42.072 1.00 21.09 C ATOM 558 N HIS A 485 6.511 3.223 41.225 1.00 18.19 N ATOM 559 CA HIS A 485 5.177 2.925 40.705 1.00 15.78 C ATOM 560 C HIS A 485 5.179 2.089 39.433 1.00 16.28 C ATOM 561 O HIS A 485 4.259 2.157 38.618 1.00 14.45 O ATOM 562 CB HIS A 485 4.328 4.202 40.637 1.00 13.03 C ATOM 563 CG HIS A 485 4.225 4.875 41.980 1.00 14.58 C ATOM 564 ND1 HIS A 485 3.632 4.267 43.048 1.00 15.10 N ATOM 565 CD2 HIS A 485 4.733 6.047 42.430 1.00 17.08 C ATOM 566 CE1 HIS A 485 3.736 5.047 44.120 1.00 19.30 C ATOM 567 NE2 HIS A 485 4.398 6.146 43.758 1.00 18.35 N ATOM 568 H HIS A 485 7.198 3.743 40.642 1.00 0.00 H ATOM 569 N ILE A 486 6.224 1.267 39.310 1.00 14.82 N ATOM 570 CA ILE A 486 6.295 0.220 38.303 1.00 14.65 C ATOM 571 C ILE A 486 6.690 -1.080 39.003 1.00 18.48 C ATOM 572 O ILE A 486 7.516 -1.061 39.922 1.00 15.92 O ATOM 573 CB ILE A 486 7.303 0.579 37.178 1.00 17.47 C ATOM 574 CG1 ILE A 486 6.838 1.838 36.442 1.00 14.89 C ATOM 575 CG2 ILE A 486 7.476 -0.565 36.202 1.00 16.54 C ATOM 576 CD1 ILE A 486 7.776 2.306 35.351 1.00 16.91 C ATOM 577 H ILE A 486 7.024 1.381 39.965 1.00 0.00 H ATOM 578 N VAL A 487 6.056 -2.191 38.619 1.00 14.75 N ATOM 579 CA VAL A 487 6.330 -3.485 39.254 1.00 16.72 C ATOM 580 C VAL A 487 7.829 -3.788 39.250 1.00 17.32 C ATOM 581 O VAL A 487 8.539 -3.514 38.279 1.00 16.39 O ATOM 582 CB VAL A 487 5.578 -4.656 38.583 1.00 17.91 C ATOM 583 CG1 VAL A 487 4.081 -4.536 38.802 1.00 19.60 C ATOM 584 CG2 VAL A 487 5.911 -4.728 37.092 1.00 18.63 C ATOM 585 H VAL A 487 5.353 -2.138 37.854 1.00 0.00 H ATOM 586 N LYS A 488 8.312 -4.328 40.361 1.00 17.15 N ATOM 587 CA LYS A 488 9.743 -4.539 40.533 1.00 22.05 C ATOM 588 C LYS A 488 10.186 -5.927 40.053 1.00 19.96 C ATOM 589 O LYS A 488 9.590 -6.946 40.424 1.00 17.70 O ATOM 590 CB LYS A 488 10.109 -4.343 42.012 1.00 20.01 C ATOM 591 CG LYS A 488 11.549 -4.701 42.369 1.00 23.45 C ATOM 592 CD LYS A 488 11.793 -4.353 43.840 1.00 31.59 C ATOM 593 CE LYS A 488 12.822 -5.272 44.485 1.00 40.85 C ATOM 594 NZ LYS A 488 12.867 -5.056 45.965 1.00 49.34 N ATOM 595 HZ1 LYS A 488 13.126 -4.068 46.162 1.00 0.00 H ATOM 596 HZ2 LYS A 488 11.932 -5.258 46.372 1.00 0.00 H ATOM 597 HZ3 LYS A 488 13.574 -5.692 46.386 1.00 0.00 H ATOM 598 H LYS A 488 7.659 -4.605 41.121 1.00 0.00 H ATOM 599 N LEU A 489 11.213 -5.969 39.210 1.00 16.50 N ATOM 600 CA LEU A 489 11.841 -7.233 38.869 1.00 19.39 C ATOM 601 C LEU A 489 12.883 -7.532 39.941 1.00 26.69 C ATOM 602 O LEU A 489 13.728 -6.678 40.259 1.00 23.97 O ATOM 603 CB LEU A 489 12.494 -7.181 37.485 1.00 21.28 C ATOM 604 CG LEU A 489 13.202 -8.447 36.981 1.00 22.60 C ATOM 605 CD1 LEU A 489 13.007 -8.598 35.478 1.00 23.82 C ATOM 606 CD2 LEU A 489 14.695 -8.411 37.295 1.00 23.27 C ATOM 607 H LEU A 489 11.570 -5.087 38.790 1.00 0.00 H ATOM 608 N ILE A 490 12.825 -8.733 40.507 1.00 21.20 N ATOM 609 CA ILE A 490 13.772 -9.106 41.559 1.00 23.70 C ATOM 610 C ILE A 490 15.023 -9.756 40.973 1.00 28.33 C ATOM 611 O ILE A 490 16.148 -9.505 41.417 1.00 29.55 O ATOM 612 CB ILE A 490 13.130 -10.029 42.621 1.00 29.17 C ATOM 613 CG1 ILE A 490 12.037 -9.275 43.381 1.00 26.52 C ATOM 614 CG2 ILE A 490 14.184 -10.540 43.600 1.00 29.43 C ATOM 615 CD1 ILE A 490 11.441 -10.051 44.539 1.00 22.77 C ATOM 616 H ILE A 490 12.101 -9.413 40.200 1.00 0.00 H ATOM 617 N GLY A 491 14.829 -10.593 39.966 1.00 25.09 N ATOM 618 CA GLY A 491 15.950 -11.224 39.305 1.00 29.55 C ATOM 619 C GLY A 491 15.512 -12.135 38.186 1.00 29.08 C ATOM 620 O GLY A 491 14.320 -12.312 37.928 1.00 23.23 O ATOM 621 H GLY A 491 13.861 -10.799 39.647 1.00 0.00 H ATOM 622 N ILE A 492 16.491 -12.710 37.505 1.00 29.79 N ATOM 623 CA ILE A 492 16.222 -13.579 36.374 1.00 31.82 C ATOM 624 C ILE A 492 17.050 -14.853 36.509 1.00 36.90 C ATOM 625 O ILE A 492 18.276 -14.807 36.447 1.00 40.52 O ATOM 626 CB ILE A 492 16.560 -12.882 35.045 1.00 32.74 C ATOM 627 CG1 ILE A 492 15.687 -11.636 34.858 1.00 29.04 C ATOM 628 CG2 ILE A 492 16.373 -13.836 33.878 1.00 35.82 C ATOM 629 CD1 ILE A 492 16.110 -10.719 33.701 1.00 26.70 C ATOM 630 H ILE A 492 17.477 -12.535 37.787 1.00 0.00 H ATOM 631 N ILE A 493 16.382 -15.983 36.734 1.00 36.93 N ATOM 632 CA ILE A 493 17.049 -17.282 36.671 1.00 38.74 C ATOM 633 C ILE A 493 17.198 -17.627 35.195 1.00 37.75 C ATOM 634 O ILE A 493 16.247 -18.063 34.551 1.00 37.71 O ATOM 635 CB ILE A 493 16.260 -18.377 37.421 1.00 38.46 C ATOM 636 CG1 ILE A 493 16.262 -18.091 38.922 1.00 35.06 C ATOM 637 CG2 ILE A 493 16.868 -19.755 37.169 1.00 44.09 C ATOM 638 CD1 ILE A 493 15.251 -18.904 39.709 1.00 38.87 C ATOM 639 H ILE A 493 15.367 -15.940 36.959 1.00 0.00 H ATOM 640 N GLU A 494 18.395 -17.402 34.658 1.00 43.73 N ATOM 641 CA GLU A 494 18.625 -17.496 33.215 1.00 42.36 C ATOM 642 C GLU A 494 18.552 -18.922 32.685 1.00 39.68 C ATOM 643 O GLU A 494 18.350 -19.124 31.489 1.00 44.13 O ATOM 644 CB GLU A 494 19.966 -16.858 32.836 1.00 44.77 C ATOM 645 H GLU A 494 19.189 -17.152 35.281 1.00 0.00 H TER 646 GLU A 494 ATOM 647 N PRO A 497 14.970 -24.050 32.166 1.00 40.73 N ATOM 648 CA PRO A 497 13.786 -23.250 31.827 1.00 40.68 C ATOM 649 C PRO A 497 13.883 -21.857 32.450 1.00 39.07 C ATOM 650 O PRO A 497 14.046 -21.741 33.669 1.00 38.45 O ATOM 651 CB PRO A 497 12.635 -24.046 32.447 1.00 36.70 C ATOM 652 CG PRO A 497 13.265 -24.781 33.591 1.00 39.92 C ATOM 653 CD PRO A 497 14.675 -25.094 33.166 1.00 37.87 C ATOM 654 HN2 PRO A 497 15.702 -23.418 32.548 1.00 0.00 H ATOM 655 HN1 PRO A 497 15.324 -24.506 31.301 1.00 0.00 H ATOM 656 N THR A 498 13.794 -20.818 31.623 1.00 37.08 N ATOM 657 CA THR A 498 14.035 -19.444 32.078 1.00 38.03 C ATOM 658 C THR A 498 12.863 -18.811 32.851 1.00 32.39 C ATOM 659 O THR A 498 11.746 -18.730 32.346 1.00 36.16 O ATOM 660 CB THR A 498 14.474 -18.532 30.908 1.00 39.98 C ATOM 661 OG1 THR A 498 15.820 -18.853 30.537 1.00 45.43 O ATOM 662 CG2 THR A 498 14.417 -17.062 31.309 1.00 37.65 C ATOM 663 HG1 THR A 498 16.418 -18.709 31.313 1.00 0.00 H ATOM 664 H THR A 498 13.547 -20.985 30.627 1.00 0.00 H ATOM 665 N TRP A 499 13.147 -18.354 34.072 1.00 33.58 N ATOM 666 CA TRP A 499 12.149 -17.742 34.958 1.00 30.17 C ATOM 667 C TRP A 499 12.451 -16.268 35.246 1.00 29.12 C ATOM 668 O TRP A 499 13.571 -15.934 35.636 1.00 24.79 O ATOM 669 CB TRP A 499 12.118 -18.465 36.305 1.00 25.45 C ATOM 670 CG TRP A 499 11.572 -19.866 36.263 1.00 31.51 C ATOM 671 CD1 TRP A 499 11.085 -20.532 35.174 1.00 31.85 C ATOM 672 CD2 TRP A 499 11.451 -20.768 37.375 1.00 29.79 C ATOM 673 NE1 TRP A 499 10.672 -21.795 35.543 1.00 27.41 N ATOM 674 CE2 TRP A 499 10.883 -21.959 36.887 1.00 27.48 C ATOM 675 CE3 TRP A 499 11.770 -20.678 38.737 1.00 30.70 C ATOM 676 CZ2 TRP A 499 10.635 -23.056 37.708 1.00 29.71 C ATOM 677 CZ3 TRP A 499 11.521 -21.774 39.553 1.00 29.63 C ATOM 678 CH2 TRP A 499 10.964 -22.946 39.033 1.00 26.84 C ATOM 679 HE1 TRP A 499 10.266 -22.508 34.904 1.00 0.00 H ATOM 680 H TRP A 499 14.126 -18.436 34.414 1.00 0.00 H ATOM 681 N ILE A 500 11.444 -15.405 35.091 1.00 24.61 N ATOM 682 CA ILE A 500 11.558 -14.002 35.508 1.00 22.86 C ATOM 683 C ILE A 500 10.919 -13.853 36.885 1.00 21.24 C ATOM 684 O ILE A 500 9.718 -14.078 37.048 1.00 19.64 O ATOM 685 CB ILE A 500 10.852 -13.033 34.536 1.00 20.42 C ATOM 686 CG1 ILE A 500 11.119 -13.408 33.077 1.00 23.32 C ATOM 687 CG2 ILE A 500 11.288 -11.586 34.797 1.00 22.17 C ATOM 688 CD1 ILE A 500 12.587 -13.635 32.723 1.00 31.06 C ATOM 689 H ILE A 500 10.555 -15.735 34.664 1.00 0.00 H ATOM 690 N ILE A 501 11.712 -13.488 37.883 1.00 18.64 N ATOM 691 CA ILE A 501 11.192 -13.371 39.237 1.00 17.99 C ATOM 692 C ILE A 501 10.776 -11.929 39.533 1.00 21.93 C ATOM 693 O ILE A 501 11.617 -11.033 39.676 1.00 18.13 O ATOM 694 CB ILE A 501 12.229 -13.848 40.244 1.00 20.00 C ATOM 695 CG1 ILE A 501 12.715 -15.239 39.832 1.00 26.42 C ATOM 696 CG2 ILE A 501 11.642 -13.899 41.642 1.00 18.54 C ATOM 697 CD1 ILE A 501 13.982 -15.638 40.515 1.00 38.19 C ATOM 698 H ILE A 501 12.714 -13.284 37.696 1.00 0.00 H ATOM 699 N MET A 502 9.469 -11.709 39.605 1.00 18.82 N ATOM 700 CA MET A 502 8.929 -10.392 39.906 1.00 20.55 C ATOM 701 C MET A 502 8.477 -10.348 41.355 1.00 21.19 C ATOM 702 O MET A 502 8.132 -11.376 41.947 1.00 22.18 O ATOM 703 CB MET A 502 7.749 -10.083 38.980 1.00 18.43 C ATOM 704 CG MET A 502 8.075 -10.242 37.500 1.00 17.62 C ATOM 705 SD MET A 502 9.286 -9.007 36.947 1.00 20.95 S ATOM 706 CE MET A 502 8.283 -7.517 37.025 1.00 20.15 C ATOM 707 H MET A 502 8.813 -12.499 39.442 1.00 0.00 H ATOM 708 N GLU A 503 8.462 -9.161 41.937 1.00 16.83 N ATOM 709 CA GLU A 503 7.859 -9.022 43.252 1.00 19.54 C ATOM 710 C GLU A 503 6.357 -9.270 43.117 1.00 21.77 C ATOM 711 O GLU A 503 5.743 -8.850 42.131 1.00 19.19 O ATOM 712 CB GLU A 503 8.115 -7.632 43.835 1.00 24.33 C ATOM 713 CG GLU A 503 7.456 -7.437 45.195 1.00 21.92 C ATOM 714 CD GLU A 503 8.034 -6.261 45.965 1.00 34.01 C ATOM 715 OE1 GLU A 503 8.985 -5.630 45.457 1.00 33.49 O ATOM 716 OE2 GLU A 503 7.531 -5.971 47.075 1.00 38.04 O ATOM 717 H GLU A 503 8.877 -8.336 41.459 1.00 0.00 H ATOM 718 N LEU A 504 5.768 -9.980 44.082 1.00 19.95 N ATOM 719 CA LEU A 504 4.335 -10.254 44.047 1.00 20.96 C ATOM 720 C LEU A 504 3.634 -9.190 44.864 1.00 21.55 C ATOM 721 O LEU A 504 4.090 -8.835 45.945 1.00 23.13 O ATOM 722 CB LEU A 504 4.016 -11.635 44.640 1.00 19.48 C ATOM 723 CG LEU A 504 2.527 -12.010 44.733 1.00 25.65 C ATOM 724 CD1 LEU A 504 1.973 -12.385 43.353 1.00 21.40 C ATOM 725 CD2 LEU A 504 2.303 -13.149 45.737 1.00 25.60 C ATOM 726 H LEU A 504 6.339 -10.344 44.871 1.00 0.00 H ATOM 727 N TYR A 505 2.537 -8.673 44.333 1.00 19.46 N ATOM 728 CA TYR A 505 1.685 -7.742 45.060 1.00 19.56 C ATOM 729 C TYR A 505 0.376 -8.490 45.266 1.00 21.49 C ATOM 730 O TYR A 505 -0.350 -8.745 44.307 1.00 23.42 O ATOM 731 CB TYR A 505 1.522 -6.453 44.246 1.00 15.57 C ATOM 732 CG TYR A 505 2.869 -5.873 43.855 1.00 17.26 C ATOM 733 CD1 TYR A 505 3.343 -5.965 42.551 1.00 18.82 C ATOM 734 CD2 TYR A 505 3.691 -5.285 44.804 1.00 18.20 C ATOM 735 CE1 TYR A 505 4.598 -5.450 42.199 1.00 18.83 C ATOM 736 CE2 TYR A 505 4.947 -4.774 44.463 1.00 16.90 C ATOM 737 CZ TYR A 505 5.391 -4.863 43.163 1.00 15.26 C ATOM 738 OH TYR A 505 6.625 -4.355 42.815 1.00 18.10 O ATOM 739 HH TYR A 505 6.781 -4.504 41.849 1.00 0.00 H ATOM 740 H TYR A 505 2.274 -8.941 43.363 1.00 0.00 H ATOM 741 N PRO A 506 0.113 -8.912 46.516 1.00 28.45 N ATOM 742 CA PRO A 506 -0.989 -9.825 46.859 1.00 26.63 C ATOM 743 C PRO A 506 -2.381 -9.201 46.826 1.00 26.51 C ATOM 744 O PRO A 506 -3.342 -9.956 46.703 1.00 26.15 O ATOM 745 CB PRO A 506 -0.639 -10.287 48.283 1.00 32.95 C ATOM 746 CG PRO A 506 0.156 -9.153 48.848 1.00 33.12 C ATOM 747 CD PRO A 506 0.965 -8.616 47.683 1.00 32.67 C ATOM 748 N TYR A 507 -2.508 -7.879 46.918 1.00 25.03 N ATOM 749 CA TYR A 507 -3.825 -7.252 46.729 1.00 25.98 C ATOM 750 C TYR A 507 -4.329 -7.433 45.291 1.00 20.86 C ATOM 751 O TYR A 507 -5.518 -7.288 45.011 1.00 26.72 O ATOM 752 CB TYR A 507 -3.803 -5.760 47.075 1.00 26.28 C ATOM 753 CG TYR A 507 -3.748 -5.417 48.553 1.00 31.44 C ATOM 754 CD1 TYR A 507 -2.567 -4.979 49.137 1.00 30.99 C ATOM 755 CD2 TYR A 507 -4.883 -5.498 49.355 1.00 32.60 C ATOM 756 CE1 TYR A 507 -2.509 -4.649 50.480 1.00 35.25 C ATOM 757 CE2 TYR A 507 -4.832 -5.169 50.704 1.00 32.96 C ATOM 758 CZ TYR A 507 -3.639 -4.746 51.257 1.00 34.89 C ATOM 759 OH TYR A 507 -3.565 -4.416 52.590 1.00 44.86 O ATOM 760 HH TYR A 507 -2.641 -4.137 52.809 1.00 0.00 H ATOM 761 H TYR A 507 -1.676 -7.290 47.123 1.00 0.00 H ATOM 762 N GLY A 508 -3.424 -7.746 44.375 1.00 20.83 N ATOM 763 CA GLY A 508 -3.827 -8.064 43.016 1.00 17.55 C ATOM 764 C GLY A 508 -4.066 -6.850 42.135 1.00 16.92 C ATOM 765 O GLY A 508 -3.440 -5.791 42.331 1.00 16.58 O ATOM 766 H GLY A 508 -2.416 -7.764 44.631 1.00 0.00 H ATOM 767 N GLU A 509 -4.966 -7.009 41.162 1.00 14.55 N ATOM 768 CA GLU A 509 -5.219 -6.001 40.141 1.00 16.97 C ATOM 769 C GLU A 509 -6.031 -4.840 40.680 1.00 17.28 C ATOM 770 O GLU A 509 -6.902 -5.019 41.530 1.00 16.67 O ATOM 771 CB GLU A 509 -5.949 -6.621 38.947 1.00 19.60 C ATOM 772 CG GLU A 509 -5.227 -7.797 38.322 1.00 18.92 C ATOM 773 CD GLU A 509 -6.100 -8.540 37.321 1.00 25.41 C ATOM 774 OE1 GLU A 509 -7.200 -8.037 36.970 1.00 17.79 O ATOM 775 OE2 GLU A 509 -5.685 -9.631 36.885 1.00 24.33 O ATOM 776 H GLU A 509 -5.512 -7.894 41.131 1.00 0.00 H ATOM 777 N LEU A 510 -5.738 -3.647 40.173 1.00 14.62 N ATOM 778 CA LEU A 510 -6.408 -2.435 40.623 1.00 14.14 C ATOM 779 C LEU A 510 -7.880 -2.435 40.261 1.00 12.04 C ATOM 780 O LEU A 510 -8.701 -1.998 41.044 1.00 15.43 O ATOM 781 CB LEU A 510 -5.728 -1.190 40.017 1.00 13.23 C ATOM 782 CG LEU A 510 -6.370 0.148 40.395 1.00 11.58 C ATOM 783 CD1 LEU A 510 -6.430 0.329 41.922 1.00 12.42 C ATOM 784 CD2 LEU A 510 -5.605 1.322 39.728 1.00 12.41 C ATOM 785 H LEU A 510 -5.010 -3.577 39.434 1.00 0.00 H ATOM 786 N GLY A 511 -8.220 -2.900 39.066 1.00 10.98 N ATOM 787 CA GLY A 511 -9.629 -2.971 38.667 1.00 16.03 C ATOM 788 C GLY A 511 -10.495 -3.698 39.691 1.00 21.35 C ATOM 789 O GLY A 511 -11.498 -3.157 40.179 1.00 19.54 O ATOM 790 H GLY A 511 -7.481 -3.217 38.407 1.00 0.00 H ATOM 791 N HIS A 512 -10.096 -4.921 40.029 1.00 19.71 N ATOM 792 CA HIS A 512 -10.807 -5.712 41.034 1.00 21.04 C ATOM 793 C HIS A 512 -10.825 -5.031 42.410 1.00 22.19 C ATOM 794 O HIS A 512 -11.861 -4.991 43.079 1.00 17.39 O ATOM 795 CB HIS A 512 -10.200 -7.110 41.127 1.00 24.15 C ATOM 796 CG HIS A 512 -10.865 -7.992 42.140 1.00 33.42 C ATOM 797 ND1 HIS A 512 -10.414 -8.099 43.436 1.00 37.37 N ATOM 798 CD2 HIS A 512 -11.940 -8.805 42.040 1.00 37.34 C ATOM 799 CE1 HIS A 512 -11.188 -8.947 44.100 1.00 35.03 C ATOM 800 NE2 HIS A 512 -12.126 -9.386 43.270 1.00 35.87 N ATOM 801 H HIS A 512 -9.257 -5.326 39.567 1.00 0.00 H ATOM 802 N TYR A 513 -9.676 -4.499 42.826 1.00 17.85 N ATOM 803 CA TYR A 513 -9.570 -3.767 44.078 1.00 15.76 C ATOM 804 C TYR A 513 -10.539 -2.581 44.139 1.00 17.77 C ATOM 805 O TYR A 513 -11.146 -2.351 45.182 1.00 17.02 O ATOM 806 CB TYR A 513 -8.137 -3.272 44.279 1.00 18.73 C ATOM 807 CG TYR A 513 -7.861 -2.630 45.617 1.00 21.90 C ATOM 808 CD1 TYR A 513 -7.487 -3.399 46.715 1.00 23.87 C ATOM 809 CD2 TYR A 513 -7.930 -1.250 45.780 1.00 20.39 C ATOM 810 CE1 TYR A 513 -7.213 -2.804 47.948 1.00 27.09 C ATOM 811 CE2 TYR A 513 -7.659 -0.650 47.010 1.00 22.18 C ATOM 812 CZ TYR A 513 -7.302 -1.436 48.086 1.00 28.36 C ATOM 813 OH TYR A 513 -7.035 -0.851 49.302 1.00 27.89 O ATOM 814 HH TYR A 513 -6.797 -1.552 49.959 1.00 0.00 H ATOM 815 H TYR A 513 -8.827 -4.611 42.236 1.00 0.00 H ATOM 816 N LEU A 514 -10.666 -1.817 43.046 1.00 13.48 N ATOM 817 CA LEU A 514 -11.624 -0.695 43.007 1.00 14.79 C ATOM 818 C LEU A 514 -13.072 -1.167 43.168 1.00 18.33 C ATOM 819 O LEU A 514 -13.862 -0.565 43.896 1.00 18.31 O ATOM 820 CB LEU A 514 -11.502 0.096 41.703 1.00 12.65 C ATOM 821 CG LEU A 514 -10.180 0.822 41.468 1.00 13.56 C ATOM 822 CD1 LEU A 514 -10.098 1.315 40.030 1.00 12.28 C ATOM 823 CD2 LEU A 514 -10.039 1.978 42.450 1.00 12.34 C ATOM 824 H LEU A 514 -10.080 -2.018 42.211 1.00 0.00 H ATOM 825 N GLU A 515 -13.410 -2.246 42.476 1.00 17.29 N ATOM 826 CA GLU A 515 -14.772 -2.773 42.485 1.00 20.75 C ATOM 827 C GLU A 515 -15.140 -3.278 43.872 1.00 26.28 C ATOM 828 O GLU A 515 -16.207 -2.960 44.386 1.00 26.11 O ATOM 829 CB GLU A 515 -14.933 -3.868 41.415 1.00 23.91 C ATOM 830 CG GLU A 515 -14.892 -3.292 39.990 1.00 27.31 C ATOM 831 CD GLU A 515 -14.603 -4.322 38.909 1.00 36.30 C ATOM 832 OE1 GLU A 515 -14.429 -5.516 39.236 1.00 39.29 O ATOM 833 OE2 GLU A 515 -14.538 -3.930 37.722 1.00 45.46 O ATOM 834 H GLU A 515 -12.684 -2.731 41.910 1.00 0.00 H ATOM 835 N ARG A 516 -14.236 -4.029 44.486 1.00 21.75 N ATOM 836 CA ARG A 516 -14.470 -4.581 45.818 1.00 23.10 C ATOM 837 C ARG A 516 -14.537 -3.499 46.877 1.00 29.60 C ATOM 838 O ARG A 516 -15.265 -3.635 47.850 1.00 28.94 O ATOM 839 CB ARG A 516 -13.373 -5.584 46.185 1.00 28.33 C ATOM 840 H ARG A 516 -13.336 -4.231 44.006 1.00 0.00 H ATOM 841 N ASN A 517 -13.791 -2.412 46.691 1.00 25.33 N ATOM 842 CA ASN A 517 -13.679 -1.417 47.752 1.00 25.26 C ATOM 843 C ASN A 517 -14.354 -0.091 47.471 1.00 24.48 C ATOM 844 O ASN A 517 -14.079 0.904 48.139 1.00 27.08 O ATOM 845 CB ASN A 517 -12.214 -1.215 48.139 1.00 24.79 C ATOM 846 CG ASN A 517 -11.606 -2.471 48.709 1.00 30.79 C ATOM 847 OD1 ASN A 517 -11.989 -2.910 49.790 1.00 33.39 O ATOM 848 ND2 ASN A 517 -10.672 -3.074 47.978 1.00 26.55 N ATOM 849 HD22 ASN A 517 -10.379 -2.665 47.068 1.00 0.00 H ATOM 850 HD21 ASN A 517 -10.235 -3.955 48.317 1.00 0.00 H ATOM 851 H ASN A 517 -13.289 -2.272 45.791 1.00 0.00 H ATOM 852 N LYS A 518 -15.268 -0.080 46.509 1.00 23.07 N ATOM 853 CA LYS A 518 -15.858 1.173 46.063 1.00 29.84 C ATOM 854 C LYS A 518 -16.730 1.848 47.120 1.00 32.05 C ATOM 855 O LYS A 518 -16.967 3.050 47.044 1.00 37.70 O ATOM 856 CB LYS A 518 -16.629 0.997 44.748 1.00 27.09 C ATOM 857 CG LYS A 518 -17.885 0.172 44.843 1.00 37.97 C ATOM 858 CD LYS A 518 -18.414 -0.131 43.443 1.00 34.92 C ATOM 859 CE LYS A 518 -19.865 -0.577 43.502 1.00 43.62 C ATOM 860 NZ LYS A 518 -20.171 -1.552 42.421 1.00 52.93 N ATOM 861 HZ1 LYS A 518 -19.996 -1.109 41.496 1.00 0.00 H ATOM 862 HZ2 LYS A 518 -19.561 -2.388 42.527 1.00 0.00 H ATOM 863 HZ3 LYS A 518 -21.169 -1.839 42.486 1.00 0.00 H ATOM 864 H LYS A 518 -15.565 -0.975 46.070 1.00 0.00 H ATOM 865 N ASN A 519 -17.194 1.086 48.105 1.00 28.06 N ATOM 866 CA ASN A 519 -17.968 1.673 49.194 1.00 33.33 C ATOM 867 C ASN A 519 -17.084 2.440 50.178 1.00 33.33 C ATOM 868 O ASN A 519 -17.537 3.382 50.823 1.00 36.10 O ATOM 869 CB ASN A 519 -18.780 0.597 49.931 1.00 36.26 C ATOM 870 CG ASN A 519 -19.960 0.095 49.118 1.00 35.90 C ATOM 871 OD1 ASN A 519 -20.540 0.837 48.322 1.00 42.78 O ATOM 872 ND2 ASN A 519 -20.323 -1.172 49.316 1.00 42.73 N ATOM 873 HD22 ASN A 519 -19.804 -1.761 49.998 1.00 0.00 H ATOM 874 HD21 ASN A 519 -21.125 -1.572 48.788 1.00 0.00 H ATOM 875 H ASN A 519 -17.004 0.064 48.100 1.00 0.00 H ATOM 876 N SER A 520 -15.819 2.040 50.277 1.00 30.45 N ATOM 877 CA SER A 520 -14.900 2.622 51.257 1.00 33.41 C ATOM 878 C SER A 520 -13.851 3.588 50.680 1.00 32.79 C ATOM 879 O SER A 520 -13.295 4.408 51.408 1.00 34.49 O ATOM 880 CB SER A 520 -14.205 1.508 52.029 1.00 30.23 C ATOM 881 OG SER A 520 -13.691 0.544 51.134 1.00 38.80 O ATOM 882 HG SER A 520 -14.433 0.159 50.604 1.00 0.00 H ATOM 883 H SER A 520 -15.473 1.293 49.641 1.00 0.00 H ATOM 884 N LEU A 521 -13.579 3.501 49.382 1.00 26.63 N ATOM 885 CA LEU A 521 -12.570 4.366 48.757 1.00 26.62 C ATOM 886 C LEU A 521 -13.006 5.832 48.635 1.00 28.30 C ATOM 887 O LEU A 521 -14.138 6.134 48.240 1.00 27.68 O ATOM 888 CB LEU A 521 -12.158 3.822 47.381 1.00 24.27 C ATOM 889 CG LEU A 521 -11.175 2.659 47.420 1.00 29.08 C ATOM 890 CD1 LEU A 521 -11.068 1.975 46.051 1.00 24.82 C ATOM 891 CD2 LEU A 521 -9.804 3.163 47.886 1.00 26.15 C ATOM 892 H LEU A 521 -14.090 2.808 48.798 1.00 0.00 H ATOM 893 N LYS A 522 -12.097 6.745 48.972 1.00 24.55 N ATOM 894 CA LYS A 522 -12.374 8.169 48.830 1.00 22.26 C ATOM 895 C LYS A 522 -11.682 8.728 47.584 1.00 22.80 C ATOM 896 O LYS A 522 -10.682 8.177 47.116 1.00 24.73 O ATOM 897 CB LYS A 522 -11.916 8.941 50.073 1.00 28.61 C ATOM 898 CG LYS A 522 -12.266 8.287 51.397 1.00 33.42 C ATOM 899 CD LYS A 522 -13.762 8.100 51.571 1.00 33.86 C ATOM 900 CE LYS A 522 -14.462 9.394 51.931 1.00 41.45 C ATOM 901 NZ LYS A 522 -15.719 9.124 52.699 1.00 44.75 N ATOM 902 HZ1 LYS A 522 -16.360 8.546 52.120 1.00 0.00 H ATOM 903 HZ2 LYS A 522 -15.486 8.614 53.575 1.00 0.00 H ATOM 904 HZ3 LYS A 522 -16.181 10.026 52.934 1.00 0.00 H ATOM 905 H LYS A 522 -11.175 6.437 49.342 1.00 0.00 H ATOM 906 N VAL A 523 -12.226 9.818 47.051 1.00 21.51 N ATOM 907 CA VAL A 523 -11.694 10.447 45.847 1.00 22.83 C ATOM 908 C VAL A 523 -10.228 10.859 45.969 1.00 21.89 C ATOM 909 O VAL A 523 -9.493 10.817 44.981 1.00 20.43 O ATOM 910 CB VAL A 523 -12.537 11.658 45.444 1.00 26.62 C ATOM 911 CG1 VAL A 523 -12.038 12.252 44.123 1.00 24.71 C ATOM 912 CG2 VAL A 523 -13.998 11.250 45.329 1.00 31.38 C ATOM 913 H VAL A 523 -13.061 10.237 47.509 1.00 0.00 H ATOM 914 N LEU A 524 -9.795 11.272 47.163 1.00 20.23 N ATOM 915 CA LEU A 524 -8.380 11.611 47.352 1.00 20.20 C ATOM 916 C LEU A 524 -7.491 10.427 46.954 1.00 19.01 C ATOM 917 O LEU A 524 -6.404 10.601 46.394 1.00 15.97 O ATOM 918 CB LEU A 524 -8.098 12.002 48.808 1.00 20.01 C ATOM 919 CG LEU A 524 -6.648 12.306 49.178 1.00 23.36 C ATOM 920 CD1 LEU A 524 -6.211 13.628 48.562 1.00 22.56 C ATOM 921 CD2 LEU A 524 -6.466 12.352 50.684 1.00 26.00 C ATOM 922 H LEU A 524 -10.460 11.353 47.958 1.00 0.00 H ATOM 923 N THR A 525 -7.956 9.216 47.224 1.00 17.93 N ATOM 924 CA THR A 525 -7.122 8.038 46.959 1.00 17.00 C ATOM 925 C THR A 525 -7.093 7.708 45.473 1.00 16.06 C ATOM 926 O THR A 525 -6.052 7.317 44.938 1.00 15.76 O ATOM 927 CB THR A 525 -7.600 6.810 47.748 1.00 19.26 C ATOM 928 OG1 THR A 525 -7.548 7.103 49.147 1.00 21.75 O ATOM 929 CG2 THR A 525 -6.719 5.593 47.450 1.00 18.33 C ATOM 930 HG1 THR A 525 -7.855 6.314 49.660 1.00 0.00 H ATOM 931 H THR A 525 -8.910 9.101 47.623 1.00 0.00 H ATOM 932 N LEU A 526 -8.235 7.855 44.810 1.00 16.32 N ATOM 933 CA LEU A 526 -8.298 7.661 43.360 1.00 16.73 C ATOM 934 C LEU A 526 -7.413 8.686 42.632 1.00 15.66 C ATOM 935 O LEU A 526 -6.779 8.372 41.620 1.00 13.24 O ATOM 936 CB LEU A 526 -9.734 7.798 42.877 1.00 14.08 C ATOM 937 CG LEU A 526 -10.746 6.887 43.593 1.00 16.86 C ATOM 938 CD1 LEU A 526 -12.156 7.174 43.096 1.00 19.46 C ATOM 939 CD2 LEU A 526 -10.384 5.436 43.396 1.00 16.55 C ATOM 940 H LEU A 526 -9.098 8.112 45.330 1.00 0.00 H ATOM 941 N VAL A 527 -7.377 9.913 43.135 1.00 13.47 N ATOM 942 CA VAL A 527 -6.473 10.919 42.564 1.00 11.43 C ATOM 943 C VAL A 527 -5.016 10.561 42.840 1.00 11.38 C ATOM 944 O VAL A 527 -4.148 10.770 42.000 1.00 14.12 O ATOM 945 CB VAL A 527 -6.727 12.317 43.137 1.00 14.71 C ATOM 946 CG1 VAL A 527 -5.702 13.298 42.591 1.00 12.54 C ATOM 947 CG2 VAL A 527 -8.143 12.782 42.797 1.00 15.05 C ATOM 948 H VAL A 527 -7.991 10.163 43.936 1.00 0.00 H ATOM 949 N LEU A 528 -4.741 10.035 44.021 1.00 13.63 N ATOM 950 CA LEU A 528 -3.391 9.560 44.333 1.00 15.60 C ATOM 951 C LEU A 528 -2.938 8.440 43.385 1.00 13.98 C ATOM 952 O LEU A 528 -1.798 8.424 42.929 1.00 13.23 O ATOM 953 CB LEU A 528 -3.316 9.063 45.776 1.00 15.32 C ATOM 954 CG LEU A 528 -1.965 8.501 46.244 1.00 17.67 C ATOM 955 CD1 LEU A 528 -0.867 9.585 46.241 1.00 19.28 C ATOM 956 CD2 LEU A 528 -2.089 7.864 47.623 1.00 18.92 C ATOM 957 H LEU A 528 -5.492 9.958 44.737 1.00 0.00 H ATOM 958 N TYR A 529 -3.817 7.485 43.105 1.00 10.56 N ATOM 959 CA TYR A 529 -3.456 6.408 42.171 1.00 13.25 C ATOM 960 C TYR A 529 -3.134 6.970 40.787 1.00 11.87 C ATOM 961 O TYR A 529 -2.196 6.528 40.130 1.00 10.63 O ATOM 962 CB TYR A 529 -4.606 5.420 42.010 1.00 11.49 C ATOM 963 CG TYR A 529 -4.916 4.611 43.243 1.00 12.70 C ATOM 964 CD1 TYR A 529 -4.016 4.515 44.298 1.00 15.29 C ATOM 965 CD2 TYR A 529 -6.120 3.951 43.352 1.00 14.61 C ATOM 966 CE1 TYR A 529 -4.326 3.750 45.444 1.00 17.83 C ATOM 967 CE2 TYR A 529 -6.431 3.193 44.466 1.00 14.16 C ATOM 968 CZ TYR A 529 -5.538 3.087 45.500 1.00 17.74 C ATOM 969 OH TYR A 529 -5.905 2.328 46.596 1.00 20.26 O ATOM 970 HH TYR A 529 -5.173 2.337 47.262 1.00 0.00 H ATOM 971 H TYR A 529 -4.759 7.499 43.545 1.00 0.00 H ATOM 972 N SER A 530 -3.959 7.900 40.334 1.00 8.85 N ATOM 973 CA SER A 530 -3.755 8.568 39.047 1.00 10.02 C ATOM 974 C SER A 530 -2.396 9.285 38.988 1.00 13.46 C ATOM 975 O SER A 530 -1.636 9.166 38.008 1.00 13.40 O ATOM 976 CB SER A 530 -4.902 9.566 38.794 1.00 11.26 C ATOM 977 OG SER A 530 -6.164 8.890 38.736 1.00 14.85 O ATOM 978 HG SER A 530 -6.328 8.426 39.595 1.00 0.00 H ATOM 979 H SER A 530 -4.781 8.166 40.912 1.00 0.00 H ATOM 980 N LEU A 531 -2.097 10.045 40.033 1.00 12.84 N ATOM 981 CA LEU A 531 -0.823 10.757 40.125 1.00 11.38 C ATOM 982 C LEU A 531 0.365 9.775 40.107 1.00 12.90 C ATOM 983 O LEU A 531 1.377 10.022 39.466 1.00 13.01 O ATOM 984 CB LEU A 531 -0.811 11.590 41.406 1.00 11.71 C ATOM 985 CG LEU A 531 0.472 12.327 41.822 1.00 16.91 C ATOM 986 CD1 LEU A 531 0.976 13.230 40.697 1.00 15.77 C ATOM 987 CD2 LEU A 531 0.221 13.151 43.105 1.00 14.41 C ATOM 988 H LEU A 531 -2.786 10.137 40.807 1.00 0.00 H ATOM 989 N GLN A 532 0.245 8.659 40.809 1.00 12.17 N ATOM 990 CA GLN A 532 1.340 7.673 40.862 1.00 12.82 C ATOM 991 C GLN A 532 1.617 7.045 39.490 1.00 13.34 C ATOM 992 O GLN A 532 2.768 6.827 39.109 1.00 13.96 O ATOM 993 CB GLN A 532 1.025 6.584 41.914 1.00 13.91 C ATOM 994 CG GLN A 532 1.055 7.109 43.368 1.00 16.66 C ATOM 995 CD GLN A 532 0.607 6.083 44.395 1.00 18.03 C ATOM 996 OE1 GLN A 532 -0.008 5.070 44.054 1.00 16.35 O ATOM 997 NE2 GLN A 532 0.910 6.346 45.666 1.00 19.48 N ATOM 998 HE22 GLN A 532 1.430 7.213 45.908 1.00 0.00 H ATOM 999 HE21 GLN A 532 0.626 5.684 46.416 1.00 0.00 H ATOM 1000 H GLN A 532 -0.635 8.475 41.331 1.00 0.00 H ATOM 1001 N ILE A 533 0.550 6.751 38.755 1.00 12.45 N ATOM 1002 CA ILE A 533 0.679 6.182 37.416 1.00 12.97 C ATOM 1003 C ILE A 533 1.271 7.235 36.484 1.00 13.64 C ATOM 1004 O ILE A 533 2.097 6.935 35.635 1.00 13.87 O ATOM 1005 CB ILE A 533 -0.682 5.691 36.895 1.00 11.44 C ATOM 1006 CG1 ILE A 533 -1.192 4.536 37.782 1.00 12.62 C ATOM 1007 CG2 ILE A 533 -0.606 5.233 35.444 1.00 13.49 C ATOM 1008 CD1 ILE A 533 -0.189 3.381 37.936 1.00 17.78 C ATOM 1009 H ILE A 533 -0.399 6.930 39.142 1.00 0.00 H ATOM 1010 N CYS A 534 0.856 8.482 36.669 1.00 15.74 N ATOM 1011 CA CYS A 534 1.348 9.585 35.851 1.00 12.78 C ATOM 1012 C CYS A 534 2.846 9.772 36.034 1.00 14.41 C ATOM 1013 O CYS A 534 3.573 10.028 35.078 1.00 15.74 O ATOM 1014 CB CYS A 534 0.617 10.887 36.210 1.00 14.59 C ATOM 1015 SG CYS A 534 0.825 12.179 34.959 1.00 16.22 S ATOM 1016 H CYS A 534 0.161 8.678 37.418 1.00 0.00 H ATOM 1017 N LYS A 535 3.307 9.660 37.272 1.00 12.50 N ATOM 1018 CA LYS A 535 4.739 9.726 37.539 1.00 16.57 C ATOM 1019 C LYS A 535 5.463 8.561 36.888 1.00 19.78 C ATOM 1020 O LYS A 535 6.552 8.731 36.346 1.00 15.21 O ATOM 1021 CB LYS A 535 5.007 9.754 39.044 1.00 15.75 C ATOM 1022 CG LYS A 535 4.563 11.049 39.705 1.00 18.37 C ATOM 1023 CD LYS A 535 4.731 10.977 41.225 1.00 19.60 C ATOM 1024 CE LYS A 535 4.466 12.326 41.875 1.00 26.46 C ATOM 1025 NZ LYS A 535 4.676 12.248 43.361 1.00 26.98 N ATOM 1026 HZ1 LYS A 535 4.025 11.545 43.765 1.00 0.00 H ATOM 1027 HZ2 LYS A 535 5.658 11.966 43.557 1.00 0.00 H ATOM 1028 HZ3 LYS A 535 4.490 13.179 43.786 1.00 0.00 H ATOM 1029 H LYS A 535 2.642 9.524 38.060 1.00 0.00 H ATOM 1030 N ALA A 536 4.860 7.375 36.935 1.00 12.86 N ATOM 1031 CA ALA A 536 5.473 6.230 36.253 1.00 16.74 C ATOM 1032 C ALA A 536 5.598 6.497 34.747 1.00 17.96 C ATOM 1033 O ALA A 536 6.627 6.194 34.130 1.00 15.27 O ATOM 1034 CB ALA A 536 4.695 4.956 36.509 1.00 15.77 C ATOM 1035 H ALA A 536 3.964 7.261 37.450 1.00 0.00 H ATOM 1036 N MET A 537 4.558 7.082 34.162 1.00 14.31 N ATOM 1037 CA MET A 537 4.567 7.393 32.728 1.00 16.98 C ATOM 1038 C MET A 537 5.574 8.487 32.385 1.00 17.60 C ATOM 1039 O MET A 537 6.260 8.405 31.366 1.00 20.68 O ATOM 1040 CB MET A 537 3.170 7.787 32.218 1.00 16.41 C ATOM 1041 CG MET A 537 2.127 6.660 32.234 1.00 19.60 C ATOM 1042 SD MET A 537 2.742 5.165 31.425 1.00 23.34 S ATOM 1043 CE MET A 537 3.228 5.783 29.800 1.00 27.75 C ATOM 1044 H MET A 537 3.722 7.324 34.731 1.00 0.00 H ATOM 1045 N ALA A 538 5.651 9.513 33.223 1.00 16.76 N ATOM 1046 CA ALA A 538 6.628 10.584 33.020 1.00 19.81 C ATOM 1047 C ALA A 538 8.042 10.005 33.023 1.00 21.42 C ATOM 1048 O ALA A 538 8.889 10.408 32.241 1.00 20.58 O ATOM 1049 CB ALA A 538 6.498 11.647 34.090 1.00 16.69 C ATOM 1050 H ALA A 538 5.006 9.557 34.038 1.00 0.00 H ATOM 1051 N TYR A 539 8.283 9.059 33.921 1.00 18.90 N ATOM 1052 CA TYR A 539 9.563 8.367 33.994 1.00 20.32 C ATOM 1053 C TYR A 539 9.844 7.602 32.701 1.00 22.35 C ATOM 1054 O TYR A 539 10.887 7.788 32.081 1.00 23.10 O ATOM 1055 CB TYR A 539 9.550 7.427 35.185 1.00 19.84 C ATOM 1056 CG TYR A 539 10.654 6.406 35.200 1.00 26.65 C ATOM 1057 CD1 TYR A 539 11.967 6.779 35.449 1.00 28.67 C ATOM 1058 CD2 TYR A 539 10.376 5.060 35.020 1.00 26.24 C ATOM 1059 CE1 TYR A 539 12.984 5.831 35.493 1.00 36.19 C ATOM 1060 CE2 TYR A 539 11.382 4.108 35.064 1.00 27.85 C ATOM 1061 CZ TYR A 539 12.679 4.499 35.300 1.00 28.90 C ATOM 1062 OH TYR A 539 13.666 3.546 35.339 1.00 33.25 O ATOM 1063 HH TYR A 539 14.537 3.982 35.517 1.00 0.00 H ATOM 1064 H TYR A 539 7.534 8.803 34.595 1.00 0.00 H ATOM 1065 N LEU A 540 8.910 6.743 32.306 1.00 20.51 N ATOM 1066 CA LEU A 540 9.037 5.974 31.068 1.00 21.26 C ATOM 1067 C LEU A 540 9.321 6.877 29.874 1.00 27.55 C ATOM 1068 O LEU A 540 10.203 6.584 29.063 1.00 30.94 O ATOM 1069 CB LEU A 540 7.798 5.122 30.816 1.00 19.82 C ATOM 1070 CG LEU A 540 7.564 3.961 31.785 1.00 20.60 C ATOM 1071 CD1 LEU A 540 6.305 3.152 31.404 1.00 20.10 C ATOM 1072 CD2 LEU A 540 8.797 3.030 31.891 1.00 23.78 C ATOM 1073 H LEU A 540 8.063 6.614 32.895 1.00 0.00 H ATOM 1074 N GLU A 541 8.588 7.981 29.777 1.00 22.53 N ATOM 1075 CA GLU A 541 8.838 8.966 28.737 1.00 28.44 C ATOM 1076 C GLU A 541 10.286 9.456 28.757 1.00 30.93 C ATOM 1077 O GLU A 541 10.921 9.587 27.711 1.00 37.53 O ATOM 1078 CB GLU A 541 7.891 10.162 28.862 1.00 26.51 C ATOM 1079 CG GLU A 541 8.367 11.329 28.007 1.00 36.96 C ATOM 1080 CD GLU A 541 7.374 12.462 27.884 1.00 36.93 C ATOM 1081 OE1 GLU A 541 6.678 12.777 28.871 1.00 36.12 O ATOM 1082 OE2 GLU A 541 7.316 13.067 26.790 1.00 47.27 O ATOM 1083 H GLU A 541 7.820 8.144 30.459 1.00 0.00 H ATOM 1084 N SER A 542 10.807 9.723 29.950 1.00 28.63 N ATOM 1085 CA SER A 542 12.181 10.204 30.080 1.00 33.00 C ATOM 1086 C SER A 542 13.159 9.193 29.505 1.00 37.18 C ATOM 1087 O SER A 542 14.295 9.540 29.174 1.00 38.28 O ATOM 1088 CB SER A 542 12.533 10.484 31.538 1.00 28.20 C ATOM 1089 OG SER A 542 12.813 9.282 32.227 1.00 31.74 O ATOM 1090 HG SER A 542 12.018 8.693 32.198 1.00 0.00 H ATOM 1091 H SER A 542 10.229 9.588 30.804 1.00 0.00 H TER 1092 SER A 542 ATOM 1093 N CYS A 545 10.718 5.041 26.569 1.00 35.60 N ATOM 1094 CA CYS A 545 9.821 3.895 26.511 1.00 28.18 C ATOM 1095 C CYS A 545 8.355 4.346 26.516 1.00 34.97 C ATOM 1096 O CYS A 545 8.024 5.451 26.966 1.00 30.62 O ATOM 1097 CB CYS A 545 10.069 2.940 27.690 1.00 32.84 C ATOM 1098 SG CYS A 545 11.662 2.016 27.714 1.00 35.89 S ATOM 1099 HN3 CYS A 545 10.536 5.578 27.441 1.00 0.00 H ATOM 1100 HN2 CYS A 545 10.553 5.651 25.743 1.00 0.00 H ATOM 1101 HN1 CYS A 545 11.704 4.709 26.564 1.00 0.00 H ATOM 1102 N VAL A 546 7.478 3.482 26.017 1.00 35.11 N ATOM 1103 CA VAL A 546 6.044 3.707 26.095 1.00 36.41 C ATOM 1104 C VAL A 546 5.414 2.573 26.878 1.00 38.28 C ATOM 1105 O VAL A 546 6.070 1.595 27.240 1.00 37.43 O ATOM 1106 CB VAL A 546 5.372 3.714 24.706 1.00 38.67 C ATOM 1107 CG1 VAL A 546 6.050 4.699 23.775 1.00 37.29 C ATOM 1108 CG2 VAL A 546 5.379 2.301 24.114 1.00 39.97 C ATOM 1109 H VAL A 546 7.828 2.618 25.556 1.00 0.00 H ATOM 1110 N HIS A 547 4.122 2.691 27.125 1.00 32.40 N ATOM 1111 CA HIS A 547 3.409 1.595 27.740 1.00 34.47 C ATOM 1112 C HIS A 547 2.082 1.403 27.024 1.00 33.41 C ATOM 1113 O HIS A 547 1.230 2.288 27.027 1.00 32.14 O ATOM 1114 CB HIS A 547 3.194 1.867 29.226 1.00 30.75 C ATOM 1115 CG HIS A 547 2.881 0.646 30.022 1.00 28.88 C ATOM 1116 ND1 HIS A 547 1.786 -0.153 29.758 1.00 28.78 N ATOM 1117 CD2 HIS A 547 3.512 0.073 31.072 1.00 30.16 C ATOM 1118 CE1 HIS A 547 1.756 -1.156 30.610 1.00 27.14 C ATOM 1119 NE2 HIS A 547 2.798 -1.040 31.428 1.00 29.02 N ATOM 1120 H HIS A 547 3.620 3.568 26.878 1.00 0.00 H ATOM 1121 N ARG A 548 1.900 0.235 26.428 1.00 36.50 N ATOM 1122 CA ARG A 548 0.743 0.019 25.573 1.00 34.75 C ATOM 1123 C ARG A 548 -0.477 -0.553 26.292 1.00 31.97 C ATOM 1124 O ARG A 548 -1.515 -0.757 25.669 1.00 38.09 O ATOM 1125 CB ARG A 548 1.128 -0.873 24.396 1.00 35.29 C ATOM 1126 CG ARG A 548 2.297 -0.353 23.586 1.00 40.36 C ATOM 1127 CD ARG A 548 2.473 -1.200 22.351 1.00 38.18 C ATOM 1128 NE ARG A 548 3.690 -0.883 21.613 1.00 53.82 N ATOM 1129 CZ ARG A 548 3.985 -1.397 20.423 1.00 54.89 C ATOM 1130 NH1 ARG A 548 3.141 -2.242 19.845 1.00 45.10 N ATOM 1131 NH2 ARG A 548 5.114 -1.063 19.813 1.00 60.51 N ATOM 1132 HE ARG A 548 4.365 -0.218 22.041 1.00 0.00 H ATOM 1133 HH12 ARG A 548 3.367 -2.647 18.914 1.00 0.00 H ATOM 1134 HH11 ARG A 548 2.254 -2.499 20.323 1.00 0.00 H ATOM 1135 HH22 ARG A 548 5.341 -1.467 18.882 1.00 0.00 H ATOM 1136 HH21 ARG A 548 5.772 -0.397 20.265 1.00 0.00 H ATOM 1137 H ARG A 548 2.588 -0.532 26.572 1.00 0.00 H ATOM 1138 N ASP A 549 -0.350 -0.821 27.591 1.00 32.86 N ATOM 1139 CA ASP A 549 -1.456 -1.372 28.376 1.00 29.74 C ATOM 1140 C ASP A 549 -1.573 -0.656 29.728 1.00 31.59 C ATOM 1141 O ASP A 549 -1.414 -1.280 30.781 1.00 27.95 O ATOM 1142 CB ASP A 549 -1.280 -2.890 28.562 1.00 30.24 C ATOM 1143 CG ASP A 549 -2.501 -3.567 29.183 1.00 34.17 C ATOM 1144 OD1 ASP A 549 -3.528 -2.897 29.424 1.00 31.03 O ATOM 1145 OD2 ASP A 549 -2.436 -4.790 29.427 1.00 37.00 O ATOM 1146 H ASP A 549 0.559 -0.634 28.060 1.00 0.00 H ATOM 1147 N ILE A 550 -1.823 0.656 29.680 1.00 31.13 N ATOM 1148 CA ILE A 550 -2.101 1.460 30.878 1.00 29.74 C ATOM 1149 C ILE A 550 -3.584 1.369 31.174 1.00 28.49 C ATOM 1150 O ILE A 550 -4.362 2.190 30.684 1.00 31.90 O ATOM 1151 CB ILE A 550 -1.804 2.950 30.650 1.00 30.46 C ATOM 1152 CG1 ILE A 550 -0.470 3.143 29.925 1.00 30.17 C ATOM 1153 CG2 ILE A 550 -1.840 3.726 31.973 1.00 31.71 C ATOM 1154 CD1 ILE A 550 -0.298 4.551 29.369 1.00 32.16 C ATOM 1155 H ILE A 550 -1.821 1.129 28.754 1.00 0.00 H ATOM 1156 N ALA A 551 -3.970 0.384 31.979 1.00 25.21 N ATOM 1157 CA ALA A 551 -5.369 0.049 32.190 1.00 28.06 C ATOM 1158 C ALA A 551 -5.487 -0.656 33.533 1.00 24.73 C ATOM 1159 O ALA A 551 -4.530 -1.302 33.963 1.00 22.23 O ATOM 1160 CB ALA A 551 -5.844 -0.852 31.082 1.00 19.39 C ATOM 1161 H ALA A 551 -3.243 -0.168 32.477 1.00 0.00 H ATOM 1162 N VAL A 552 -6.642 -0.552 34.193 1.00 17.85 N ATOM 1163 CA VAL A 552 -6.696 -0.950 35.602 1.00 17.51 C ATOM 1164 C VAL A 552 -6.489 -2.453 35.840 1.00 18.52 C ATOM 1165 O VAL A 552 -6.050 -2.861 36.911 1.00 16.37 O ATOM 1166 CB VAL A 552 -7.946 -0.421 36.332 1.00 16.35 C ATOM 1167 CG1 VAL A 552 -7.946 1.118 36.347 1.00 15.22 C ATOM 1168 CG2 VAL A 552 -9.227 -0.991 35.692 1.00 18.77 C ATOM 1169 H VAL A 552 -7.492 -0.193 33.714 1.00 0.00 H ATOM 1170 N ARG A 553 -6.800 -3.270 34.842 1.00 19.02 N ATOM 1171 CA ARG A 553 -6.580 -4.710 34.944 1.00 19.25 C ATOM 1172 C ARG A 553 -5.073 -5.053 34.967 1.00 18.04 C ATOM 1173 O ARG A 553 -4.670 -6.123 35.426 1.00 24.39 O ATOM 1174 CB ARG A 553 -7.266 -5.436 33.775 1.00 27.53 C ATOM 1175 H ARG A 553 -7.208 -2.877 33.970 1.00 0.00 H ATOM 1176 N ASN A 554 -4.262 -4.126 34.477 1.00 20.39 N ATOM 1177 CA ASN A 554 -2.819 -4.312 34.337 1.00 21.20 C ATOM 1178 C ASN A 554 -2.014 -3.394 35.264 1.00 19.54 C ATOM 1179 O ASN A 554 -0.856 -3.048 34.986 1.00 20.07 O ATOM 1180 CB ASN A 554 -2.393 -4.084 32.883 1.00 22.13 C ATOM 1181 CG ASN A 554 -1.041 -4.711 32.575 1.00 27.50 C ATOM 1182 OD1 ASN A 554 -0.750 -5.815 33.029 1.00 31.06 O ATOM 1183 ND2 ASN A 554 -0.201 -3.994 31.840 1.00 26.51 N ATOM 1184 HD22 ASN A 554 -0.492 -3.064 31.477 1.00 0.00 H ATOM 1185 HD21 ASN A 554 0.748 -4.362 31.627 1.00 0.00 H ATOM 1186 H ASN A 554 -4.674 -3.219 34.177 1.00 0.00 H ATOM 1187 N ILE A 555 -2.645 -2.985 36.358 1.00 15.77 N ATOM 1188 CA ILE A 555 -1.984 -2.191 37.389 1.00 13.54 C ATOM 1189 C ILE A 555 -2.152 -2.976 38.684 1.00 14.80 C ATOM 1190 O ILE A 555 -3.228 -3.506 38.959 1.00 14.93 O ATOM 1191 CB ILE A 555 -2.622 -0.779 37.523 1.00 15.85 C ATOM 1192 CG1 ILE A 555 -2.414 0.034 36.234 1.00 15.15 C ATOM 1193 CG2 ILE A 555 -2.040 -0.011 38.722 1.00 12.50 C ATOM 1194 CD1 ILE A 555 -3.249 1.343 36.186 1.00 19.34 C ATOM 1195 H ILE A 555 -3.645 -3.239 36.485 1.00 0.00 H ATOM 1196 N LEU A 556 -1.084 -3.077 39.465 1.00 14.51 N ATOM 1197 CA LEU A 556 -1.106 -3.896 40.674 1.00 13.79 C ATOM 1198 C LEU A 556 -1.223 -2.998 41.893 1.00 16.26 C ATOM 1199 O LEU A 556 -0.693 -1.888 41.904 1.00 14.14 O ATOM 1200 CB LEU A 556 0.184 -4.735 40.764 1.00 14.70 C ATOM 1201 CG LEU A 556 0.255 -5.943 39.822 1.00 16.09 C ATOM 1202 CD1 LEU A 556 -1.017 -6.799 39.986 1.00 14.76 C ATOM 1203 CD2 LEU A 556 0.444 -5.555 38.374 1.00 14.06 C ATOM 1204 H LEU A 556 -0.216 -2.564 39.212 1.00 0.00 H ATOM 1205 N VAL A 557 -1.927 -3.466 42.917 1.00 14.39 N ATOM 1206 CA VAL A 557 -2.013 -2.736 44.170 1.00 15.17 C ATOM 1207 C VAL A 557 -0.967 -3.271 45.145 1.00 22.74 C ATOM 1208 O VAL A 557 -1.041 -4.428 45.573 1.00 19.09 O ATOM 1209 CB VAL A 557 -3.408 -2.833 44.781 1.00 19.87 C ATOM 1210 CG1 VAL A 557 -3.479 -2.029 46.079 1.00 18.92 C ATOM 1211 CG2 VAL A 557 -4.461 -2.340 43.779 1.00 15.86 C ATOM 1212 H VAL A 557 -2.427 -4.373 42.820 1.00 0.00 H ATOM 1213 N ALA A 558 0.031 -2.445 45.466 1.00 15.72 N ATOM 1214 CA ALA A 558 1.072 -2.860 46.407 1.00 18.49 C ATOM 1215 C ALA A 558 0.580 -2.707 47.846 1.00 21.53 C ATOM 1216 O ALA A 558 0.920 -3.498 48.725 1.00 28.14 O ATOM 1217 CB ALA A 558 2.355 -2.064 46.195 1.00 18.28 C ATOM 1218 H ALA A 558 0.069 -1.496 45.043 1.00 0.00 H ATOM 1219 N SER A 559 -0.221 -1.673 48.067 1.00 20.38 N ATOM 1220 CA SER A 559 -0.769 -1.347 49.376 1.00 23.77 C ATOM 1221 C SER A 559 -1.916 -0.381 49.101 1.00 26.68 C ATOM 1222 O SER A 559 -2.029 0.130 47.979 1.00 22.60 O ATOM 1223 CB SER A 559 0.294 -0.661 50.231 1.00 24.89 C ATOM 1224 OG SER A 559 0.285 0.732 49.999 1.00 26.91 O ATOM 1225 HG SER A 559 0.978 1.163 50.559 1.00 0.00 H ATOM 1226 H SER A 559 -0.471 -1.063 47.263 1.00 0.00 H ATOM 1227 N PRO A 560 -2.766 -0.118 50.111 1.00 27.99 N ATOM 1228 CA PRO A 560 -3.927 0.757 49.896 1.00 26.05 C ATOM 1229 C PRO A 560 -3.590 2.144 49.360 1.00 27.09 C ATOM 1230 O PRO A 560 -4.479 2.790 48.794 1.00 25.15 O ATOM 1231 CB PRO A 560 -4.538 0.876 51.293 1.00 30.90 C ATOM 1232 CG PRO A 560 -4.179 -0.414 51.955 1.00 32.25 C ATOM 1233 CD PRO A 560 -2.819 -0.786 51.429 1.00 27.61 C ATOM 1234 N GLU A 561 -2.346 2.585 49.533 1.00 22.10 N ATOM 1235 CA GLU A 561 -1.920 3.899 49.050 1.00 21.97 C ATOM 1236 C GLU A 561 -0.758 3.800 48.060 1.00 25.07 C ATOM 1237 O GLU A 561 0.005 4.743 47.912 1.00 21.76 O ATOM 1238 CB GLU A 561 -1.514 4.800 50.225 1.00 29.31 C ATOM 1239 H GLU A 561 -1.658 1.979 50.025 1.00 0.00 H ATOM 1240 N CYS A 562 -0.617 2.659 47.388 1.00 18.79 N ATOM 1241 CA CYS A 562 0.456 2.503 46.409 1.00 23.39 C ATOM 1242 C CYS A 562 0.129 1.542 45.265 1.00 21.83 C ATOM 1243 O CYS A 562 -0.127 0.364 45.496 1.00 20.33 O ATOM 1244 CB CYS A 562 1.734 2.027 47.090 1.00 22.15 C ATOM 1245 SG CYS A 562 3.102 1.974 45.936 1.00 24.84 S ATOM 1246 H CYS A 562 -1.276 1.873 47.561 1.00 0.00 H ATOM 1247 N VAL A 563 0.171 2.040 44.032 1.00 19.02 N ATOM 1248 CA VAL A 563 -0.067 1.191 42.869 1.00 15.77 C ATOM 1249 C VAL A 563 1.168 1.079 41.979 1.00 17.28 C ATOM 1250 O VAL A 563 2.043 1.944 42.007 1.00 16.14 O ATOM 1251 CB VAL A 563 -1.302 1.659 42.047 1.00 16.50 C ATOM 1252 CG1 VAL A 563 -2.585 1.502 42.845 1.00 16.90 C ATOM 1253 CG2 VAL A 563 -1.131 3.094 41.565 1.00 13.46 C ATOM 1254 H VAL A 563 0.377 3.050 43.895 1.00 0.00 H ATOM 1255 N LYS A 564 1.233 0.009 41.188 1.00 12.92 N ATOM 1256 CA LYS A 564 2.401 -0.270 40.360 1.00 15.41 C ATOM 1257 C LYS A 564 1.958 -0.649 38.966 1.00 15.63 C ATOM 1258 O LYS A 564 1.199 -1.591 38.803 1.00 13.62 O ATOM 1259 CB LYS A 564 3.203 -1.441 40.934 1.00 16.81 C ATOM 1260 CG LYS A 564 3.468 -1.392 42.443 1.00 24.12 C ATOM 1261 CD LYS A 564 4.889 -0.919 42.732 1.00 18.49 C ATOM 1262 CE LYS A 564 5.266 -1.014 44.233 1.00 19.94 C ATOM 1263 NZ LYS A 564 6.531 -0.242 44.459 1.00 21.27 N ATOM 1264 HZ1 LYS A 564 7.291 -0.647 43.876 1.00 0.00 H ATOM 1265 HZ2 LYS A 564 6.381 0.752 44.194 1.00 0.00 H ATOM 1266 HZ3 LYS A 564 6.795 -0.298 45.463 1.00 0.00 H ATOM 1267 H LYS A 564 0.427 -0.647 41.160 1.00 0.00 H ATOM 1268 N LEU A 565 2.434 0.086 37.968 1.00 13.23 N ATOM 1269 CA LEU A 565 2.159 -0.238 36.574 1.00 14.39 C ATOM 1270 C LEU A 565 2.756 -1.612 36.251 1.00 20.33 C ATOM 1271 O LEU A 565 3.915 -1.877 36.585 1.00 17.62 O ATOM 1272 CB LEU A 565 2.786 0.835 35.690 1.00 16.97 C ATOM 1273 CG LEU A 565 2.364 1.048 34.242 1.00 25.56 C ATOM 1274 CD1 LEU A 565 0.845 1.100 34.109 1.00 23.43 C ATOM 1275 CD2 LEU A 565 2.988 2.359 33.757 1.00 23.81 C ATOM 1276 H LEU A 565 3.020 0.917 38.187 1.00 0.00 H ATOM 1277 N GLY A 566 1.970 -2.483 35.611 1.00 17.26 N ATOM 1278 CA GLY A 566 2.420 -3.830 35.268 1.00 21.50 C ATOM 1279 C GLY A 566 3.457 -3.860 34.154 1.00 24.59 C ATOM 1280 O GLY A 566 3.692 -2.842 33.497 1.00 22.04 O ATOM 1281 H GLY A 566 1.007 -2.192 35.349 1.00 0.00 H ATOM 1282 N ASP A 567 4.092 -5.017 33.952 1.00 24.09 N ATOM 1283 CA ASP A 567 5.132 -5.139 32.935 1.00 26.78 C ATOM 1284 C ASP A 567 4.568 -5.401 31.535 1.00 27.19 C ATOM 1285 O ASP A 567 5.092 -4.887 30.548 1.00 28.29 O ATOM 1286 CB ASP A 567 6.178 -6.207 33.321 1.00 30.97 C ATOM 1287 CG ASP A 567 5.558 -7.561 33.660 1.00 33.14 C ATOM 1288 OD1 ASP A 567 6.052 -8.588 33.153 1.00 39.21 O ATOM 1289 OD2 ASP A 567 4.594 -7.613 34.451 1.00 34.97 O ATOM 1290 H ASP A 567 3.841 -5.845 34.529 1.00 0.00 H ATOM 1291 N PHE A 568 3.493 -6.184 31.454 1.00 24.70 N ATOM 1292 CA PHE A 568 2.862 -6.482 30.163 1.00 27.57 C ATOM 1293 C PHE A 568 2.481 -5.212 29.426 1.00 29.22 C ATOM 1294 O PHE A 568 1.760 -4.377 29.964 1.00 29.75 O ATOM 1295 CB PHE A 568 1.612 -7.347 30.359 1.00 32.88 C ATOM 1296 CG PHE A 568 0.836 -7.587 29.094 1.00 28.02 C ATOM 1297 CD1 PHE A 568 -0.271 -6.808 28.784 1.00 34.67 C ATOM 1298 CD2 PHE A 568 1.209 -8.592 28.212 1.00 36.75 C ATOM 1299 CE1 PHE A 568 -0.998 -7.028 27.620 1.00 36.46 C ATOM 1300 CE2 PHE A 568 0.487 -8.821 27.047 1.00 37.98 C ATOM 1301 CZ PHE A 568 -0.617 -8.037 26.752 1.00 36.89 C ATOM 1302 H PHE A 568 3.093 -6.592 32.323 1.00 0.00 H ATOM 1303 N GLY A 569 2.969 -5.071 28.196 1.00 24.59 N ATOM 1304 CA GLY A 569 2.706 -3.890 27.387 1.00 25.69 C ATOM 1305 C GLY A 569 3.762 -2.807 27.517 1.00 27.22 C ATOM 1306 O GLY A 569 3.724 -1.800 26.802 1.00 32.78 O ATOM 1307 H GLY A 569 3.558 -5.831 27.799 1.00 0.00 H ATOM 1308 N LEU A 570 4.706 -2.992 28.435 1.00 30.23 N ATOM 1309 CA LEU A 570 5.787 -2.015 28.586 1.00 35.42 C ATOM 1310 C LEU A 570 6.845 -2.279 27.521 1.00 34.01 C ATOM 1311 O LEU A 570 7.408 -3.371 27.460 1.00 39.98 O ATOM 1312 CB LEU A 570 6.414 -2.085 29.980 1.00 34.84 C ATOM 1313 CG LEU A 570 6.943 -0.784 30.586 1.00 32.60 C ATOM 1314 CD1 LEU A 570 7.216 -0.992 32.068 1.00 30.27 C ATOM 1315 CD2 LEU A 570 8.194 -0.312 29.867 1.00 36.74 C ATOM 1316 H LEU A 570 4.677 -3.832 29.047 1.00 0.00 H ATOM 1317 N SER A 571 7.116 -1.278 26.686 1.00 34.49 N ATOM 1318 CA SER A 571 8.032 -1.454 25.565 1.00 39.20 C ATOM 1319 C SER A 571 8.783 -0.167 25.210 1.00 39.28 C ATOM 1320 O SER A 571 8.583 0.875 25.830 1.00 33.70 O ATOM 1321 CB SER A 571 7.268 -1.947 24.340 1.00 37.01 C ATOM 1322 OG SER A 571 6.588 -0.873 23.721 1.00 46.92 O ATOM 1323 HG SER A 571 6.097 -1.207 22.929 1.00 0.00 H ATOM 1324 H SER A 571 6.666 -0.353 26.836 1.00 0.00 H ATOM 1325 N ARG A 572 9.644 -0.259 24.200 1.00 41.17 N ATOM 1326 CA ARG A 572 10.428 0.875 23.719 1.00 41.37 C ATOM 1327 C ARG A 572 9.664 1.702 22.684 1.00 39.57 C ATOM 1328 O ARG A 572 9.736 2.935 22.679 1.00 40.04 O ATOM 1329 CB ARG A 572 11.748 0.387 23.143 1.00 41.89 C ATOM 1330 H ARG A 572 9.764 -1.180 23.732 1.00 0.00 H TER 1331 ARG A 572 ATOM 1332 N ILE A 589 -8.667 -1.026 21.717 1.00 29.08 N ATOM 1333 CA ILE A 589 -9.371 -0.091 20.846 1.00 27.94 C ATOM 1334 C ILE A 589 -10.080 1.031 21.616 1.00 27.87 C ATOM 1335 O ILE A 589 -10.003 2.211 21.249 1.00 30.22 O ATOM 1336 CB ILE A 589 -10.437 -0.803 20.004 1.00 36.94 C ATOM 1337 CG1 ILE A 589 -9.822 -1.980 19.243 1.00 37.70 C ATOM 1338 CG2 ILE A 589 -11.099 0.187 19.048 1.00 37.70 C ATOM 1339 CD1 ILE A 589 -8.632 -1.582 18.403 1.00 38.27 C ATOM 1340 HN3 ILE A 589 -9.346 -1.470 22.368 1.00 0.00 H ATOM 1341 HN2 ILE A 589 -7.946 -0.513 22.263 1.00 0.00 H ATOM 1342 HN1 ILE A 589 -8.209 -1.759 21.139 1.00 0.00 H ATOM 1343 N LYS A 590 -10.794 0.651 22.671 1.00 29.96 N ATOM 1344 CA LYS A 590 -11.568 1.609 23.456 1.00 28.37 C ATOM 1345 C LYS A 590 -10.652 2.423 24.355 1.00 22.73 C ATOM 1346 O LYS A 590 -11.107 3.270 25.118 1.00 24.88 O ATOM 1347 CB LYS A 590 -12.643 0.881 24.264 1.00 20.01 C ATOM 1348 CG LYS A 590 -13.839 0.500 23.406 1.00 23.15 C ATOM 1349 CD LYS A 590 -14.671 -0.605 24.024 1.00 26.57 C ATOM 1350 CE LYS A 590 -15.929 -0.813 23.190 1.00 30.07 C ATOM 1351 NZ LYS A 590 -16.917 -1.669 23.894 1.00 29.63 N ATOM 1352 HZ1 LYS A 590 -16.493 -2.599 24.087 1.00 0.00 H ATOM 1353 HZ2 LYS A 590 -17.188 -1.218 24.791 1.00 0.00 H ATOM 1354 HZ3 LYS A 590 -17.759 -1.788 23.296 1.00 0.00 H ATOM 1355 H LYS A 590 -10.802 -0.353 22.944 1.00 0.00 H ATOM 1356 N TRP A 591 -9.355 2.150 24.244 1.00 22.91 N ATOM 1357 CA TRP A 591 -8.332 2.813 25.039 1.00 25.47 C ATOM 1358 C TRP A 591 -7.453 3.704 24.147 1.00 28.01 C ATOM 1359 O TRP A 591 -6.628 4.484 24.636 1.00 25.86 O ATOM 1360 CB TRP A 591 -7.468 1.764 25.761 1.00 21.92 C ATOM 1361 CG TRP A 591 -7.969 1.309 27.127 1.00 22.14 C ATOM 1362 CD1 TRP A 591 -7.650 1.857 28.342 1.00 25.68 C ATOM 1363 CD2 TRP A 591 -8.845 0.197 27.410 1.00 23.81 C ATOM 1364 NE1 TRP A 591 -8.278 1.158 29.358 1.00 21.43 N ATOM 1365 CE2 TRP A 591 -9.019 0.142 28.811 1.00 22.92 C ATOM 1366 CE3 TRP A 591 -9.485 -0.759 26.614 1.00 26.26 C ATOM 1367 CZ2 TRP A 591 -9.812 -0.836 29.436 1.00 29.93 C ATOM 1368 CZ3 TRP A 591 -10.288 -1.734 27.241 1.00 34.23 C ATOM 1369 CH2 TRP A 591 -10.441 -1.758 28.639 1.00 26.19 C ATOM 1370 HE1 TRP A 591 -8.200 1.369 30.373 1.00 0.00 H ATOM 1371 H TRP A 591 -9.058 1.429 23.556 1.00 0.00 H ATOM 1372 N MET A 592 -7.653 3.605 22.835 1.00 32.11 N ATOM 1373 CA MET A 592 -6.713 4.179 21.863 1.00 29.98 C ATOM 1374 C MET A 592 -7.045 5.565 21.299 1.00 27.22 C ATOM 1375 O MET A 592 -8.214 5.899 21.060 1.00 23.37 O ATOM 1376 CB MET A 592 -6.479 3.179 20.718 1.00 31.99 C ATOM 1377 CG MET A 592 -5.684 1.960 21.132 1.00 26.68 C ATOM 1378 SD MET A 592 -5.958 0.546 20.039 1.00 41.18 S ATOM 1379 CE MET A 592 -5.882 1.397 18.463 1.00 25.62 C ATOM 1380 H MET A 592 -8.498 3.108 22.488 1.00 0.00 H ATOM 1381 N SER A 593 -5.999 6.370 21.077 1.00 22.61 N ATOM 1382 CA SER A 593 -6.154 7.701 20.484 1.00 26.01 C ATOM 1383 C SER A 593 -6.700 7.617 19.055 1.00 29.41 C ATOM 1384 O SER A 593 -6.595 6.575 18.415 1.00 27.13 O ATOM 1385 CB SER A 593 -4.810 8.438 20.470 1.00 30.42 C ATOM 1386 OG SER A 593 -3.919 7.850 19.535 1.00 31.64 O ATOM 1387 HG SER A 593 -3.761 6.904 19.781 1.00 0.00 H ATOM 1388 H SER A 593 -5.046 6.041 21.333 1.00 0.00 H ATOM 1389 N PRO A 594 -7.292 8.716 18.556 1.00 29.78 N ATOM 1390 CA PRO A 594 -7.817 8.727 17.187 1.00 29.85 C ATOM 1391 C PRO A 594 -6.738 8.416 16.157 1.00 40.89 C ATOM 1392 O PRO A 594 -6.982 7.604 15.263 1.00 42.87 O ATOM 1393 CB PRO A 594 -8.316 10.159 17.010 1.00 33.76 C ATOM 1394 CG PRO A 594 -8.653 10.620 18.407 1.00 31.53 C ATOM 1395 CD PRO A 594 -7.617 9.955 19.285 1.00 25.53 C ATOM 1396 N GLU A 595 -5.567 9.043 16.285 1.00 36.92 N ATOM 1397 CA GLU A 595 -4.461 8.781 15.368 1.00 37.89 C ATOM 1398 C GLU A 595 -3.970 7.334 15.459 1.00 37.91 C ATOM 1399 O GLU A 595 -3.490 6.775 14.474 1.00 41.46 O ATOM 1400 CB GLU A 595 -3.308 9.764 15.607 1.00 36.38 C ATOM 1401 CG GLU A 595 -2.471 9.462 16.849 1.00 37.42 C ATOM 1402 CD GLU A 595 -2.893 10.274 18.069 1.00 36.87 C ATOM 1403 OE1 GLU A 595 -3.921 10.995 18.007 1.00 33.69 O ATOM 1404 OE2 GLU A 595 -2.180 10.193 19.095 1.00 36.97 O ATOM 1405 H GLU A 595 -5.439 9.732 17.053 1.00 0.00 H ATOM 1406 N SER A 596 -4.095 6.721 16.633 1.00 33.86 N ATOM 1407 CA SER A 596 -3.709 5.323 16.788 1.00 33.83 C ATOM 1408 C SER A 596 -4.691 4.426 16.042 1.00 40.35 C ATOM 1409 O SER A 596 -4.318 3.377 15.513 1.00 40.16 O ATOM 1410 CB SER A 596 -3.625 4.922 18.266 1.00 33.65 C ATOM 1411 OG SER A 596 -2.777 5.799 18.991 1.00 35.74 O ATOM 1412 HG SER A 596 -3.132 6.721 18.934 1.00 0.00 H ATOM 1413 H SER A 596 -4.472 7.244 17.449 1.00 0.00 H ATOM 1414 N ILE A 597 -5.948 4.856 15.993 1.00 35.28 N ATOM 1415 CA ILE A 597 -6.990 4.093 15.316 1.00 42.64 C ATOM 1416 C ILE A 597 -7.003 4.386 13.816 1.00 37.60 C ATOM 1417 O ILE A 597 -7.030 3.474 12.994 1.00 41.26 O ATOM 1418 CB ILE A 597 -8.386 4.403 15.908 1.00 41.91 C ATOM 1419 CG1 ILE A 597 -8.523 3.815 17.317 1.00 38.36 C ATOM 1420 CG2 ILE A 597 -9.490 3.879 14.997 1.00 41.93 C ATOM 1421 CD1 ILE A 597 -9.798 4.258 18.042 1.00 34.19 C ATOM 1422 H ILE A 597 -6.194 5.758 16.448 1.00 0.00 H ATOM 1423 N ASN A 598 -6.976 5.668 13.472 1.00 39.47 N ATOM 1424 CA ASN A 598 -7.076 6.097 12.083 1.00 39.80 C ATOM 1425 C ASN A 598 -5.810 5.853 11.249 1.00 42.50 C ATOM 1426 O ASN A 598 -5.897 5.639 10.038 1.00 37.52 O ATOM 1427 CB ASN A 598 -7.465 7.578 12.012 1.00 38.80 C ATOM 1428 CG ASN A 598 -8.964 7.797 12.067 1.00 38.67 C ATOM 1429 OD1 ASN A 598 -9.746 6.875 11.839 1.00 42.77 O ATOM 1430 ND2 ASN A 598 -9.373 9.032 12.349 1.00 40.08 N ATOM 1431 HD22 ASN A 598 -8.676 9.781 12.535 1.00 0.00 H ATOM 1432 HD21 ASN A 598 -10.390 9.248 12.383 1.00 0.00 H ATOM 1433 H ASN A 598 -6.881 6.388 14.216 1.00 0.00 H ATOM 1434 N PHE A 599 -4.644 5.882 11.898 1.00 45.62 N ATOM 1435 CA PHE A 599 -3.362 5.890 11.183 1.00 39.69 C ATOM 1436 C PHE A 599 -2.265 5.016 11.794 1.00 41.43 C ATOM 1437 O PHE A 599 -1.107 5.106 11.384 1.00 48.63 O ATOM 1438 CB PHE A 599 -2.852 7.324 11.061 1.00 40.28 C ATOM 1439 CG PHE A 599 -3.860 8.275 10.497 1.00 35.28 C ATOM 1440 CD1 PHE A 599 -4.379 9.299 11.274 1.00 33.87 C ATOM 1441 CD2 PHE A 599 -4.298 8.144 9.192 1.00 33.69 C ATOM 1442 CE1 PHE A 599 -5.313 10.181 10.759 1.00 38.40 C ATOM 1443 CE2 PHE A 599 -5.230 9.025 8.667 1.00 31.31 C ATOM 1444 CZ PHE A 599 -5.745 10.041 9.450 1.00 35.86 C ATOM 1445 H PHE A 599 -4.644 5.899 12.938 1.00 0.00 H ATOM 1446 N ARG A 600 -2.627 4.190 12.774 1.00 43.77 N ATOM 1447 CA ARG A 600 -1.694 3.254 13.423 1.00 43.29 C ATOM 1448 C ARG A 600 -0.483 3.905 14.112 1.00 45.91 C ATOM 1449 O ARG A 600 0.484 3.218 14.452 1.00 47.59 O ATOM 1450 CB ARG A 600 -1.221 2.189 12.432 1.00 41.50 C ATOM 1451 H ARG A 600 -3.616 4.207 13.096 1.00 0.00 H ATOM 1452 N ARG A 601 -0.543 5.216 14.328 1.00 39.17 N ATOM 1453 CA ARG A 601 0.537 5.947 14.993 1.00 43.76 C ATOM 1454 C ARG A 601 0.439 5.825 16.517 1.00 47.38 C ATOM 1455 O ARG A 601 -0.650 5.903 17.080 1.00 43.16 O ATOM 1456 CB ARG A 601 0.492 7.422 14.591 1.00 36.22 C ATOM 1457 H ARG A 601 -1.385 5.739 14.014 1.00 0.00 H ATOM 1458 N PHE A 602 1.575 5.645 17.185 1.00 43.57 N ATOM 1459 CA PHE A 602 1.584 5.477 18.634 1.00 36.62 C ATOM 1460 C PHE A 602 2.730 6.236 19.301 1.00 42.92 C ATOM 1461 O PHE A 602 3.797 5.670 19.560 1.00 43.19 O ATOM 1462 CB PHE A 602 1.673 4.003 18.999 1.00 34.81 C ATOM 1463 H PHE A 602 2.475 5.624 16.664 1.00 0.00 H ATOM 1464 N THR A 603 2.485 7.512 19.591 1.00 36.90 N ATOM 1465 CA THR A 603 3.468 8.401 20.203 1.00 32.62 C ATOM 1466 C THR A 603 3.190 8.631 21.687 1.00 36.44 C ATOM 1467 O THR A 603 2.171 8.175 22.225 1.00 30.91 O ATOM 1468 CB THR A 603 3.456 9.771 19.527 1.00 37.60 C ATOM 1469 OG1 THR A 603 2.190 10.394 19.760 1.00 39.16 O ATOM 1470 CG2 THR A 603 3.698 9.642 18.025 1.00 35.03 C ATOM 1471 HG1 THR A 603 2.176 11.283 19.324 1.00 0.00 H ATOM 1472 H THR A 603 1.544 7.896 19.370 1.00 0.00 H ATOM 1473 N THR A 604 4.096 9.351 22.342 1.00 29.46 N ATOM 1474 CA THR A 604 3.900 9.732 23.730 1.00 28.81 C ATOM 1475 C THR A 604 2.576 10.483 23.887 1.00 27.63 C ATOM 1476 O THR A 604 1.895 10.313 24.883 1.00 23.89 O ATOM 1477 CB THR A 604 5.077 10.594 24.262 1.00 30.18 C ATOM 1478 OG1 THR A 604 6.307 9.893 24.055 1.00 37.83 O ATOM 1479 CG2 THR A 604 4.919 10.848 25.739 1.00 34.39 C ATOM 1480 HG1 THR A 604 7.059 10.441 24.394 1.00 0.00 H ATOM 1481 H THR A 604 4.963 9.648 21.850 1.00 0.00 H ATOM 1482 N ALA A 605 2.204 11.295 22.896 1.00 22.76 N ATOM 1483 CA ALA A 605 0.949 12.036 22.967 1.00 28.24 C ATOM 1484 C ALA A 605 -0.238 11.079 22.947 1.00 26.95 C ATOM 1485 O ALA A 605 -1.305 11.393 23.469 1.00 21.60 O ATOM 1486 CB ALA A 605 0.841 13.041 21.834 1.00 28.61 C ATOM 1487 H ALA A 605 2.816 11.401 22.062 1.00 0.00 H ATOM 1488 N SER A 606 -0.042 9.913 22.339 1.00 24.51 N ATOM 1489 CA SER A 606 -1.086 8.889 22.283 1.00 27.27 C ATOM 1490 C SER A 606 -1.166 8.143 23.612 1.00 25.47 C ATOM 1491 O SER A 606 -2.236 7.656 23.997 1.00 20.24 O ATOM 1492 CB SER A 606 -0.823 7.909 21.134 1.00 30.90 C ATOM 1493 OG SER A 606 0.104 6.906 21.521 1.00 40.59 O ATOM 1494 HG SER A 606 0.960 7.331 21.778 1.00 0.00 H ATOM 1495 H SER A 606 0.877 9.724 21.891 1.00 0.00 H ATOM 1496 N ASP A 607 -0.031 8.053 24.306 1.00 18.29 N ATOM 1497 CA ASP A 607 -0.006 7.473 25.640 1.00 22.06 C ATOM 1498 C ASP A 607 -0.694 8.403 26.650 1.00 18.40 C ATOM 1499 O ASP A 607 -1.315 7.927 27.601 1.00 16.42 O ATOM 1500 CB ASP A 607 1.429 7.162 26.088 1.00 24.99 C ATOM 1501 CG ASP A 607 1.659 5.679 26.360 1.00 32.44 C ATOM 1502 OD1 ASP A 607 0.682 4.900 26.376 1.00 30.07 O ATOM 1503 OD2 ASP A 607 2.826 5.287 26.583 1.00 33.41 O ATOM 1504 H ASP A 607 0.853 8.404 23.886 1.00 0.00 H ATOM 1505 N VAL A 608 -0.572 9.715 26.446 1.00 16.15 N ATOM 1506 CA VAL A 608 -1.281 10.691 27.274 1.00 17.74 C ATOM 1507 C VAL A 608 -2.793 10.512 27.141 1.00 16.39 C ATOM 1508 O VAL A 608 -3.538 10.621 28.131 1.00 13.84 O ATOM 1509 CB VAL A 608 -0.905 12.141 26.894 1.00 17.70 C ATOM 1510 CG1 VAL A 608 -1.872 13.147 27.533 1.00 14.10 C ATOM 1511 CG2 VAL A 608 0.540 12.443 27.301 1.00 15.72 C ATOM 1512 H VAL A 608 0.043 10.053 25.679 1.00 0.00 H ATOM 1513 N TRP A 609 -3.243 10.259 25.913 1.00 18.25 N ATOM 1514 CA TRP A 609 -4.656 9.938 25.649 1.00 18.90 C ATOM 1515 C TRP A 609 -5.042 8.722 26.473 1.00 17.14 C ATOM 1516 O TRP A 609 -5.992 8.759 27.244 1.00 15.16 O ATOM 1517 CB TRP A 609 -4.904 9.638 24.151 1.00 18.82 C ATOM 1518 CG TRP A 609 -6.336 9.199 23.833 1.00 18.10 C ATOM 1519 CD1 TRP A 609 -6.915 7.989 24.121 1.00 19.81 C ATOM 1520 CD2 TRP A 609 -7.342 9.973 23.164 1.00 17.77 C ATOM 1521 NE1 TRP A 609 -8.229 7.973 23.681 1.00 18.11 N ATOM 1522 CE2 TRP A 609 -8.510 9.179 23.093 1.00 19.88 C ATOM 1523 CE3 TRP A 609 -7.368 11.268 22.628 1.00 18.72 C ATOM 1524 CZ2 TRP A 609 -9.689 9.635 22.496 1.00 20.47 C ATOM 1525 CZ3 TRP A 609 -8.538 11.723 22.041 1.00 23.58 C ATOM 1526 CH2 TRP A 609 -9.685 10.907 21.980 1.00 20.12 C ATOM 1527 HE1 TRP A 609 -8.892 7.178 23.780 1.00 0.00 H ATOM 1528 H TRP A 609 -2.576 10.289 25.116 1.00 0.00 H ATOM 1529 N MET A 610 -4.284 7.644 26.302 1.00 13.99 N ATOM 1530 CA MET A 610 -4.563 6.388 26.971 1.00 16.06 C ATOM 1531 C MET A 610 -4.505 6.521 28.492 1.00 15.25 C ATOM 1532 O MET A 610 -5.295 5.901 29.208 1.00 13.34 O ATOM 1533 CB MET A 610 -3.572 5.312 26.494 1.00 19.55 C ATOM 1534 CG MET A 610 -3.776 3.963 27.157 1.00 17.97 C ATOM 1535 SD MET A 610 -2.594 2.685 26.627 1.00 29.58 S ATOM 1536 CE MET A 610 -3.555 1.220 27.053 1.00 38.68 C ATOM 1537 H MET A 610 -3.463 7.703 25.667 1.00 0.00 H ATOM 1538 N PHE A 611 -3.562 7.324 28.976 1.00 13.10 N ATOM 1539 CA PHE A 611 -3.462 7.610 30.401 1.00 14.84 C ATOM 1540 C PHE A 611 -4.744 8.239 30.953 1.00 10.87 C ATOM 1541 O PHE A 611 -5.178 7.899 32.050 1.00 14.07 O ATOM 1542 CB PHE A 611 -2.270 8.531 30.723 1.00 12.12 C ATOM 1543 CG PHE A 611 -2.289 9.042 32.150 1.00 10.47 C ATOM 1544 CD1 PHE A 611 -2.026 8.183 33.211 1.00 14.02 C ATOM 1545 CD2 PHE A 611 -2.596 10.364 32.421 1.00 14.87 C ATOM 1546 CE1 PHE A 611 -2.057 8.641 34.522 1.00 12.73 C ATOM 1547 CE2 PHE A 611 -2.632 10.838 33.727 1.00 16.71 C ATOM 1548 CZ PHE A 611 -2.377 9.967 34.782 1.00 14.28 C ATOM 1549 H PHE A 611 -2.880 7.758 28.322 1.00 0.00 H ATOM 1550 N ALA A 612 -5.343 9.167 30.217 1.00 10.91 N ATOM 1551 CA ALA A 612 -6.593 9.780 30.695 1.00 10.75 C ATOM 1552 C ALA A 612 -7.734 8.770 30.681 1.00 11.17 C ATOM 1553 O ALA A 612 -8.633 8.825 31.535 1.00 11.44 O ATOM 1554 CB ALA A 612 -6.956 11.013 29.889 1.00 13.21 C ATOM 1555 H ALA A 612 -4.932 9.459 29.308 1.00 0.00 H ATOM 1556 N VAL A 613 -7.701 7.843 29.732 1.00 10.92 N ATOM 1557 CA VAL A 613 -8.661 6.746 29.757 1.00 12.62 C ATOM 1558 C VAL A 613 -8.499 5.921 31.033 1.00 14.83 C ATOM 1559 O VAL A 613 -9.486 5.562 31.674 1.00 11.85 O ATOM 1560 CB VAL A 613 -8.546 5.827 28.514 1.00 16.07 C ATOM 1561 CG1 VAL A 613 -9.531 4.646 28.625 1.00 15.76 C ATOM 1562 CG2 VAL A 613 -8.811 6.622 27.236 1.00 14.45 C ATOM 1563 H VAL A 613 -6.992 7.899 28.973 1.00 0.00 H ATOM 1564 N CYS A 614 -7.252 5.596 31.382 1.00 12.77 N ATOM 1565 CA CYS A 614 -6.949 4.918 32.635 1.00 12.06 C ATOM 1566 C CYS A 614 -7.462 5.714 33.845 1.00 13.16 C ATOM 1567 O CYS A 614 -8.051 5.136 34.779 1.00 12.97 O ATOM 1568 CB CYS A 614 -5.434 4.676 32.765 1.00 15.74 C ATOM 1569 SG CYS A 614 -4.968 3.738 34.241 1.00 20.97 S ATOM 1570 H CYS A 614 -6.471 5.835 30.738 1.00 0.00 H ATOM 1571 N MET A 615 -7.236 7.027 33.845 1.00 12.71 N ATOM 1572 CA MET A 615 -7.802 7.891 34.898 1.00 11.37 C ATOM 1573 C MET A 615 -9.313 7.777 34.982 1.00 14.28 C ATOM 1574 O MET A 615 -9.877 7.719 36.076 1.00 15.01 O ATOM 1575 CB MET A 615 -7.418 9.366 34.714 1.00 16.19 C ATOM 1576 CG MET A 615 -5.942 9.652 34.891 1.00 13.00 C ATOM 1577 SD MET A 615 -5.718 11.403 35.265 1.00 20.46 S ATOM 1578 CE MET A 615 -5.988 12.063 33.608 1.00 19.44 C ATOM 1579 H MET A 615 -6.653 7.448 33.093 1.00 0.00 H ATOM 1580 N TRP A 616 -9.972 7.766 33.830 1.00 12.18 N ATOM 1581 CA TRP A 616 -11.428 7.608 33.792 1.00 12.30 C ATOM 1582 C TRP A 616 -11.866 6.273 34.409 1.00 11.70 C ATOM 1583 O TRP A 616 -12.834 6.217 35.184 1.00 12.45 O ATOM 1584 CB TRP A 616 -11.947 7.749 32.355 1.00 11.72 C ATOM 1585 CG TRP A 616 -13.443 7.676 32.212 1.00 10.71 C ATOM 1586 CD1 TRP A 616 -14.316 8.734 32.167 1.00 14.01 C ATOM 1587 CD2 TRP A 616 -14.252 6.489 32.089 1.00 13.13 C ATOM 1588 NE1 TRP A 616 -15.602 8.276 32.024 1.00 12.91 N ATOM 1589 CE2 TRP A 616 -15.591 6.908 31.971 1.00 14.41 C ATOM 1590 CE3 TRP A 616 -13.962 5.117 32.056 1.00 13.51 C ATOM 1591 CZ2 TRP A 616 -16.652 6.005 31.837 1.00 15.64 C ATOM 1592 CZ3 TRP A 616 -15.018 4.214 31.926 1.00 17.28 C ATOM 1593 CH2 TRP A 616 -16.347 4.664 31.820 1.00 18.48 C ATOM 1594 HE1 TRP A 616 -16.451 8.874 31.965 1.00 0.00 H ATOM 1595 H TRP A 616 -9.446 7.871 32.939 1.00 0.00 H ATOM 1596 N GLU A 617 -11.160 5.197 34.066 1.00 12.82 N ATOM 1597 CA GLU A 617 -11.419 3.883 34.658 1.00 12.47 C ATOM 1598 C GLU A 617 -11.310 3.925 36.170 1.00 12.84 C ATOM 1599 O GLU A 617 -12.140 3.370 36.879 1.00 13.03 O ATOM 1600 CB GLU A 617 -10.389 2.853 34.175 1.00 14.66 C ATOM 1601 CG GLU A 617 -10.556 2.359 32.767 1.00 16.11 C ATOM 1602 CD GLU A 617 -9.819 1.037 32.557 1.00 23.29 C ATOM 1603 OE1 GLU A 617 -8.571 1.025 32.666 1.00 27.18 O ATOM 1604 OE2 GLU A 617 -10.497 0.016 32.322 1.00 27.78 O ATOM 1605 H GLU A 617 -10.404 5.293 33.358 1.00 0.00 H ATOM 1606 N ILE A 618 -10.237 4.544 36.655 1.00 12.12 N ATOM 1607 CA ILE A 618 -9.977 4.638 38.082 1.00 12.23 C ATOM 1608 C ILE A 618 -11.115 5.387 38.781 1.00 13.91 C ATOM 1609 O ILE A 618 -11.699 4.898 39.755 1.00 13.32 O ATOM 1610 CB ILE A 618 -8.604 5.328 38.358 1.00 12.49 C ATOM 1611 CG1 ILE A 618 -7.451 4.401 37.925 1.00 10.95 C ATOM 1612 CG2 ILE A 618 -8.458 5.643 39.829 1.00 11.04 C ATOM 1613 CD1 ILE A 618 -6.069 5.079 37.969 1.00 12.61 C ATOM 1614 H ILE A 618 -9.562 4.975 35.991 1.00 0.00 H ATOM 1615 N LEU A 619 -11.453 6.560 38.264 1.00 13.36 N ATOM 1616 CA LEU A 619 -12.474 7.397 38.903 1.00 14.24 C ATOM 1617 C LEU A 619 -13.871 6.812 38.731 1.00 15.98 C ATOM 1618 O LEU A 619 -14.807 7.222 39.411 1.00 15.35 O ATOM 1619 CB LEU A 619 -12.417 8.831 38.388 1.00 14.16 C ATOM 1620 CG LEU A 619 -11.334 9.769 38.971 1.00 16.10 C ATOM 1621 CD1 LEU A 619 -11.672 10.156 40.408 1.00 16.26 C ATOM 1622 CD2 LEU A 619 -9.958 9.152 38.925 1.00 17.17 C ATOM 1623 H LEU A 619 -10.988 6.891 37.394 1.00 0.00 H ATOM 1624 N SER A 620 -14.013 5.848 37.826 1.00 13.19 N ATOM 1625 CA SER A 620 -15.291 5.148 37.645 1.00 13.97 C ATOM 1626 C SER A 620 -15.322 3.844 38.437 1.00 13.98 C ATOM 1627 O SER A 620 -16.213 3.025 38.244 1.00 16.01 O ATOM 1628 CB SER A 620 -15.527 4.830 36.159 1.00 13.26 C ATOM 1629 OG SER A 620 -15.526 6.020 35.381 1.00 14.85 O ATOM 1630 HG SER A 620 -14.651 6.474 35.476 1.00 0.00 H ATOM 1631 H SER A 620 -13.200 5.584 37.233 1.00 0.00 H ATOM 1632 N PHE A 621 -14.306 3.623 39.271 1.00 14.02 N ATOM 1633 CA PHE A 621 -14.167 2.374 40.022 1.00 16.97 C ATOM 1634 C PHE A 621 -14.075 1.123 39.146 1.00 20.03 C ATOM 1635 O PHE A 621 -14.623 0.063 39.479 1.00 15.89 O ATOM 1636 CB PHE A 621 -15.302 2.230 41.045 1.00 16.92 C ATOM 1637 CG PHE A 621 -15.279 3.285 42.120 1.00 16.28 C ATOM 1638 CD1 PHE A 621 -16.062 4.418 42.014 1.00 19.26 C ATOM 1639 CD2 PHE A 621 -14.454 3.143 43.233 1.00 22.03 C ATOM 1640 CE1 PHE A 621 -16.038 5.405 43.015 1.00 24.37 C ATOM 1641 CE2 PHE A 621 -14.419 4.115 44.236 1.00 16.24 C ATOM 1642 CZ PHE A 621 -15.213 5.243 44.130 1.00 19.97 C ATOM 1643 H PHE A 621 -13.587 4.364 39.393 1.00 0.00 H ATOM 1644 N GLY A 622 -13.382 1.240 38.024 1.00 14.39 N ATOM 1645 CA GLY A 622 -13.053 0.065 37.247 1.00 14.97 C ATOM 1646 C GLY A 622 -14.004 -0.265 36.114 1.00 23.13 C ATOM 1647 O GLY A 622 -13.895 -1.335 35.527 1.00 20.55 O ATOM 1648 H GLY A 622 -13.073 2.179 37.700 1.00 0.00 H ATOM 1649 N LYS A 623 -14.926 0.636 35.789 1.00 18.37 N ATOM 1650 CA LYS A 623 -15.787 0.424 34.627 1.00 21.58 C ATOM 1651 C LYS A 623 -14.971 0.457 33.339 1.00 24.09 C ATOM 1652 O LYS A 623 -13.950 1.154 33.263 1.00 15.43 O ATOM 1653 CB LYS A 623 -16.874 1.500 34.557 1.00 20.48 C ATOM 1654 CG LYS A 623 -17.842 1.485 35.724 1.00 23.92 C ATOM 1655 CD LYS A 623 -18.897 2.581 35.575 1.00 28.77 C ATOM 1656 CE LYS A 623 -19.743 2.678 36.821 1.00 27.72 C ATOM 1657 NZ LYS A 623 -20.268 1.339 37.168 1.00 37.44 N ATOM 1658 HZ1 LYS A 623 -20.848 0.981 36.382 1.00 0.00 H ATOM 1659 HZ2 LYS A 623 -19.473 0.690 37.338 1.00 0.00 H ATOM 1660 HZ3 LYS A 623 -20.851 1.408 38.027 1.00 0.00 H ATOM 1661 H LYS A 623 -15.035 1.496 36.364 1.00 0.00 H ATOM 1662 N GLN A 624 -15.450 -0.267 32.327 1.00 21.32 N ATOM 1663 CA GLN A 624 -14.808 -0.300 31.016 1.00 20.15 C ATOM 1664 C GLN A 624 -15.148 0.936 30.211 1.00 22.24 C ATOM 1665 O GLN A 624 -16.324 1.299 30.082 1.00 19.28 O ATOM 1666 CB GLN A 624 -15.236 -1.534 30.200 1.00 23.58 C ATOM 1667 CG GLN A 624 -14.530 -1.590 28.835 1.00 33.16 C ATOM 1668 CD GLN A 624 -15.123 -2.596 27.858 1.00 36.20 C ATOM 1669 OE1 GLN A 624 -16.001 -2.259 27.050 1.00 29.97 O ATOM 1670 NE2 GLN A 624 -14.611 -3.828 27.897 1.00 35.83 N ATOM 1671 HE22 GLN A 624 -13.875 -4.064 28.593 1.00 0.00 H ATOM 1672 HE21 GLN A 624 -14.948 -4.552 27.231 1.00 0.00 H ATOM 1673 H GLN A 624 -16.312 -0.829 32.477 1.00 0.00 H ATOM 1674 N PRO A 625 -14.123 1.588 29.648 1.00 20.60 N ATOM 1675 CA PRO A 625 -14.424 2.744 28.802 1.00 19.46 C ATOM 1676 C PRO A 625 -15.267 2.330 27.588 1.00 20.58 C ATOM 1677 O PRO A 625 -15.007 1.292 26.985 1.00 19.29 O ATOM 1678 CB PRO A 625 -13.035 3.211 28.348 1.00 17.72 C ATOM 1679 CG PRO A 625 -12.172 1.973 28.428 1.00 20.83 C ATOM 1680 CD PRO A 625 -12.683 1.260 29.661 1.00 21.57 C ATOM 1681 N PHE A 626 -16.276 3.129 27.256 1.00 18.47 N ATOM 1682 CA PHE A 626 -17.106 2.861 26.093 1.00 22.90 C ATOM 1683 C PHE A 626 -17.759 1.473 26.113 1.00 20.64 C ATOM 1684 O PHE A 626 -17.932 0.852 25.063 1.00 21.01 O ATOM 1685 CB PHE A 626 -16.294 3.073 24.801 1.00 18.34 C ATOM 1686 CG PHE A 626 -15.885 4.501 24.583 1.00 22.37 C ATOM 1687 CD1 PHE A 626 -16.842 5.484 24.400 1.00 23.03 C ATOM 1688 CD2 PHE A 626 -14.545 4.863 24.560 1.00 19.59 C ATOM 1689 CE1 PHE A 626 -16.474 6.807 24.206 1.00 23.53 C ATOM 1690 CE2 PHE A 626 -14.168 6.180 24.360 1.00 21.69 C ATOM 1691 CZ PHE A 626 -15.128 7.154 24.184 1.00 24.38 C ATOM 1692 H PHE A 626 -16.476 3.965 27.842 1.00 0.00 H ATOM 1693 N PHE A 627 -18.147 0.996 27.294 1.00 20.96 N ATOM 1694 CA PHE A 627 -18.829 -0.299 27.376 1.00 23.79 C ATOM 1695 C PHE A 627 -20.147 -0.276 26.590 1.00 23.72 C ATOM 1696 O PHE A 627 -20.639 -1.307 26.151 1.00 24.22 O ATOM 1697 CB PHE A 627 -19.046 -0.744 28.834 1.00 23.15 C ATOM 1698 CG PHE A 627 -19.973 0.154 29.635 1.00 20.99 C ATOM 1699 CD1 PHE A 627 -21.361 -0.034 29.599 1.00 22.13 C ATOM 1700 CD2 PHE A 627 -19.460 1.162 30.447 1.00 15.48 C ATOM 1701 CE1 PHE A 627 -22.210 0.785 30.351 1.00 20.43 C ATOM 1702 CE2 PHE A 627 -20.295 1.977 31.194 1.00 19.67 C ATOM 1703 CZ PHE A 627 -21.678 1.792 31.145 1.00 19.52 C ATOM 1704 H PHE A 627 -17.966 1.543 28.160 1.00 0.00 H ATOM 1705 N TRP A 628 -20.685 0.919 26.385 1.00 27.17 N ATOM 1706 CA TRP A 628 -21.949 1.074 25.671 1.00 28.72 C ATOM 1707 C TRP A 628 -21.785 1.013 24.149 1.00 33.34 C ATOM 1708 O TRP A 628 -22.775 0.983 23.420 1.00 35.93 O ATOM 1709 CB TRP A 628 -22.643 2.377 26.093 1.00 18.46 C ATOM 1710 CG TRP A 628 -21.784 3.603 25.934 1.00 24.98 C ATOM 1711 CD1 TRP A 628 -21.755 4.445 24.864 1.00 22.52 C ATOM 1712 CD2 TRP A 628 -20.842 4.129 26.882 1.00 21.50 C ATOM 1713 NE1 TRP A 628 -20.857 5.456 25.077 1.00 24.65 N ATOM 1714 CE2 TRP A 628 -20.279 5.289 26.308 1.00 23.24 C ATOM 1715 CE3 TRP A 628 -20.418 3.728 28.156 1.00 19.76 C ATOM 1716 CZ2 TRP A 628 -19.300 6.053 26.957 1.00 18.10 C ATOM 1717 CZ3 TRP A 628 -19.444 4.489 28.805 1.00 16.75 C ATOM 1718 CH2 TRP A 628 -18.900 5.644 28.202 1.00 18.24 C ATOM 1719 HE1 TRP A 628 -20.647 6.227 24.411 1.00 0.00 H ATOM 1720 H TRP A 628 -20.195 1.765 26.741 1.00 0.00 H ATOM 1721 N LEU A 629 -20.543 0.978 23.670 1.00 27.48 N ATOM 1722 CA LEU A 629 -20.291 0.970 22.236 1.00 32.01 C ATOM 1723 C LEU A 629 -19.681 -0.342 21.760 1.00 37.98 C ATOM 1724 O LEU A 629 -19.037 -1.068 22.528 1.00 30.35 O ATOM 1725 CB LEU A 629 -19.343 2.108 21.839 1.00 30.25 C ATOM 1726 CG LEU A 629 -19.756 3.568 21.969 1.00 32.69 C ATOM 1727 CD1 LEU A 629 -18.608 4.475 21.513 1.00 32.83 C ATOM 1728 CD2 LEU A 629 -21.025 3.865 21.180 1.00 32.45 C ATOM 1729 H LEU A 629 -19.740 0.956 24.331 1.00 0.00 H ATOM 1730 N GLU A 630 -19.896 -0.629 20.478 1.00 42.21 N ATOM 1731 CA GLU A 630 -19.099 -1.619 19.770 1.00 43.20 C ATOM 1732 C GLU A 630 -17.900 -0.906 19.174 1.00 39.42 C ATOM 1733 O GLU A 630 -17.997 0.268 18.803 1.00 41.24 O ATOM 1734 CB GLU A 630 -19.912 -2.291 18.661 1.00 44.49 C ATOM 1735 CG GLU A 630 -20.794 -3.428 19.140 1.00 47.70 C ATOM 1736 CD GLU A 630 -21.567 -4.087 18.011 1.00 57.08 C ATOM 1737 OE1 GLU A 630 -21.081 -4.074 16.860 1.00 54.73 O ATOM 1738 OE2 GLU A 630 -22.669 -4.614 18.277 1.00 61.08 O ATOM 1739 H GLU A 630 -20.654 -0.132 19.969 1.00 0.00 H ATOM 1740 N ASN A 631 -16.779 -1.619 19.089 1.00 42.56 N ATOM 1741 CA ASN A 631 -15.524 -1.068 18.572 1.00 37.99 C ATOM 1742 C ASN A 631 -15.654 -0.189 17.326 1.00 44.27 C ATOM 1743 O ASN A 631 -15.029 0.868 17.245 1.00 38.37 O ATOM 1744 CB ASN A 631 -14.529 -2.196 18.304 1.00 43.83 C ATOM 1745 CG ASN A 631 -13.939 -2.762 19.572 1.00 44.43 C ATOM 1746 OD1 ASN A 631 -13.815 -2.061 20.578 1.00 41.37 O ATOM 1747 ND2 ASN A 631 -13.571 -4.035 19.538 1.00 44.26 N ATOM 1748 HD22 ASN A 631 -13.694 -4.589 18.666 1.00 0.00 H ATOM 1749 HD21 ASN A 631 -13.159 -4.480 20.383 1.00 0.00 H ATOM 1750 H ASN A 631 -16.795 -2.610 19.403 1.00 0.00 H ATOM 1751 N LYS A 632 -16.486 -0.617 16.377 1.00 41.41 N ATOM 1752 CA LYS A 632 -16.643 0.078 15.104 1.00 35.39 C ATOM 1753 C LYS A 632 -17.203 1.490 15.267 1.00 43.75 C ATOM 1754 O LYS A 632 -16.997 2.358 14.411 1.00 43.60 O ATOM 1755 CB LYS A 632 -17.553 -0.729 14.172 1.00 45.51 C ATOM 1756 H LYS A 632 -17.044 -1.478 16.550 1.00 0.00 H ATOM 1757 N ASP A 633 -17.906 1.718 16.371 1.00 40.12 N ATOM 1758 CA ASP A 633 -18.567 2.991 16.605 1.00 40.27 C ATOM 1759 C ASP A 633 -17.663 4.016 17.301 1.00 42.00 C ATOM 1760 O ASP A 633 -17.978 5.205 17.328 1.00 42.98 O ATOM 1761 CB ASP A 633 -19.831 2.755 17.429 1.00 44.93 C ATOM 1762 CG ASP A 633 -20.749 1.729 16.792 1.00 51.96 C ATOM 1763 OD1 ASP A 633 -20.977 1.832 15.567 1.00 45.31 O ATOM 1764 OD2 ASP A 633 -21.217 0.814 17.508 1.00 52.47 O ATOM 1765 H ASP A 633 -17.985 0.967 17.086 1.00 0.00 H ATOM 1766 N VAL A 634 -16.543 3.556 17.853 1.00 40.00 N ATOM 1767 CA VAL A 634 -15.688 4.416 18.678 1.00 36.38 C ATOM 1768 C VAL A 634 -15.174 5.661 17.958 1.00 33.35 C ATOM 1769 O VAL A 634 -15.404 6.785 18.408 1.00 35.15 O ATOM 1770 CB VAL A 634 -14.504 3.624 19.275 1.00 37.77 C ATOM 1771 CG1 VAL A 634 -13.506 4.563 19.975 1.00 30.12 C ATOM 1772 CG2 VAL A 634 -15.004 2.564 20.231 1.00 32.04 C ATOM 1773 H VAL A 634 -16.268 2.565 17.696 1.00 0.00 H ATOM 1774 N ILE A 635 -14.500 5.468 16.829 1.00 37.90 N ATOM 1775 CA ILE A 635 -13.865 6.586 16.138 1.00 33.87 C ATOM 1776 C ILE A 635 -14.857 7.655 15.669 1.00 38.01 C ATOM 1777 O ILE A 635 -14.577 8.851 15.778 1.00 36.47 O ATOM 1778 CB ILE A 635 -12.946 6.110 14.979 1.00 39.50 C ATOM 1779 CG1 ILE A 635 -12.007 7.238 14.530 1.00 40.66 C ATOM 1780 CG2 ILE A 635 -13.761 5.591 13.801 1.00 41.33 C ATOM 1781 CD1 ILE A 635 -10.722 7.314 15.327 1.00 38.13 C ATOM 1782 H ILE A 635 -14.424 4.509 16.433 1.00 0.00 H ATOM 1783 N GLY A 636 -16.028 7.238 15.188 1.00 35.42 N ATOM 1784 CA GLY A 636 -17.023 8.192 14.726 1.00 34.82 C ATOM 1785 C GLY A 636 -17.496 9.106 15.844 1.00 34.97 C ATOM 1786 O GLY A 636 -17.692 10.310 15.657 1.00 39.79 O ATOM 1787 H GLY A 636 -16.232 6.219 15.143 1.00 0.00 H ATOM 1788 N VAL A 637 -17.678 8.517 17.018 1.00 37.62 N ATOM 1789 CA VAL A 637 -18.022 9.252 18.226 1.00 32.72 C ATOM 1790 C VAL A 637 -16.925 10.266 18.566 1.00 35.23 C ATOM 1791 O VAL A 637 -17.206 11.439 18.834 1.00 35.33 O ATOM 1792 CB VAL A 637 -18.242 8.257 19.384 1.00 40.34 C ATOM 1793 CG1 VAL A 637 -18.285 8.959 20.717 1.00 33.52 C ATOM 1794 CG2 VAL A 637 -19.522 7.454 19.156 1.00 38.78 C ATOM 1795 H VAL A 637 -17.570 7.484 17.078 1.00 0.00 H ATOM 1796 N LEU A 638 -15.674 9.818 18.533 1.00 31.18 N ATOM 1797 CA LEU A 638 -14.545 10.701 18.813 1.00 33.35 C ATOM 1798 C LEU A 638 -14.494 11.836 17.788 1.00 36.49 C ATOM 1799 O LEU A 638 -14.342 13.006 18.145 1.00 35.16 O ATOM 1800 CB LEU A 638 -13.231 9.900 18.830 1.00 31.15 C ATOM 1801 CG LEU A 638 -13.200 8.785 19.879 1.00 30.43 C ATOM 1802 CD1 LEU A 638 -11.935 7.934 19.810 1.00 29.20 C ATOM 1803 CD2 LEU A 638 -13.368 9.373 21.277 1.00 31.10 C ATOM 1804 H LEU A 638 -15.496 8.819 18.303 1.00 0.00 H ATOM 1805 N GLU A 639 -14.661 11.488 16.516 1.00 41.31 N ATOM 1806 CA GLU A 639 -14.645 12.477 15.439 1.00 41.10 C ATOM 1807 C GLU A 639 -15.763 13.522 15.564 1.00 42.83 C ATOM 1808 O GLU A 639 -15.611 14.653 15.106 1.00 44.51 O ATOM 1809 CB GLU A 639 -14.663 11.776 14.075 1.00 42.29 C ATOM 1810 CG GLU A 639 -13.423 10.912 13.844 1.00 43.56 C ATOM 1811 CD GLU A 639 -13.553 9.965 12.669 1.00 46.10 C ATOM 1812 OE1 GLU A 639 -12.563 9.824 11.922 1.00 50.69 O ATOM 1813 OE2 GLU A 639 -14.629 9.349 12.499 1.00 46.94 O ATOM 1814 H GLU A 639 -14.807 10.486 16.281 1.00 0.00 H ATOM 1815 N LYS A 640 -16.867 13.155 16.212 1.00 37.85 N ATOM 1816 CA LYS A 640 -17.971 14.090 16.430 1.00 40.27 C ATOM 1817 C LYS A 640 -17.730 14.962 17.658 1.00 40.65 C ATOM 1818 O LYS A 640 -18.517 15.855 17.959 1.00 41.06 O ATOM 1819 CB LYS A 640 -19.305 13.348 16.573 1.00 44.07 C ATOM 1820 H LYS A 640 -16.946 12.182 16.571 1.00 0.00 H ATOM 1821 N GLY A 641 -16.637 14.699 18.369 1.00 40.32 N ATOM 1822 CA GLY A 641 -16.300 15.483 19.544 1.00 37.37 C ATOM 1823 C GLY A 641 -16.822 14.904 20.850 1.00 33.46 C ATOM 1824 O GLY A 641 -16.634 15.499 21.911 1.00 31.77 O ATOM 1825 H GLY A 641 -16.013 13.919 18.079 1.00 0.00 H ATOM 1826 N ASP A 642 -17.485 13.755 20.786 1.00 31.78 N ATOM 1827 CA ASP A 642 -17.991 13.125 22.004 1.00 30.54 C ATOM 1828 C ASP A 642 -16.855 12.427 22.774 1.00 29.81 C ATOM 1829 O ASP A 642 -15.900 11.941 22.175 1.00 27.67 O ATOM 1830 CB ASP A 642 -19.072 12.102 21.671 1.00 31.99 C ATOM 1831 CG ASP A 642 -20.239 12.703 20.919 1.00 39.77 C ATOM 1832 OD1 ASP A 642 -20.566 13.884 21.161 1.00 36.34 O ATOM 1833 OD2 ASP A 642 -20.834 11.981 20.091 1.00 47.93 O ATOM 1834 H ASP A 642 -17.645 13.301 19.864 1.00 0.00 H ATOM 1835 N ARG A 643 -16.969 12.376 24.098 1.00 25.11 N ATOM 1836 CA ARG A 643 -15.910 11.817 24.936 1.00 26.46 C ATOM 1837 C ARG A 643 -16.524 10.969 26.038 1.00 21.77 C ATOM 1838 O ARG A 643 -17.728 11.010 26.226 1.00 22.19 O ATOM 1839 CB ARG A 643 -15.070 12.948 25.550 1.00 22.66 C ATOM 1840 CG ARG A 643 -14.314 13.808 24.541 1.00 24.30 C ATOM 1841 CD ARG A 643 -13.227 13.007 23.826 1.00 25.83 C ATOM 1842 NE ARG A 643 -12.420 13.851 22.946 1.00 27.43 N ATOM 1843 CZ ARG A 643 -12.625 13.990 21.639 1.00 30.38 C ATOM 1844 NH1 ARG A 643 -13.609 13.329 21.044 1.00 28.53 N ATOM 1845 NH2 ARG A 643 -11.838 14.787 20.927 1.00 32.55 N ATOM 1846 HE ARG A 643 -11.631 14.379 23.371 1.00 0.00 H ATOM 1847 HH12 ARG A 643 -13.766 13.440 20.022 1.00 0.00 H ATOM 1848 HH11 ARG A 643 -14.223 12.700 21.599 1.00 0.00 H ATOM 1849 HH22 ARG A 643 -11.997 14.897 19.905 1.00 0.00 H ATOM 1850 HH21 ARG A 643 -11.062 15.302 21.391 1.00 0.00 H ATOM 1851 H ARG A 643 -17.832 12.743 24.548 1.00 0.00 H ATOM 1852 N LEU A 644 -15.700 10.203 26.754 1.00 20.11 N ATOM 1853 CA LEU A 644 -16.159 9.497 27.956 1.00 16.62 C ATOM 1854 C LEU A 644 -16.774 10.537 28.903 1.00 16.87 C ATOM 1855 O LEU A 644 -16.213 11.614 29.102 1.00 19.47 O ATOM 1856 CB LEU A 644 -14.987 8.771 28.647 1.00 16.99 C ATOM 1857 CG LEU A 644 -14.346 7.606 27.874 1.00 15.75 C ATOM 1858 CD1 LEU A 644 -12.953 7.255 28.413 1.00 15.98 C ATOM 1859 CD2 LEU A 644 -15.247 6.361 27.913 1.00 14.27 C ATOM 1860 H LEU A 644 -14.709 10.104 26.454 1.00 0.00 H ATOM 1861 N PRO A 645 -17.946 10.235 29.478 1.00 20.97 N ATOM 1862 CA PRO A 645 -18.608 11.232 30.340 1.00 18.68 C ATOM 1863 C PRO A 645 -17.891 11.378 31.691 1.00 18.65 C ATOM 1864 O PRO A 645 -17.098 10.501 32.049 1.00 18.20 O ATOM 1865 CB PRO A 645 -20.016 10.654 30.512 1.00 21.02 C ATOM 1866 CG PRO A 645 -19.806 9.153 30.413 1.00 22.78 C ATOM 1867 CD PRO A 645 -18.656 8.944 29.449 1.00 18.01 C ATOM 1868 N LYS A 646 -18.136 12.465 32.422 1.00 15.83 N ATOM 1869 CA LYS A 646 -17.457 12.675 33.710 1.00 18.10 C ATOM 1870 C LYS A 646 -17.959 11.679 34.745 1.00 19.04 C ATOM 1871 O LYS A 646 -19.160 11.612 34.996 1.00 18.42 O ATOM 1872 CB LYS A 646 -17.711 14.081 34.242 1.00 18.75 C ATOM 1873 CG LYS A 646 -17.035 14.369 35.590 1.00 20.81 C ATOM 1874 CD LYS A 646 -17.402 15.758 36.133 1.00 23.08 C ATOM 1875 CE LYS A 646 -18.605 15.691 37.056 1.00 26.33 C ATOM 1876 NZ LYS A 646 -18.361 14.868 38.280 1.00 23.56 N ATOM 1877 HZ1 LYS A 646 -18.124 13.895 38.000 1.00 0.00 H ATOM 1878 HZ2 LYS A 646 -17.572 15.277 38.820 1.00 0.00 H ATOM 1879 HZ3 LYS A 646 -19.218 14.861 38.868 1.00 0.00 H ATOM 1880 H LYS A 646 -18.815 13.173 32.078 1.00 0.00 H ATOM 1881 N PRO A 647 -17.053 10.876 35.333 1.00 15.55 N ATOM 1882 CA PRO A 647 -17.517 9.968 36.385 1.00 18.73 C ATOM 1883 C PRO A 647 -18.103 10.745 37.566 1.00 21.41 C ATOM 1884 O PRO A 647 -17.669 11.869 37.827 1.00 19.38 O ATOM 1885 CB PRO A 647 -16.228 9.250 36.814 1.00 16.55 C ATOM 1886 CG PRO A 647 -15.399 9.260 35.562 1.00 16.07 C ATOM 1887 CD PRO A 647 -15.651 10.613 34.961 1.00 16.49 C ATOM 1888 N ASP A 648 -19.062 10.147 38.267 1.00 23.05 N ATOM 1889 CA ASP A 648 -19.742 10.815 39.378 1.00 27.71 C ATOM 1890 C ASP A 648 -18.791 11.393 40.424 1.00 30.72 C ATOM 1891 O ASP A 648 -18.920 12.552 40.809 1.00 31.30 O ATOM 1892 CB ASP A 648 -20.743 9.861 40.039 1.00 34.52 C ATOM 1893 CG ASP A 648 -21.486 10.506 41.201 1.00 43.12 C ATOM 1894 OD1 ASP A 648 -22.282 11.440 40.959 1.00 46.33 O ATOM 1895 OD2 ASP A 648 -21.283 10.074 42.357 1.00 48.29 O ATOM 1896 H ASP A 648 -19.337 9.175 38.018 1.00 0.00 H ATOM 1897 N LEU A 649 -17.826 10.598 40.873 1.00 26.45 N ATOM 1898 CA LEU A 649 -16.929 11.053 41.935 1.00 28.43 C ATOM 1899 C LEU A 649 -15.873 12.035 41.443 1.00 30.05 C ATOM 1900 O LEU A 649 -15.215 12.709 42.236 1.00 30.49 O ATOM 1901 CB LEU A 649 -16.240 9.861 42.603 1.00 33.36 C ATOM 1902 H LEU A 649 -17.708 9.648 40.467 1.00 0.00 H ATOM 1903 N CYS A 650 -15.705 12.113 40.131 1.00 25.30 N ATOM 1904 CA CYS A 650 -14.623 12.898 39.555 1.00 21.55 C ATOM 1905 C CYS A 650 -14.787 14.411 39.777 1.00 24.27 C ATOM 1906 O CYS A 650 -15.773 15.003 39.336 1.00 20.88 O ATOM 1907 CB CYS A 650 -14.510 12.596 38.057 1.00 20.51 C ATOM 1908 SG CYS A 650 -13.127 13.374 37.221 1.00 23.10 S ATOM 1909 H CYS A 650 -16.358 11.604 39.501 1.00 0.00 H ATOM 1910 N PRO A 651 -13.802 15.042 40.445 1.00 22.97 N ATOM 1911 CA PRO A 651 -13.749 16.509 40.547 1.00 23.39 C ATOM 1912 C PRO A 651 -13.750 17.137 39.161 1.00 21.68 C ATOM 1913 O PRO A 651 -13.008 16.669 38.287 1.00 19.21 O ATOM 1914 CB PRO A 651 -12.394 16.775 41.207 1.00 27.49 C ATOM 1915 CG PRO A 651 -12.043 15.482 41.901 1.00 31.17 C ATOM 1916 CD PRO A 651 -12.627 14.395 41.050 1.00 25.15 C ATOM 1917 N PRO A 652 -14.566 18.181 38.959 1.00 20.29 N ATOM 1918 CA PRO A 652 -14.646 18.847 37.657 1.00 23.71 C ATOM 1919 C PRO A 652 -13.286 19.265 37.097 1.00 21.91 C ATOM 1920 O PRO A 652 -13.073 19.134 35.886 1.00 22.65 O ATOM 1921 CB PRO A 652 -15.537 20.055 37.950 1.00 23.14 C ATOM 1922 CG PRO A 652 -16.461 19.555 39.024 1.00 24.95 C ATOM 1923 CD PRO A 652 -15.599 18.674 39.894 1.00 25.03 C ATOM 1924 N VAL A 653 -12.378 19.733 37.952 1.00 20.05 N ATOM 1925 CA VAL A 653 -11.040 20.125 37.503 1.00 22.19 C ATOM 1926 C VAL A 653 -10.279 18.955 36.858 1.00 16.49 C ATOM 1927 O VAL A 653 -9.545 19.137 35.878 1.00 17.35 O ATOM 1928 CB VAL A 653 -10.196 20.761 38.661 1.00 20.91 C ATOM 1929 CG1 VAL A 653 -10.026 19.791 39.826 1.00 19.20 C ATOM 1930 CG2 VAL A 653 -8.845 21.251 38.162 1.00 20.94 C ATOM 1931 H VAL A 653 -12.624 19.822 38.959 1.00 0.00 H ATOM 1932 N LEU A 654 -10.468 17.762 37.407 1.00 18.33 N ATOM 1933 CA LEU A 654 -9.820 16.574 36.872 1.00 19.66 C ATOM 1934 C LEU A 654 -10.456 16.154 35.547 1.00 18.47 C ATOM 1935 O LEU A 654 -9.757 15.711 34.631 1.00 18.19 O ATOM 1936 CB LEU A 654 -9.846 15.449 37.903 1.00 12.86 C ATOM 1937 CG LEU A 654 -9.164 14.149 37.478 1.00 20.27 C ATOM 1938 CD1 LEU A 654 -7.706 14.406 37.096 1.00 19.50 C ATOM 1939 CD2 LEU A 654 -9.265 13.157 38.620 1.00 17.03 C ATOM 1940 H LEU A 654 -11.091 17.674 38.235 1.00 0.00 H ATOM 1941 N TYR A 655 -11.772 16.317 35.426 1.00 15.68 N ATOM 1942 CA TYR A 655 -12.424 16.003 34.155 1.00 18.41 C ATOM 1943 C TYR A 655 -11.944 16.955 33.068 1.00 17.33 C ATOM 1944 O TYR A 655 -11.730 16.546 31.926 1.00 19.62 O ATOM 1945 CB TYR A 655 -13.963 16.016 34.255 1.00 18.42 C ATOM 1946 CG TYR A 655 -14.625 15.507 32.983 1.00 19.18 C ATOM 1947 CD1 TYR A 655 -14.375 14.217 32.516 1.00 16.78 C ATOM 1948 CD2 TYR A 655 -15.488 16.319 32.240 1.00 19.10 C ATOM 1949 CE1 TYR A 655 -14.968 13.743 31.343 1.00 16.85 C ATOM 1950 CE2 TYR A 655 -16.088 15.855 31.069 1.00 19.22 C ATOM 1951 CZ TYR A 655 -15.825 14.571 30.626 1.00 16.93 C ATOM 1952 OH TYR A 655 -16.421 14.116 29.464 1.00 20.23 O ATOM 1953 HH TYR A 655 -16.131 13.186 29.288 1.00 0.00 H ATOM 1954 H TYR A 655 -12.332 16.665 36.230 1.00 0.00 H ATOM 1955 N THR A 656 -11.764 18.227 33.423 1.00 20.72 N ATOM 1956 CA THR A 656 -11.226 19.202 32.472 1.00 22.95 C ATOM 1957 C THR A 656 -9.833 18.786 32.029 1.00 20.12 C ATOM 1958 O THR A 656 -9.482 18.894 30.854 1.00 23.09 O ATOM 1959 CB THR A 656 -11.169 20.628 33.064 1.00 29.21 C ATOM 1960 OG1 THR A 656 -12.498 21.103 33.300 1.00 25.59 O ATOM 1961 CG2 THR A 656 -10.476 21.581 32.105 1.00 31.63 C ATOM 1962 HG1 THR A 656 -12.955 20.499 33.938 1.00 0.00 H ATOM 1963 H THR A 656 -12.009 18.531 34.387 1.00 0.00 H ATOM 1964 N LEU A 657 -9.044 18.287 32.975 1.00 21.77 N ATOM 1965 CA LEU A 657 -7.728 17.738 32.660 1.00 23.72 C ATOM 1966 C LEU A 657 -7.824 16.532 31.715 1.00 19.35 C ATOM 1967 O LEU A 657 -7.100 16.464 30.710 1.00 20.04 O ATOM 1968 CB LEU A 657 -6.982 17.366 33.948 1.00 23.05 C ATOM 1969 CG LEU A 657 -5.458 17.325 33.843 1.00 26.82 C ATOM 1970 CD1 LEU A 657 -4.901 18.717 33.539 1.00 28.60 C ATOM 1971 CD2 LEU A 657 -4.816 16.742 35.105 1.00 24.96 C ATOM 1972 H LEU A 657 -9.371 18.288 33.962 1.00 0.00 H ATOM 1973 N MET A 658 -8.718 15.589 32.018 1.00 18.39 N ATOM 1974 CA MET A 658 -8.936 14.441 31.131 1.00 17.21 C ATOM 1975 C MET A 658 -9.333 14.907 29.739 1.00 20.26 C ATOM 1976 O MET A 658 -8.869 14.371 28.725 1.00 18.24 O ATOM 1977 CB MET A 658 -10.035 13.519 31.682 1.00 17.09 C ATOM 1978 CG MET A 658 -9.720 12.753 32.958 1.00 17.93 C ATOM 1979 SD MET A 658 -11.239 11.915 33.505 1.00 25.23 S ATOM 1980 CE MET A 658 -10.814 11.421 35.179 1.00 23.38 C ATOM 1981 H MET A 658 -9.269 15.669 32.897 1.00 0.00 H ATOM 1982 N THR A 659 -10.195 15.915 29.697 1.00 15.54 N ATOM 1983 CA THR A 659 -10.667 16.468 28.431 1.00 21.65 C ATOM 1984 C THR A 659 -9.527 17.026 27.575 1.00 25.44 C ATOM 1985 O THR A 659 -9.499 16.811 26.357 1.00 22.46 O ATOM 1986 CB THR A 659 -11.763 17.532 28.668 1.00 23.17 C ATOM 1987 OG1 THR A 659 -12.917 16.878 29.227 1.00 22.83 O ATOM 1988 CG2 THR A 659 -12.145 18.204 27.371 1.00 30.82 C ATOM 1989 HG1 THR A 659 -12.669 16.449 30.084 1.00 0.00 H ATOM 1990 H THR A 659 -10.543 16.321 30.589 1.00 0.00 H ATOM 1991 N ARG A 660 -8.578 17.716 28.205 1.00 19.62 N ATOM 1992 CA ARG A 660 -7.399 18.180 27.477 1.00 22.81 C ATOM 1993 C ARG A 660 -6.609 17.008 26.902 1.00 24.73 C ATOM 1994 O ARG A 660 -6.140 17.059 25.758 1.00 25.07 O ATOM 1995 CB ARG A 660 -6.486 19.000 28.393 1.00 21.24 C ATOM 1996 CG ARG A 660 -7.107 20.274 28.888 1.00 29.98 C ATOM 1997 CD ARG A 660 -6.078 21.188 29.511 1.00 33.57 C ATOM 1998 NE ARG A 660 -6.726 22.405 29.982 1.00 42.10 N ATOM 1999 CZ ARG A 660 -7.232 22.553 31.201 1.00 43.88 C ATOM 2000 NH1 ARG A 660 -7.140 21.560 32.090 1.00 36.48 N ATOM 2001 NH2 ARG A 660 -7.822 23.696 31.531 1.00 42.00 N ATOM 2002 HE ARG A 660 -6.797 23.207 29.323 1.00 0.00 H ATOM 2003 HH12 ARG A 660 -7.537 21.678 33.044 1.00 0.00 H ATOM 2004 HH11 ARG A 660 -6.672 20.669 31.828 1.00 0.00 H ATOM 2005 HH22 ARG A 660 -8.221 23.819 32.484 1.00 0.00 H ATOM 2006 HH21 ARG A 660 -7.885 24.468 30.837 1.00 0.00 H ATOM 2007 H ARG A 660 -8.676 17.925 29.219 1.00 0.00 H ATOM 2008 N CYS A 661 -6.454 15.954 27.697 1.00 19.28 N ATOM 2009 CA CYS A 661 -5.703 14.772 27.260 1.00 18.90 C ATOM 2010 C CYS A 661 -6.350 14.108 26.056 1.00 21.45 C ATOM 2011 O CYS A 661 -5.696 13.373 25.314 1.00 17.77 O ATOM 2012 CB CYS A 661 -5.614 13.744 28.395 1.00 15.95 C ATOM 2013 SG CYS A 661 -4.527 14.245 29.787 1.00 17.15 S ATOM 2014 H CYS A 661 -6.874 15.968 28.648 1.00 0.00 H ATOM 2015 N TRP A 662 -7.654 14.335 25.903 1.00 18.50 N ATOM 2016 CA TRP A 662 -8.415 13.783 24.793 1.00 20.43 C ATOM 2017 C TRP A 662 -8.609 14.831 23.690 1.00 25.91 C ATOM 2018 O TRP A 662 -9.540 14.730 22.887 1.00 24.67 O ATOM 2019 CB TRP A 662 -9.784 13.265 25.271 1.00 18.79 C ATOM 2020 CG TRP A 662 -9.685 12.124 26.248 1.00 20.17 C ATOM 2021 CD1 TRP A 662 -8.745 11.133 26.265 1.00 16.03 C ATOM 2022 CD2 TRP A 662 -10.558 11.872 27.356 1.00 15.78 C ATOM 2023 NE1 TRP A 662 -8.986 10.275 27.323 1.00 17.56 N ATOM 2024 CE2 TRP A 662 -10.089 10.708 28.001 1.00 13.87 C ATOM 2025 CE3 TRP A 662 -11.689 12.519 27.860 1.00 19.44 C ATOM 2026 CZ2 TRP A 662 -10.712 10.184 29.131 1.00 16.48 C ATOM 2027 CZ3 TRP A 662 -12.311 11.988 28.984 1.00 18.78 C ATOM 2028 CH2 TRP A 662 -11.820 10.830 29.601 1.00 15.49 C ATOM 2029 HE1 TRP A 662 -8.419 9.437 27.563 1.00 0.00 H ATOM 2030 H TRP A 662 -8.145 14.928 26.602 1.00 0.00 H ATOM 2031 N ASP A 663 -7.759 15.855 23.670 1.00 25.03 N ATOM 2032 CA ASP A 663 -7.754 16.770 22.531 1.00 27.32 C ATOM 2033 C ASP A 663 -7.558 15.944 21.259 1.00 25.10 C ATOM 2034 O ASP A 663 -6.695 15.068 21.218 1.00 26.66 O ATOM 2035 CB ASP A 663 -6.646 17.816 22.672 1.00 27.64 C ATOM 2036 CG ASP A 663 -7.078 19.024 23.485 1.00 32.30 C ATOM 2037 OD1 ASP A 663 -8.251 19.087 23.892 1.00 32.08 O ATOM 2038 OD2 ASP A 663 -6.247 19.929 23.700 1.00 39.13 O ATOM 2039 H ASP A 663 -7.101 16.003 24.462 1.00 0.00 H ATOM 2040 N TYR A 664 -8.377 16.182 20.237 1.00 26.17 N ATOM 2041 CA TYR A 664 -8.234 15.415 18.999 1.00 31.22 C ATOM 2042 C TYR A 664 -6.846 15.598 18.360 1.00 28.65 C ATOM 2043 O TYR A 664 -6.227 14.632 17.929 1.00 31.35 O ATOM 2044 CB TYR A 664 -9.339 15.757 17.992 1.00 34.13 C ATOM 2045 CG TYR A 664 -9.540 14.670 16.955 1.00 34.63 C ATOM 2046 CD1 TYR A 664 -10.523 13.702 17.119 1.00 38.56 C ATOM 2047 CD2 TYR A 664 -8.728 14.592 15.832 1.00 38.93 C ATOM 2048 CE1 TYR A 664 -10.700 12.694 16.184 1.00 40.92 C ATOM 2049 CE2 TYR A 664 -8.897 13.587 14.890 1.00 41.32 C ATOM 2050 CZ TYR A 664 -9.884 12.643 15.075 1.00 38.89 C ATOM 2051 OH TYR A 664 -10.060 11.645 14.145 1.00 46.89 O ATOM 2052 HH TYR A 664 -10.805 11.058 14.430 1.00 0.00 H ATOM 2053 H TYR A 664 -9.115 16.910 20.318 1.00 0.00 H ATOM 2054 N ASP A 665 -6.372 16.839 18.308 1.00 28.09 N ATOM 2055 CA ASP A 665 -5.017 17.153 17.843 1.00 32.63 C ATOM 2056 C ASP A 665 -4.005 16.822 18.935 1.00 28.73 C ATOM 2057 O ASP A 665 -3.977 17.481 19.974 1.00 31.46 O ATOM 2058 CB ASP A 665 -4.909 18.640 17.490 1.00 30.89 C ATOM 2059 CG ASP A 665 -3.571 19.005 16.838 1.00 36.92 C ATOM 2060 OD1 ASP A 665 -3.518 20.065 16.182 1.00 43.34 O ATOM 2061 OD2 ASP A 665 -2.579 18.249 16.967 1.00 36.37 O ATOM 2062 H ASP A 665 -6.988 17.620 18.610 1.00 0.00 H ATOM 2063 N PRO A 666 -3.151 15.820 18.688 1.00 27.10 N ATOM 2064 CA PRO A 666 -2.225 15.316 19.705 1.00 29.89 C ATOM 2065 C PRO A 666 -1.180 16.334 20.148 1.00 31.89 C ATOM 2066 O PRO A 666 -0.615 16.174 21.227 1.00 27.07 O ATOM 2067 CB PRO A 666 -1.553 14.125 19.013 1.00 31.18 C ATOM 2068 CG PRO A 666 -1.740 14.351 17.568 1.00 33.16 C ATOM 2069 CD PRO A 666 -3.021 15.095 17.412 1.00 27.61 C ATOM 2070 N SER A 667 -0.934 17.360 19.336 1.00 30.62 N ATOM 2071 CA SER A 667 0.073 18.361 19.658 1.00 29.73 C ATOM 2072 C SER A 667 -0.417 19.330 20.725 1.00 29.58 C ATOM 2073 O SER A 667 0.384 20.012 21.364 1.00 30.09 O ATOM 2074 CB SER A 667 0.492 19.118 18.391 1.00 35.24 C ATOM 2075 OG SER A 667 0.931 18.201 17.407 1.00 40.07 O ATOM 2076 HG SER A 667 1.200 18.696 16.593 1.00 0.00 H ATOM 2077 H SER A 667 -1.474 17.448 18.451 1.00 0.00 H ATOM 2078 N ASP A 668 -1.734 19.377 20.919 1.00 28.91 N ATOM 2079 CA ASP A 668 -2.336 20.254 21.918 1.00 27.89 C ATOM 2080 C ASP A 668 -2.534 19.571 23.267 1.00 25.40 C ATOM 2081 O ASP A 668 -2.881 20.232 24.247 1.00 28.41 O ATOM 2082 CB ASP A 668 -3.693 20.778 21.440 1.00 30.50 C ATOM 2083 CG ASP A 668 -3.597 21.627 20.182 1.00 37.53 C ATOM 2084 OD1 ASP A 668 -2.543 21.597 19.519 1.00 37.16 O ATOM 2085 OD2 ASP A 668 -4.591 22.312 19.853 1.00 40.45 O ATOM 2086 H ASP A 668 -2.351 18.771 20.342 1.00 0.00 H ATOM 2087 N ARG A 669 -2.358 18.252 23.303 1.00 28.94 N ATOM 2088 CA ARG A 669 -2.484 17.485 24.551 1.00 28.34 C ATOM 2089 C ARG A 669 -1.357 17.843 25.498 1.00 25.24 C ATOM 2090 O ARG A 669 -0.242 18.100 25.043 1.00 25.16 O ATOM 2091 CB ARG A 669 -2.427 15.971 24.283 1.00 23.03 C ATOM 2092 CG ARG A 669 -3.669 15.400 23.635 1.00 24.01 C ATOM 2093 CD ARG A 669 -3.471 13.962 23.201 1.00 26.11 C ATOM 2094 NE ARG A 669 -4.286 13.647 22.030 1.00 28.14 N ATOM 2095 CZ ARG A 669 -4.061 12.623 21.214 1.00 25.50 C ATOM 2096 NH1 ARG A 669 -3.068 11.793 21.460 1.00 25.74 N ATOM 2097 NH2 ARG A 669 -4.848 12.423 20.167 1.00 30.98 N ATOM 2098 HE ARG A 669 -5.096 14.265 21.821 1.00 0.00 H ATOM 2099 HH12 ARG A 669 -2.891 10.991 20.822 1.00 0.00 H ATOM 2100 HH11 ARG A 669 -2.462 11.940 22.292 1.00 0.00 H ATOM 2101 HH22 ARG A 669 -4.671 11.621 19.529 1.00 0.00 H ATOM 2102 HH21 ARG A 669 -5.643 13.068 19.983 1.00 0.00 H ATOM 2103 H ARG A 669 -2.125 17.750 22.423 1.00 0.00 H ATOM 2104 N PRO A 670 -1.636 17.835 26.817 1.00 23.05 N ATOM 2105 CA PRO A 670 -0.591 18.075 27.815 1.00 23.32 C ATOM 2106 C PRO A 670 0.488 17.007 27.711 1.00 23.39 C ATOM 2107 O PRO A 670 0.223 15.900 27.220 1.00 23.77 O ATOM 2108 CB PRO A 670 -1.336 17.918 29.152 1.00 24.10 C ATOM 2109 CG PRO A 670 -2.788 18.135 28.814 1.00 24.53 C ATOM 2110 CD PRO A 670 -2.936 17.537 27.446 1.00 22.13 C ATOM 2111 N ARG A 671 1.693 17.330 28.165 1.00 20.30 N ATOM 2112 CA ARG A 671 2.758 16.337 28.271 1.00 23.43 C ATOM 2113 C ARG A 671 2.749 15.758 29.681 1.00 21.78 C ATOM 2114 O ARG A 671 2.172 16.361 30.597 1.00 19.55 O ATOM 2115 CB ARG A 671 4.114 16.980 27.970 1.00 27.96 C ATOM 2116 CG ARG A 671 4.217 17.507 26.538 1.00 31.29 C ATOM 2117 CD ARG A 671 5.336 16.796 25.809 1.00 40.78 C ATOM 2118 NE ARG A 671 6.616 17.025 26.474 1.00 49.24 N ATOM 2119 CZ ARG A 671 7.684 16.250 26.330 1.00 47.81 C ATOM 2120 NH1 ARG A 671 7.630 15.190 25.540 1.00 46.91 N ATOM 2121 NH2 ARG A 671 8.803 16.534 26.983 1.00 54.47 N ATOM 2122 HE ARG A 671 6.696 17.850 27.102 1.00 0.00 H ATOM 2123 HH12 ARG A 671 8.467 14.583 25.427 1.00 0.00 H ATOM 2124 HH11 ARG A 671 6.751 14.964 25.032 1.00 0.00 H ATOM 2125 HH22 ARG A 671 9.640 15.927 26.870 1.00 0.00 H ATOM 2126 HH21 ARG A 671 8.844 17.364 27.608 1.00 0.00 H ATOM 2127 H ARG A 671 1.882 18.312 28.451 1.00 0.00 H ATOM 2128 N PHE A 672 3.385 14.606 29.861 1.00 20.03 N ATOM 2129 CA PHE A 672 3.341 13.926 31.157 1.00 22.07 C ATOM 2130 C PHE A 672 3.928 14.762 32.300 1.00 22.72 C ATOM 2131 O PHE A 672 3.437 14.712 33.434 1.00 20.62 O ATOM 2132 CB PHE A 672 3.995 12.539 31.089 1.00 21.32 C ATOM 2133 CG PHE A 672 3.092 11.466 30.525 1.00 20.01 C ATOM 2134 CD1 PHE A 672 1.969 11.043 31.226 1.00 17.24 C ATOM 2135 CD2 PHE A 672 3.365 10.881 29.292 1.00 15.93 C ATOM 2136 CE1 PHE A 672 1.137 10.058 30.705 1.00 15.49 C ATOM 2137 CE2 PHE A 672 2.535 9.895 28.766 1.00 19.01 C ATOM 2138 CZ PHE A 672 1.424 9.485 29.471 1.00 18.82 C ATOM 2139 H PHE A 672 3.919 14.183 29.075 1.00 0.00 H ATOM 2140 N THR A 673 4.959 15.553 32.004 1.00 23.80 N ATOM 2141 CA THR A 673 5.568 16.399 33.034 1.00 20.58 C ATOM 2142 C THR A 673 4.597 17.462 33.524 1.00 22.25 C ATOM 2143 O THR A 673 4.531 17.738 34.723 1.00 19.72 O ATOM 2144 CB THR A 673 6.861 17.079 32.540 1.00 25.34 C ATOM 2145 OG1 THR A 673 6.623 17.652 31.255 1.00 29.47 O ATOM 2146 CG2 THR A 673 7.985 16.069 32.422 1.00 29.93 C ATOM 2147 HG1 THR A 673 6.357 16.939 30.621 1.00 0.00 H ATOM 2148 H THR A 673 5.334 15.570 31.034 1.00 0.00 H ATOM 2149 N GLU A 674 3.853 18.063 32.596 1.00 18.81 N ATOM 2150 CA GLU A 674 2.805 19.012 32.952 1.00 23.65 C ATOM 2151 C GLU A 674 1.704 18.327 33.755 1.00 21.85 C ATOM 2152 O GLU A 674 1.188 18.893 34.708 1.00 18.33 O ATOM 2153 CB GLU A 674 2.165 19.620 31.705 1.00 23.52 C ATOM 2154 CG GLU A 674 3.102 20.219 30.687 1.00 32.18 C ATOM 2155 CD GLU A 674 2.432 20.361 29.325 1.00 35.39 C ATOM 2156 OE1 GLU A 674 1.347 20.975 29.245 1.00 40.56 O ATOM 2157 OE2 GLU A 674 2.977 19.834 28.335 1.00 39.72 O ATOM 2158 H GLU A 674 4.024 17.850 31.593 1.00 0.00 H ATOM 2159 N LEU A 675 1.331 17.112 33.356 1.00 18.90 N ATOM 2160 CA LEU A 675 0.264 16.382 34.051 1.00 18.96 C ATOM 2161 C LEU A 675 0.620 16.032 35.494 1.00 18.05 C ATOM 2162 O LEU A 675 -0.238 16.054 36.387 1.00 18.89 O ATOM 2163 CB LEU A 675 -0.106 15.106 33.293 1.00 17.14 C ATOM 2164 CG LEU A 675 -0.889 15.298 31.996 1.00 22.02 C ATOM 2165 CD1 LEU A 675 -1.050 13.956 31.296 1.00 24.30 C ATOM 2166 CD2 LEU A 675 -2.262 15.912 32.307 1.00 18.70 C ATOM 2167 H LEU A 675 1.803 16.674 32.539 1.00 0.00 H ATOM 2168 N VAL A 676 1.884 15.700 35.722 1.00 16.29 N ATOM 2169 CA VAL A 676 2.345 15.435 37.079 1.00 17.20 C ATOM 2170 C VAL A 676 2.132 16.659 37.960 1.00 16.28 C ATOM 2171 O VAL A 676 1.680 16.547 39.096 1.00 16.48 O ATOM 2172 CB VAL A 676 3.831 15.009 37.096 1.00 20.71 C ATOM 2173 CG1 VAL A 676 4.395 15.026 38.523 1.00 21.08 C ATOM 2174 CG2 VAL A 676 3.988 13.616 36.469 1.00 20.73 C ATOM 2175 H VAL A 676 2.551 15.628 34.927 1.00 0.00 H ATOM 2176 N CYS A 677 2.450 17.834 37.429 1.00 18.64 N ATOM 2177 CA CYS A 677 2.255 19.071 38.177 1.00 16.98 C ATOM 2178 C CYS A 677 0.785 19.354 38.420 1.00 19.19 C ATOM 2179 O CYS A 677 0.389 19.716 39.525 1.00 18.33 O ATOM 2180 CB CYS A 677 2.873 20.253 37.427 1.00 24.95 C ATOM 2181 SG CYS A 677 4.662 20.132 37.308 1.00 34.30 S ATOM 2182 H CYS A 677 2.843 17.873 36.467 1.00 0.00 H ATOM 2183 N SER A 678 -0.017 19.189 37.375 1.00 16.92 N ATOM 2184 CA SER A 678 -1.446 19.441 37.465 1.00 20.00 C ATOM 2185 C SER A 678 -2.081 18.473 38.463 1.00 20.01 C ATOM 2186 O SER A 678 -2.856 18.878 39.327 1.00 15.93 O ATOM 2187 CB SER A 678 -2.107 19.310 36.089 1.00 17.89 C ATOM 2188 OG SER A 678 -1.738 20.384 35.257 1.00 25.61 O ATOM 2189 HG SER A 678 -2.174 20.281 34.374 1.00 0.00 H ATOM 2190 H SER A 678 0.387 18.872 36.470 1.00 0.00 H ATOM 2191 N LEU A 679 -1.726 17.196 38.363 1.00 14.36 N ATOM 2192 CA LEU A 679 -2.310 16.185 39.249 1.00 14.37 C ATOM 2193 C LEU A 679 -1.866 16.365 40.685 1.00 17.52 C ATOM 2194 O LEU A 679 -2.608 16.078 41.627 1.00 17.84 O ATOM 2195 CB LEU A 679 -1.988 14.770 38.752 1.00 16.53 C ATOM 2196 CG LEU A 679 -2.862 14.284 37.599 1.00 17.22 C ATOM 2197 CD1 LEU A 679 -2.347 12.930 37.078 1.00 14.06 C ATOM 2198 CD2 LEU A 679 -4.300 14.148 38.097 1.00 17.94 C ATOM 2199 H LEU A 679 -1.026 16.911 37.648 1.00 0.00 H ATOM 2200 N SER A 680 -0.647 16.849 40.856 1.00 16.32 N ATOM 2201 CA SER A 680 -0.105 17.075 42.182 1.00 16.03 C ATOM 2202 C SER A 680 -0.874 18.218 42.841 1.00 18.36 C ATOM 2203 O SER A 680 -1.131 18.197 44.041 1.00 18.23 O ATOM 2204 CB SER A 680 1.391 17.405 42.076 1.00 24.52 C ATOM 2205 OG SER A 680 1.983 17.460 43.358 1.00 33.12 O ATOM 2206 HG SER A 680 1.879 16.583 43.806 1.00 0.00 H ATOM 2207 H SER A 680 -0.066 17.072 40.023 1.00 0.00 H ATOM 2208 N ASP A 681 -1.269 19.202 42.044 1.00 20.07 N ATOM 2209 CA ASP A 681 -2.111 20.295 42.535 1.00 20.88 C ATOM 2210 C ASP A 681 -3.506 19.807 42.889 1.00 19.87 C ATOM 2211 O ASP A 681 -4.075 20.219 43.897 1.00 21.47 O ATOM 2212 CB ASP A 681 -2.252 21.394 41.490 1.00 19.91 C ATOM 2213 CG ASP A 681 -0.974 22.188 41.296 1.00 31.16 C ATOM 2214 OD1 ASP A 681 -0.030 22.017 42.094 1.00 31.92 O ATOM 2215 OD2 ASP A 681 -0.927 22.990 40.342 1.00 32.89 O ATOM 2216 H ASP A 681 -0.974 19.197 41.047 1.00 0.00 H ATOM 2217 N VAL A 682 -4.075 18.956 42.043 1.00 16.80 N ATOM 2218 CA VAL A 682 -5.419 18.445 42.318 1.00 19.04 C ATOM 2219 C VAL A 682 -5.401 17.622 43.602 1.00 19.64 C ATOM 2220 O VAL A 682 -6.284 17.755 44.461 1.00 17.34 O ATOM 2221 CB VAL A 682 -5.977 17.625 41.147 1.00 18.26 C ATOM 2222 CG1 VAL A 682 -7.251 16.883 41.563 1.00 18.05 C ATOM 2223 CG2 VAL A 682 -6.246 18.527 39.953 1.00 17.15 C ATOM 2224 H VAL A 682 -3.567 18.653 41.187 1.00 0.00 H ATOM 2225 N TYR A 683 -4.363 16.802 43.739 1.00 17.02 N ATOM 2226 CA TYR A 683 -4.191 15.951 44.909 1.00 17.23 C ATOM 2227 C TYR A 683 -4.084 16.758 46.206 1.00 19.79 C ATOM 2228 O TYR A 683 -4.726 16.419 47.210 1.00 20.45 O ATOM 2229 CB TYR A 683 -2.959 15.041 44.769 1.00 17.50 C ATOM 2230 CG TYR A 683 -2.696 14.239 46.026 1.00 20.50 C ATOM 2231 CD1 TYR A 683 -3.474 13.129 46.336 1.00 18.13 C ATOM 2232 CD2 TYR A 683 -1.695 14.606 46.917 1.00 25.48 C ATOM 2233 CE1 TYR A 683 -3.254 12.398 47.486 1.00 22.39 C ATOM 2234 CE2 TYR A 683 -1.466 13.872 48.087 1.00 24.84 C ATOM 2235 CZ TYR A 683 -2.253 12.771 48.359 1.00 25.20 C ATOM 2236 OH TYR A 683 -2.057 12.039 49.501 1.00 27.58 O ATOM 2237 HH TYR A 683 -2.707 11.293 49.529 1.00 0.00 H ATOM 2238 H TYR A 683 -3.649 16.767 42.984 1.00 0.00 H ATOM 2239 N GLN A 684 -3.255 17.798 46.190 1.00 15.87 N ATOM 2240 CA GLN A 684 -3.061 18.637 47.370 1.00 21.56 C ATOM 2241 C GLN A 684 -4.338 19.360 47.743 1.00 19.52 C ATOM 2242 O GLN A 684 -4.669 19.511 48.923 1.00 19.91 O ATOM 2243 CB GLN A 684 -1.935 19.658 47.145 1.00 21.44 C ATOM 2244 CG GLN A 684 -0.545 19.046 47.071 1.00 31.31 C ATOM 2245 CD GLN A 684 -0.176 18.267 48.327 1.00 33.11 C ATOM 2246 OE1 GLN A 684 -0.594 18.614 49.435 1.00 35.16 O ATOM 2247 NE2 GLN A 684 0.618 17.210 48.157 1.00 31.95 N ATOM 2248 HE22 GLN A 684 0.946 16.954 47.204 1.00 0.00 H ATOM 2249 HE21 GLN A 684 0.909 16.641 48.977 1.00 0.00 H ATOM 2250 H GLN A 684 -2.733 18.019 45.318 1.00 0.00 H ATOM 2251 N MET A 685 -5.053 19.822 46.730 1.00 18.30 N ATOM 2252 CA MET A 685 -6.345 20.441 46.971 1.00 20.07 C ATOM 2253 C MET A 685 -7.376 19.477 47.562 1.00 21.73 C ATOM 2254 O MET A 685 -8.089 19.825 48.518 1.00 17.71 O ATOM 2255 CB MET A 685 -6.891 21.045 45.689 1.00 20.51 C ATOM 2256 CG MET A 685 -8.085 21.918 45.934 1.00 23.43 C ATOM 2257 SD MET A 685 -9.070 22.027 44.467 1.00 36.38 S ATOM 2258 CE MET A 685 -9.853 20.385 44.513 1.00 19.84 C ATOM 2259 H MET A 685 -4.689 19.742 45.759 1.00 0.00 H ATOM 2260 N GLU A 686 -7.478 18.277 46.991 1.00 20.25 N ATOM 2261 CA GLU A 686 -8.429 17.277 47.501 1.00 21.57 C ATOM 2262 C GLU A 686 -8.079 16.855 48.919 1.00 19.71 C ATOM 2263 O GLU A 686 -8.956 16.556 49.723 1.00 22.24 O ATOM 2264 CB GLU A 686 -8.503 16.043 46.581 1.00 20.01 C ATOM 2265 CG GLU A 686 -9.153 16.318 45.233 1.00 23.63 C ATOM 2266 CD GLU A 686 -10.633 16.643 45.356 1.00 29.42 C ATOM 2267 OE1 GLU A 686 -11.256 16.250 46.369 1.00 30.33 O ATOM 2268 OE2 GLU A 686 -11.183 17.280 44.434 1.00 32.19 O ATOM 2269 H GLU A 686 -6.878 18.045 46.174 1.00 0.00 H ATOM 2270 N LYS A 687 -6.788 16.834 49.215 1.00 19.73 N ATOM 2271 CA LYS A 687 -6.312 16.540 50.562 1.00 22.78 C ATOM 2272 C LYS A 687 -6.822 17.582 51.563 1.00 24.68 C ATOM 2273 O LYS A 687 -7.312 17.235 52.629 1.00 26.21 O ATOM 2274 CB LYS A 687 -4.786 16.528 50.563 1.00 23.63 C ATOM 2275 CG LYS A 687 -4.126 15.914 51.787 1.00 29.83 C ATOM 2276 CD LYS A 687 -2.605 15.873 51.561 1.00 32.54 C ATOM 2277 CE LYS A 687 -1.906 14.842 52.431 1.00 44.40 C ATOM 2278 NZ LYS A 687 -0.558 14.476 51.876 1.00 46.80 N ATOM 2279 HZ1 LYS A 687 -0.674 14.079 50.922 1.00 0.00 H ATOM 2280 HZ2 LYS A 687 0.039 15.327 51.829 1.00 0.00 H ATOM 2281 HZ3 LYS A 687 -0.110 13.771 52.495 1.00 0.00 H ATOM 2282 H LYS A 687 -6.094 17.033 48.466 1.00 0.00 H ATOM 2283 N ASP A 688 -6.702 18.861 51.217 1.00 22.27 N ATOM 2284 CA ASP A 688 -7.181 19.935 52.092 1.00 22.66 C ATOM 2285 C ASP A 688 -8.697 19.905 52.250 1.00 24.62 C ATOM 2286 O ASP A 688 -9.229 20.036 53.351 1.00 25.50 O ATOM 2287 CB ASP A 688 -6.736 21.293 51.555 1.00 21.13 C ATOM 2288 CG ASP A 688 -5.263 21.553 51.781 1.00 26.07 C ATOM 2289 OD1 ASP A 688 -4.619 20.755 52.487 1.00 31.56 O ATOM 2290 OD2 ASP A 688 -4.754 22.560 51.251 1.00 26.27 O ATOM 2291 H ASP A 688 -6.260 19.104 50.308 1.00 0.00 H ATOM 2292 N ILE A 689 -9.394 19.724 51.141 1.00 20.68 N ATOM 2293 CA ILE A 689 -10.843 19.540 51.180 1.00 25.42 C ATOM 2294 C ILE A 689 -11.274 18.359 52.061 1.00 26.35 C ATOM 2295 O ILE A 689 -12.263 18.454 52.778 1.00 28.35 O ATOM 2296 CB ILE A 689 -11.404 19.380 49.760 1.00 25.86 C ATOM 2297 CG1 ILE A 689 -11.211 20.685 48.997 1.00 25.95 C ATOM 2298 CG2 ILE A 689 -12.870 18.983 49.778 1.00 26.14 C ATOM 2299 CD1 ILE A 689 -11.561 20.580 47.543 1.00 27.83 C ATOM 2300 H ILE A 689 -8.902 19.712 50.225 1.00 0.00 H ATOM 2301 N ALA A 690 -10.515 17.265 52.023 1.00 24.84 N ATOM 2302 CA ALA A 690 -10.831 16.065 52.810 1.00 33.08 C ATOM 2303 C ALA A 690 -10.558 16.244 54.307 1.00 32.92 C ATOM 2304 O ALA A 690 -11.310 15.758 55.148 1.00 33.59 O ATOM 2305 CB ALA A 690 -10.071 14.858 52.276 1.00 31.89 C ATOM 2306 H ALA A 690 -9.671 17.260 51.416 1.00 0.00 H ATOM 2307 N MET A 691 -9.465 16.917 54.640 1.00 35.11 N ATOM 2308 CA MET A 691 -9.135 17.142 56.044 1.00 42.39 C ATOM 2309 C MET A 691 -8.584 18.533 56.302 1.00 42.86 C ATOM 2310 O MET A 691 -7.900 18.757 57.297 1.00 49.20 O ATOM 2311 CB MET A 691 -8.154 16.082 56.541 1.00 45.54 C ATOM 2312 CG MET A 691 -6.929 15.902 55.664 1.00 40.33 C ATOM 2313 SD MET A 691 -6.386 14.184 55.700 1.00 57.98 S ATOM 2314 CE MET A 691 -7.956 13.360 55.452 1.00 44.29 C ATOM 2315 H MET A 691 -8.839 17.287 53.896 1.00 0.00 H TER 2316 MET A 691 HETATM 2317 O HOH 1 -0.264 21.727 30.600 1.00 40.61 O HETATM 2318 O HOH 2 6.798 15.034 29.430 1.00 36.35 O HETATM 2319 O HOH 3 15.858 3.464 34.541 1.00 30.78 O HETATM 2320 O HOH 4 -20.179 -1.003 37.781 1.00 32.91 O HETATM 2321 O HOH 5 6.046 -9.897 47.501 1.00 31.78 O HETATM 2322 O HOH 6 0.977 16.803 22.959 1.00 27.71 O HETATM 2323 O HOH 7 -15.448 14.264 44.154 1.00 32.62 O HETATM 2324 O HOH 8 -20.538 13.201 36.362 1.00 26.34 O HETATM 2325 O HOH 9 16.113 -5.904 26.185 1.00 32.94 O HETATM 2326 O HOH 10 5.230 -23.020 33.196 1.00 31.20 O HETATM 2327 O HOH 11 4.977 -16.037 31.675 1.00 23.76 O HETATM 2328 O HOH 12 -12.824 16.112 18.977 1.00 37.03 O HETATM 2329 O HOH 13 -7.533 -6.819 43.472 1.00 23.70 O HETATM 2330 O HOH 14 -9.667 5.952 50.134 1.00 27.77 O HETATM 2331 O HOH 15 -2.976 23.316 38.763 1.00 35.19 O HETATM 2332 O HOH 16 1.565 16.294 45.667 1.00 38.86 O HETATM 2333 O HOH 17 20.547 -3.357 34.838 1.00 37.07 O HETATM 2334 O HOH 18 -13.716 17.955 44.570 1.00 36.07 O HETATM 2335 O HOH 19 8.427 10.366 37.184 1.00 27.97 O HETATM 2336 O HOH 20 -7.743 21.230 34.626 1.00 26.36 O HETATM 2337 O HOH 21 -2.180 22.971 51.584 1.00 34.13 O HETATM 2338 O HOH 22 12.179 -20.054 48.876 1.00 32.03 O HETATM 2339 O HOH 23 -13.776 22.119 35.377 1.00 30.50 O HETATM 2340 O HOH 24 10.549 -1.931 37.588 1.00 29.43 O HETATM 2341 O HOH 25 -10.741 5.411 21.696 1.00 26.20 O HETATM 2342 O HOH 26 8.414 -0.600 42.379 1.00 23.85 O HETATM 2343 O HOH 27 -11.199 4.862 10.885 1.00 35.88 O HETATM 2344 O HOH 28 -17.366 7.560 40.083 1.00 22.32 O HETATM 2345 O HOH 29 3.305 -4.728 48.672 1.00 42.09 O HETATM 2346 O HOH 30 2.743 10.623 44.289 1.00 31.22 O HETATM 2347 O HOH 31 -19.788 9.417 25.546 1.00 35.41 O HETATM 2348 O HOH 32 -8.800 -5.903 37.419 1.00 24.93 O HETATM 2349 O HOH 33 -16.772 -1.732 49.056 1.00 32.66 O HETATM 2350 O HOH 34 4.644 13.774 27.378 1.00 33.83 O HETATM 2351 O HOH 35 -16.807 5.553 48.087 1.00 38.25 O HETATM 2352 O HOH 36 7.497 -28.729 22.883 1.00 35.55 O HETATM 2353 O HOH 37 8.831 12.916 31.164 1.00 30.27 O HETATM 2354 O HOH 38 -18.181 6.658 35.156 1.00 20.05 O HETATM 2355 O HOH 39 -6.823 -11.533 35.267 1.00 39.03 O HETATM 2356 O HOH 40 19.864 -17.108 44.634 1.00 44.32 O HETATM 2357 O HOH 41 6.589 17.323 36.521 1.00 28.46 O HETATM 2358 O HOH 42 -19.777 14.401 31.318 1.00 24.53 O HETATM 2359 O HOH 43 1.140 14.766 24.858 1.00 23.99 O HETATM 2360 O HOH 44 2.754 -9.838 34.769 1.00 26.48 O HETATM 2361 O HOH 45 -1.495 19.875 32.531 1.00 28.95 O HETATM 2362 O HOH 46 -3.549 22.855 44.718 1.00 17.78 O HETATM 2363 O HOH 47 -12.988 10.222 26.015 1.00 18.65 O HETATM 2364 O HOH 48 7.254 -26.142 45.535 1.00 22.86 O HETATM 2365 O HOH 49 12.738 -3.737 38.108 1.00 28.98 O HETATM 2366 O HOH 50 -11.689 16.416 24.627 1.00 30.73 O HETATM 2367 O HOH 51 -11.303 15.156 49.017 1.00 27.15 O HETATM 2368 O HOH 52 -11.432 12.289 49.242 1.00 23.94 O HETATM 2369 O HOH 53 -15.097 19.478 33.916 1.00 30.00 O HETATM 2370 O HOH 54 4.669 -14.151 29.866 1.00 33.74 O HETATM 2371 O HOH 55 14.221 -22.012 48.777 1.00 32.29 O HETATM 2372 O HOH 56 2.420 -11.552 30.226 1.00 30.53 O HETATM 2373 O HOH 57 3.644 -16.076 47.327 1.00 29.76 O HETATM 2374 O HOH 58 -19.153 13.833 25.314 1.00 38.05 O HETATM 2375 O HOH 59 4.892 -22.098 30.761 1.00 37.77 O HETATM 2376 O HOH 60 -3.382 5.684 22.111 1.00 38.14 O HETATM 2377 O HOH 61 -10.399 6.068 24.084 1.00 23.85 O HETATM 2378 O HOH 62 1.725 -6.923 34.106 1.00 25.28 O HETATM 2379 O HOH 63 -5.062 -16.579 33.671 1.00 29.67 O HETATM 2380 O HOH 64 -7.567 21.209 55.730 1.00 46.08 O HETATM 2381 O HOH 65 9.135 -25.365 43.752 1.00 22.70 O HETATM 2382 O HOH 66 8.724 10.032 39.554 1.00 33.19 O HETATM 2383 O HOH 67 -16.565 6.230 50.709 1.00 41.45 O HETATM 2384 O HOH 68 10.587 -0.580 39.482 1.00 24.56 O HETATM 2385 O HOH 69 -20.423 12.827 43.469 1.00 38.13 O HETATM 2386 O HOH 70 -14.747 10.856 48.461 1.00 28.75 O HETATM 2387 O HOH 71 1.060 22.007 34.379 1.00 34.57 O HETATM 2388 O HOH 72 10.481 -20.792 50.873 1.00 39.47 O HETATM 2389 O HOH 73 -6.909 -9.604 41.183 1.00 28.14 O HETATM 2390 O HOH 74 -11.158 8.454 25.175 1.00 22.53 O HETATM 2391 O HOH 75 3.368 13.672 25.000 1.00 32.23 O HETATM 2392 O HOH 76 -8.960 23.660 34.760 1.00 36.68 O HETATM 2393 O HOH 77 -18.976 6.704 37.520 1.00 31.75 O HETATM 2394 O HOH 78 -1.066 23.319 45.239 1.00 34.83 O HETATM 2395 O HOH 79 -19.178 6.460 41.806 1.00 37.68 O HETATM 2396 O HOH 80 -13.842 15.319 50.043 1.00 35.81 O HETATM 2397 O HOH 81 7.754 14.983 35.844 1.00 34.71 O HETATM 2398 O HOH 82 -10.792 -5.387 35.673 1.00 34.32 O HETATM 2399 O HOH 83 7.619 12.814 38.173 1.00 33.41 O HETATM 2400 C10 UNN A 84 -2.061 -10.359 40.570 1.00 -0.05 C HETATM 2401 C09 UNN A 84 -1.338 -10.467 41.776 1.00 0.06 C HETATM 2402 N08 UNN A 84 -0.083 -9.881 41.951 1.00 -0.24 N HETATM 2403 C02 UNN A 84 0.939 -9.668 41.012 1.00 0.23 C HETATM 2404 N01 UNN A 84 2.030 -9.034 41.465 1.00 -0.23 N HETATM 2405 C06 UNN A 84 2.991 -8.802 40.558 1.00 0.04 C HETATM 2406 C05 UNN A 84 2.920 -9.193 39.233 1.00 0.10 C HETATM 2407 C04 UNN A 84 1.772 -9.843 38.830 1.00 0.15 C HETATM 2408 N03 UNN A 84 0.798 -10.080 39.725 1.00 -0.21 N HETATM 2409 N18 UNN A 84 1.516 -10.293 37.549 1.00 -0.28 N HETATM 2410 C19 UNN A 84 0.406 -11.143 37.209 1.00 0.07 C HETATM 2411 C20 UNN A 84 -0.697 -10.329 36.575 1.00 0.03 C HETATM 2412 C21 UNN A 84 -1.821 -10.908 35.989 1.00 0.14 C HETATM 2413 N22 UNN A 84 -2.842 -10.220 35.405 1.00 -0.30 N HETATM 2414 C23 UNN A 84 -2.736 -8.869 35.400 1.00 -0.02 C HETATM 2415 C24 UNN A 84 -1.660 -8.194 35.953 1.00 -0.06 C HETATM 2416 C25 UNN A 84 -0.624 -8.933 36.538 1.00 -0.05 C HETATM 2417 H13 UNN A 84 0.234 -8.423 36.962 1.00 0.06 H HETATM 2418 H3 UNN A 84 -1.621 -7.111 35.933 1.00 0.05 H HETATM 2419 H12 UNN A 84 -3.530 -8.290 34.942 1.00 0.07 H HETATM 2420 N26 UNN A 84 -1.967 -12.341 35.995 1.00 -0.16 N HETATM 2421 C27 UNN A 84 -2.568 -13.087 37.155 1.00 0.06 C HETATM 2422 C29 UNN A 84 -4.044 -12.731 37.348 1.00 -0.03 C HETATM 2423 C32 UNN A 84 -4.620 -13.413 38.590 1.00 -0.03 C HETATM 2424 C33 UNN A 84 -5.801 -12.620 39.151 1.00 0.05 C HETATM 2425 C30 UNN A 84 -5.967 -12.865 40.643 1.00 0.25 C HETATM 2426 N15 UNN A 84 -5.040 -12.413 41.584 1.00 -0.18 N HETATM 2427 C12 UNN A 84 -3.829 -11.687 41.476 1.00 0.09 C HETATM 2428 C13 UNN A 84 -3.117 -11.795 42.672 1.00 -0.04 C HETATM 2429 C17 UNN A 84 -3.864 -12.610 43.680 1.00 -0.07 C HETATM 2430 C16 UNN A 84 -5.246 -12.699 43.018 1.00 0.05 C HETATM 2431 H8 UNN A 84 -6.191 -12.928 43.509 1.00 0.09 H HETATM 2432 H2 UNN A 84 -3.521 -13.027 44.626 1.00 0.02 H HETATM 2433 C14 UNN A 84 -1.880 -11.195 42.837 1.00 -0.05 C HETATM 2434 H7 UNN A 84 -1.342 -11.289 43.773 1.00 0.04 H HETATM 2435 C11 UNN A 84 -3.302 -10.967 40.424 1.00 -0.04 C HETATM 2436 H6 UNN A 84 -3.850 -10.876 39.493 1.00 0.05 H HETATM 2437 O31 UNN A 84 -6.972 -13.505 40.969 1.00 -0.36 O HETATM 2438 H20 UNN A 84 -5.627 -11.547 38.980 1.00 0.05 H HETATM 2439 H21 UNN A 84 -6.720 -12.929 38.632 1.00 0.05 H HETATM 2440 H18 UNN A 84 -3.836 -13.483 39.358 1.00 0.03 H HETATM 2441 H19 UNN A 84 -4.961 -14.424 38.320 1.00 0.03 H HETATM 2442 H16 UNN A 84 -4.611 -13.058 36.464 1.00 0.03 H HETATM 2443 H17 UNN A 84 -4.138 -11.641 37.461 1.00 0.03 H HETATM 2444 H14 UNN A 84 -2.016 -12.829 38.071 1.00 0.06 H HETATM 2445 H15 UNN A 84 -2.483 -14.168 36.968 1.00 0.06 H HETATM 2446 S28 UNN A 84 -1.469 -13.193 34.567 1.00 0.06 S HETATM 2447 O34 UNN A 84 -0.552 -12.369 33.794 1.00 -0.15 O HETATM 2448 O35 UNN A 84 -1.143 -14.564 34.890 1.00 -0.15 O HETATM 2449 C36 UNN A 84 -3.053 -13.214 33.759 1.00 0.08 C HETATM 2450 H22 UNN A 84 -2.964 -13.730 32.791 1.00 0.05 H HETATM 2451 H23 UNN A 84 -3.394 -12.181 33.594 1.00 0.05 H HETATM 2452 H24 UNN A 84 -3.780 -13.744 34.392 1.00 0.05 H HETATM 2453 H10 UNN A 84 0.742 -11.914 36.500 1.00 0.07 H HETATM 2454 H11 UNN A 84 0.024 -11.625 38.121 1.00 0.07 H HETATM 2455 H9 UNN A 84 2.156 -10.004 36.795 1.00 0.20 H HETATM 2456 C07 UNN A 84 4.034 -8.869 38.315 1.00 0.36 C HETATM 2457 F37 UNN A 84 5.049 -8.144 38.871 1.00 -0.24 F HETATM 2458 F38 UNN A 84 4.612 -9.943 37.739 1.00 -0.24 F HETATM 2459 F39 UNN A 84 3.535 -8.108 37.310 1.00 -0.24 F HETATM 2460 H4 UNN A 84 3.880 -8.274 40.884 1.00 0.11 H HETATM 2461 H5 UNN A 84 0.123 -9.558 42.907 1.00 0.23 H HETATM 2462 H1 UNN A 84 -1.643 -9.794 39.745 1.00 0.05 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 410 411 420 421 422 CONECT 420 410 CONECT 421 410 CONECT 422 410 CONECT 647 648 653 654 655 CONECT 654 647 CONECT 655 647 CONECT 1093 1094 1099 1100 1101 CONECT 1099 1093 CONECT 1100 1093 CONECT 1101 1093 CONECT 1332 1333 1340 1341 1342 CONECT 1340 1332 CONECT 1341 1332 CONECT 1342 1332 CONECT 2400 2401 2435 2462 CONECT 2401 2400 2402 2433 CONECT 2402 2401 2403 2461 CONECT 2403 2402 2404 2408 CONECT 2404 2403 2405 CONECT 2405 2404 2406 2460 CONECT 2406 2405 2407 2456 CONECT 2407 2406 2408 2409 CONECT 2408 2403 2407 CONECT 2409 2407 2410 2455 CONECT 2410 2409 2411 2453 2454 CONECT 2411 2410 2412 2416 CONECT 2412 2411 2413 2420 CONECT 2413 2412 2414 CONECT 2414 2413 2415 2419 CONECT 2415 2414 2416 2418 CONECT 2416 2411 2415 2417 CONECT 2417 2416 CONECT 2418 2415 CONECT 2419 2414 CONECT 2420 2412 2421 2446 CONECT 2421 2420 2422 2444 2445 CONECT 2422 2421 2423 2442 2443 CONECT 2423 2422 2424 2440 2441 CONECT 2424 2423 2425 2438 2439 CONECT 2425 2424 2426 2437 CONECT 2426 2425 2427 2430 CONECT 2427 2426 2428 2435 CONECT 2428 2427 2429 2433 CONECT 2429 2428 2430 2432 CONECT 2430 2426 2429 2431 CONECT 2431 2430 CONECT 2432 2429 CONECT 2433 2401 2428 2434 CONECT 2434 2433 CONECT 2435 2400 2427 2436 CONECT 2436 2435 CONECT 2437 2425 CONECT 2438 2424 CONECT 2439 2424 CONECT 2440 2423 CONECT 2441 2423 CONECT 2442 2422 CONECT 2443 2422 CONECT 2444 2421 CONECT 2445 2421 CONECT 2446 2420 2447 2448 2449 CONECT 2447 2446 CONECT 2448 2446 CONECT 2449 2446 2450 2451 2452 CONECT 2450 2449 CONECT 2451 2449 CONECT 2452 2449 CONECT 2453 2410 CONECT 2454 2410 CONECT 2455 2409 CONECT 2456 2406 2457 2458 2459 CONECT 2457 2456 CONECT 2458 2456 CONECT 2459 2456 CONECT 2460 2405 CONECT 2461 2402 CONECT 2462 2400 MASTER 0 0 0 0 0 0 0 0 2457 5 82 22 END
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Structure:
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Related entries of code: 5to8
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
3et7
RCSB PDB
PDBbind
277aa, >3ET7_1|Chain... at 100%
3fzr
RCSB PDB
PDBbind
277aa, >3FZR_1|Chain... at 100%
3fzs
RCSB PDB
PDBbind
277aa, >3FZS_1|Chain... at 100%
3fzt
RCSB PDB
PDBbind
277aa, >3FZT_1|Chain... at 100%
3h3c
RCSB PDB
PDBbind
277aa, >3H3C_1|Chain... at 100%
4h1j
RCSB PDB
PDBbind
293aa, >4H1J_1|Chain... *
4h1m
RCSB PDB
PDBbind
293aa, >4H1M_1|Chain... at 100%
5tob
RCSB PDB
PDBbind
282aa, >5TOB_1|Chain... at 98%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
5to8
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Protein-tyrosine kinase 2-beta, Pyk2
Ligand Name
7FM
EC.Number
E.C.2.7.10.2
Resolution
1.98(Å)
Affinity (Kd/Ki/IC50)
IC50=3.1nM
Release Year
2016
Protein/NA Sequence
Check fasta file
Primary Reference
(2016) Bioorg. Med. Chem. Lett. Vol. 26: pp. 5926-5930
Ligand Properties
Formula
C
2
5
H
2
4
F
3
N
7
O
3
S
Molecular Weight
559.563
Exact Mass
559.161
No. of atoms
63
No. of bonds
67
Polar Surface Area
130.49
LOGP Value
3.57 (
Computed with XLOGP3
)
6.21 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 6
No. of Rotatable Bonds: 1
No. of Nitrogen and Oxygen Atoms: 10
No. of Rings: 5
Canonical SMILES
O=C1CCCCN(c2ncccc2CNc2nc(Nc3ccc4n1ccc4c3)ncc2C(F)(F)F)S(=O)(=O)C
InChI String
InChI=1S/C25H24F3N7O3S/c1-39(37,38)35-11-3-2-6-21(36)34-12-9-16-13-18(7-8-20(16)34)32-24-31-15-19(25(26,27)28)22(33-24)30-14-17-5-4-10-29-23(17)35/h4-5,7-10,12-13,15H,2-3,6,11,14H2,1H3,(H2,30,31,32,33)
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):
Q14289
Entrez Gene ID
NCBI Entrez Gene ID:
2185
ASD
Information of known allosteric effects of PDB entries
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times since Nov 2007.
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