Browse entries in the PDBbind-CN Database
HEADER 3QUP_COMPLEX COMPND 3QUP_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 6 GLU ASP VAL LEU ILE PRO SEQRES 1 A 20 PHE THR LEU GLY ARG MET LEU GLY LYS GLY GLU PHE GLY SEQRES 2 A 20 SER VAL ARG GLU ALA GLN LEU SEQRES 1 A 8 VAL LYS VAL ALA VAL LYS MET LEU SEQRES 1 A 32 SER SER ASP ILE GLU GLU PHE LEU ARG GLU ALA ALA CYS SEQRES 2 A 32 MET LYS GLU PHE ASP HIS PRO HIS VAL ALA LYS LEU VAL SEQRES 3 A 32 GLY VAL SER LEU ARG SER SEQRES 1 A 23 ILE PRO MET VAL ILE LEU PRO PHE MET LYS HIS GLY ASP SEQRES 2 A 23 LEU HIS ALA PHE LEU LEU ALA SER ARG ILE SEQRES 1 A 53 PRO PHE ASN LEU PRO LEU GLN THR LEU VAL ARG PHE MET SEQRES 2 A 53 VAL ASP ILE ALA CYS GLY MET GLU TYR LEU SER SER ARG SEQRES 3 A 53 ASN PHE ILE HIS ARG ASP LEU ALA ALA ARG ASN CYS MET SEQRES 4 A 53 LEU ALA GLU ASP MET THR VAL CYS VAL ALA ASP PHE GLY SEQRES 5 A 53 LEU SEQRES 1 A 99 LEU PRO VAL LYS TRP LEU ALA LEU GLU SER LEU ALA ASP SEQRES 2 A 99 ASN LEU TYR THR VAL HIS SER ASP VAL TRP ALA PHE GLY SEQRES 3 A 99 VAL THR MET TRP GLU ILE MET THR ARG GLY GLN THR PRO SEQRES 4 A 99 TYR ALA GLY ILE GLU ASN ALA GLU ILE TYR ASN TYR LEU SEQRES 5 A 99 ILE GLY GLY ASN ARG LEU LYS GLN PRO PRO GLU CYS MET SEQRES 6 A 99 GLU GLU VAL TYR ASP LEU MET TYR GLN CYS TRP SER ALA SEQRES 7 A 99 ASP PRO LYS GLN ARG PRO SER PHE THR CYS LEU ARG MET SEQRES 8 A 99 GLU LEU GLU ASN ILE LEU GLY HIS HET LUN A 318 60 ATOM 1 N GLU A 499 4.748 7.002 33.032 1.00 81.27 N ATOM 2 CA GLU A 499 3.844 6.697 31.879 1.00 81.01 C ATOM 3 C GLU A 499 3.542 5.203 31.741 1.00 81.04 C ATOM 4 O GLU A 499 4.425 4.363 31.922 1.00 81.04 O ATOM 5 CB GLU A 499 4.405 7.263 30.561 1.00 80.96 C ATOM 6 CG GLU A 499 5.819 7.873 30.624 1.00 80.62 C ATOM 7 CD GLU A 499 6.941 6.855 30.831 1.00 80.28 C ATOM 8 OE1 GLU A 499 6.691 5.758 31.374 1.00 80.17 O ATOM 9 OE2 GLU A 499 8.092 7.163 30.462 1.00 79.78 O ATOM 10 HA GLU A 499 2.898 7.194 32.094 1.00 0.00 H ATOM 11 HB2 GLU A 499 4.426 6.452 29.833 1.00 0.00 H ATOM 12 HB3 GLU A 499 3.723 8.041 30.217 1.00 0.00 H ATOM 13 HG2 GLU A 499 6.005 8.399 29.688 1.00 0.00 H ATOM 14 HG3 GLU A 499 5.847 8.583 31.450 1.00 0.00 H ATOM 15 HN3 GLU A 499 5.652 6.505 32.903 1.00 0.00 H ATOM 16 HN2 GLU A 499 4.300 6.685 33.915 1.00 0.00 H ATOM 17 HN1 GLU A 499 4.917 8.027 33.076 1.00 0.00 H ATOM 18 N ASP A 500 2.287 4.886 31.423 1.00 80.98 N ATOM 19 CA ASP A 500 1.858 3.511 31.144 1.00 80.82 C ATOM 20 C ASP A 500 2.459 3.027 29.813 1.00 80.68 C ATOM 21 O ASP A 500 1.755 2.816 28.819 1.00 80.75 O ATOM 22 CB ASP A 500 0.323 3.421 31.148 1.00 80.86 C ATOM 23 CG ASP A 500 -0.190 1.988 31.060 1.00 80.99 C ATOM 24 OD1 ASP A 500 -1.135 1.748 30.274 1.00 81.06 O ATOM 25 OD2 ASP A 500 0.343 1.104 31.767 1.00 80.50 O ATOM 26 HA ASP A 500 2.226 2.852 31.930 1.00 0.00 H ATOM 27 HB2 ASP A 500 -0.049 3.867 32.070 1.00 0.00 H ATOM 28 HB3 ASP A 500 -0.060 3.980 30.295 1.00 0.00 H ATOM 29 H ASP A 500 1.580 5.647 31.370 1.00 0.00 H ATOM 30 N VAL A 501 3.779 2.876 29.815 1.00 80.29 N ATOM 31 CA VAL A 501 4.550 2.459 28.649 1.00 79.96 C ATOM 32 C VAL A 501 5.563 1.413 29.106 1.00 79.74 C ATOM 33 O VAL A 501 5.824 0.433 28.406 1.00 79.79 O ATOM 34 CB VAL A 501 5.285 3.663 27.995 1.00 79.91 C ATOM 35 CG1 VAL A 501 6.243 3.203 26.902 1.00 79.82 C ATOM 36 CG2 VAL A 501 4.286 4.669 27.435 1.00 80.09 C ATOM 37 HA VAL A 501 3.877 2.044 27.898 1.00 0.00 H ATOM 38 HB VAL A 501 5.871 4.151 28.774 1.00 0.00 H ATOM 39 HG11 VAL A 501 6.988 2.534 27.332 1.00 0.00 H ATOM 40 HG12 VAL A 501 5.684 2.677 26.128 1.00 0.00 H ATOM 41 HG13 VAL A 501 6.739 4.070 26.467 1.00 0.00 H ATOM 42 HG21 VAL A 501 3.667 4.183 26.681 1.00 0.00 H ATOM 43 HG22 VAL A 501 3.654 5.039 28.242 1.00 0.00 H ATOM 44 HG23 VAL A 501 4.825 5.502 26.983 1.00 0.00 H ATOM 45 H VAL A 501 4.292 3.066 30.699 1.00 0.00 H ATOM 46 N LEU A 502 6.127 1.634 30.291 1.00 79.41 N ATOM 47 CA LEU A 502 7.053 0.692 30.905 1.00 79.20 C ATOM 48 C LEU A 502 6.328 -0.539 31.434 1.00 78.96 C ATOM 49 O LEU A 502 5.204 -0.445 31.939 1.00 78.81 O ATOM 50 CB LEU A 502 7.838 1.367 32.027 1.00 79.33 C ATOM 51 CG LEU A 502 9.112 2.101 31.609 1.00 79.24 C ATOM 52 CD1 LEU A 502 9.229 3.430 32.343 1.00 79.42 C ATOM 53 CD2 LEU A 502 10.342 1.223 31.846 1.00 79.33 C ATOM 54 HA LEU A 502 7.750 0.364 30.134 1.00 0.00 H ATOM 55 HB2 LEU A 502 7.179 2.090 32.507 1.00 0.00 H ATOM 56 HB3 LEU A 502 8.117 0.598 32.748 1.00 0.00 H ATOM 57 HG LEU A 502 9.056 2.314 30.541 1.00 0.00 H ATOM 58 HD21 LEU A 502 10.409 0.972 32.905 1.00 0.00 H ATOM 59 HD22 LEU A 502 10.252 0.308 31.260 1.00 0.00 H ATOM 60 HD23 LEU A 502 11.238 1.765 31.542 1.00 0.00 H ATOM 61 HD11 LEU A 502 8.367 4.053 32.104 1.00 0.00 H ATOM 62 HD12 LEU A 502 9.261 3.249 33.417 1.00 0.00 H ATOM 63 HD13 LEU A 502 10.142 3.937 32.031 1.00 0.00 H ATOM 64 H LEU A 502 5.898 2.513 30.798 1.00 0.00 H ATOM 65 N ILE A 503 6.979 -1.690 31.297 1.00 78.67 N ATOM 66 CA ILE A 503 6.400 -2.969 31.689 1.00 78.53 C ATOM 67 C ILE A 503 7.365 -3.684 32.631 1.00 78.54 C ATOM 68 O ILE A 503 8.534 -3.883 32.275 1.00 78.63 O ATOM 69 CB ILE A 503 6.060 -3.860 30.443 1.00 78.37 C ATOM 70 CG1 ILE A 503 4.891 -3.271 29.635 1.00 78.39 C ATOM 71 CG2 ILE A 503 5.773 -5.303 30.841 1.00 78.09 C ATOM 72 CD1 ILE A 503 3.596 -3.019 30.424 1.00 78.40 C ATOM 73 HA ILE A 503 5.458 -2.785 32.206 1.00 0.00 H ATOM 74 HB ILE A 503 6.943 -3.865 29.804 1.00 0.00 H ATOM 75 HG12 ILE A 503 5.219 -2.320 29.216 1.00 0.00 H ATOM 76 HG13 ILE A 503 4.661 -3.963 28.825 1.00 0.00 H ATOM 77 HD11 ILE A 503 3.237 -3.960 30.841 1.00 0.00 H ATOM 78 HD12 ILE A 503 3.795 -2.315 31.232 1.00 0.00 H ATOM 79 HD13 ILE A 503 2.841 -2.604 29.757 1.00 0.00 H ATOM 80 HG21 ILE A 503 6.649 -5.724 31.335 1.00 0.00 H ATOM 81 HG22 ILE A 503 4.923 -5.328 31.523 1.00 0.00 H ATOM 82 HG23 ILE A 503 5.542 -5.886 29.949 1.00 0.00 H ATOM 83 H ILE A 503 7.938 -1.677 30.895 1.00 0.00 H ATOM 84 N PRO A 504 6.885 -4.052 33.841 1.00 78.50 N ATOM 85 CA PRO A 504 7.659 -4.835 34.814 1.00 78.40 C ATOM 86 C PRO A 504 8.178 -6.155 34.238 1.00 78.16 C ATOM 87 O PRO A 504 9.382 -6.300 34.017 1.00 77.83 O ATOM 88 CB PRO A 504 6.642 -5.112 35.936 1.00 78.43 C ATOM 89 CG PRO A 504 5.289 -4.811 35.337 1.00 78.48 C ATOM 90 CD PRO A 504 5.548 -3.711 34.365 1.00 78.46 C ATOM 91 HA PRO A 504 8.551 -4.300 35.140 1.00 0.00 H ATOM 92 HD3 PRO A 504 4.803 -3.705 33.569 1.00 0.00 H ATOM 93 HD2 PRO A 504 5.555 -2.741 34.861 1.00 0.00 H ATOM 94 HG3 PRO A 504 4.589 -4.488 36.108 1.00 0.00 H ATOM 95 HG2 PRO A 504 4.888 -5.688 34.829 1.00 0.00 H ATOM 96 HB2 PRO A 504 6.696 -6.154 36.251 1.00 0.00 H ATOM 97 HB3 PRO A 504 6.833 -4.465 36.792 1.00 0.00 H TER 98 PRO A 504 ATOM 99 N PHE A 508 6.041 -10.720 32.321 1.00 69.52 N ATOM 100 CA PHE A 508 6.402 -11.598 31.210 1.00 69.63 C ATOM 101 C PHE A 508 7.691 -12.390 31.459 1.00 69.70 C ATOM 102 O PHE A 508 8.543 -11.969 32.246 1.00 69.85 O ATOM 103 CB PHE A 508 6.499 -10.800 29.892 1.00 69.59 C ATOM 104 CG PHE A 508 7.656 -9.833 29.841 1.00 69.37 C ATOM 105 CD1 PHE A 508 8.895 -10.232 29.342 1.00 68.68 C ATOM 106 CD2 PHE A 508 7.503 -8.520 30.288 1.00 69.27 C ATOM 107 CE1 PHE A 508 9.968 -9.345 29.297 1.00 69.03 C ATOM 108 CE2 PHE A 508 8.569 -7.622 30.248 1.00 69.35 C ATOM 109 CZ PHE A 508 9.806 -8.036 29.749 1.00 69.07 C ATOM 110 HA PHE A 508 5.601 -12.332 31.126 1.00 0.00 H ATOM 111 HB2 PHE A 508 6.608 -11.508 29.070 1.00 0.00 H ATOM 112 HB3 PHE A 508 5.575 -10.236 29.764 1.00 0.00 H ATOM 113 HD2 PHE A 508 6.538 -8.192 30.673 1.00 0.00 H ATOM 114 HE2 PHE A 508 8.437 -6.601 30.605 1.00 0.00 H ATOM 115 HZ PHE A 508 10.642 -7.338 29.713 1.00 0.00 H ATOM 116 HE1 PHE A 508 10.932 -9.674 28.909 1.00 0.00 H ATOM 117 HD1 PHE A 508 9.026 -11.252 28.982 1.00 0.00 H ATOM 118 HN3 PHE A 508 6.806 -10.034 32.481 1.00 0.00 H ATOM 119 HN2 PHE A 508 5.899 -11.290 33.179 1.00 0.00 H ATOM 120 HN1 PHE A 508 5.162 -10.214 32.090 1.00 0.00 H ATOM 121 N THR A 509 7.824 -13.533 30.782 1.00 69.88 N ATOM 122 CA THR A 509 9.048 -14.348 30.845 1.00 70.14 C ATOM 123 C THR A 509 9.534 -14.783 29.465 1.00 70.06 C ATOM 124 O THR A 509 8.740 -15.199 28.619 1.00 70.01 O ATOM 125 CB THR A 509 8.881 -15.611 31.731 1.00 70.37 C ATOM 126 OG1 THR A 509 7.664 -16.285 31.387 1.00 70.55 O ATOM 127 CG2 THR A 509 8.865 -15.242 33.224 1.00 70.44 C ATOM 128 HA THR A 509 9.793 -13.693 31.296 1.00 0.00 H ATOM 129 HB THR A 509 9.730 -16.270 31.551 1.00 0.00 H ATOM 130 HG1 THR A 509 7.695 -16.553 30.435 1.00 0.00 H ATOM 131 HG23 THR A 509 9.792 -14.730 33.480 1.00 0.00 H ATOM 132 HG21 THR A 509 8.018 -14.586 33.426 1.00 0.00 H ATOM 133 HG22 THR A 509 8.773 -16.150 33.820 1.00 0.00 H ATOM 134 H THR A 509 7.034 -13.859 30.189 1.00 0.00 H ATOM 135 N LEU A 510 10.848 -14.706 29.269 1.00 70.01 N ATOM 136 CA LEU A 510 11.487 -14.946 27.977 1.00 69.91 C ATOM 137 C LEU A 510 11.497 -16.414 27.559 1.00 70.04 C ATOM 138 O LEU A 510 11.664 -17.307 28.394 1.00 70.10 O ATOM 139 CB LEU A 510 12.914 -14.398 27.985 1.00 69.88 C ATOM 140 CG LEU A 510 13.115 -12.918 28.332 1.00 69.96 C ATOM 141 CD1 LEU A 510 14.588 -12.581 28.403 1.00 69.33 C ATOM 142 CD2 LEU A 510 12.408 -12.000 27.334 1.00 70.84 C ATOM 143 HA LEU A 510 10.883 -14.419 27.238 1.00 0.00 H ATOM 144 HB2 LEU A 510 13.481 -14.981 28.710 1.00 0.00 H ATOM 145 HB3 LEU A 510 13.328 -14.557 26.989 1.00 0.00 H ATOM 146 HG LEU A 510 12.667 -12.751 29.312 1.00 0.00 H ATOM 147 HD21 LEU A 510 12.807 -12.175 26.335 1.00 0.00 H ATOM 148 HD22 LEU A 510 11.339 -12.212 27.342 1.00 0.00 H ATOM 149 HD23 LEU A 510 12.576 -10.961 27.616 1.00 0.00 H ATOM 150 HD11 LEU A 510 15.062 -13.191 29.171 1.00 0.00 H ATOM 151 HD12 LEU A 510 15.053 -12.784 27.438 1.00 0.00 H ATOM 152 HD13 LEU A 510 14.707 -11.526 28.650 1.00 0.00 H ATOM 153 H LEU A 510 11.453 -14.462 30.079 1.00 0.00 H ATOM 154 N GLY A 511 11.334 -16.640 26.254 1.00 69.86 N ATOM 155 CA GLY A 511 11.204 -17.982 25.676 1.00 69.58 C ATOM 156 C GLY A 511 12.218 -18.270 24.585 1.00 69.38 C ATOM 157 O GLY A 511 13.384 -17.893 24.714 1.00 69.18 O ATOM 158 HA3 GLY A 511 10.204 -18.081 25.253 1.00 0.00 H ATOM 159 HA2 GLY A 511 11.335 -18.715 26.472 1.00 0.00 H ATOM 160 H GLY A 511 11.297 -15.822 25.613 1.00 0.00 H ATOM 161 N ARG A 512 11.775 -18.935 23.514 1.00 69.38 N ATOM 162 CA ARG A 512 12.663 -19.347 22.414 1.00 69.57 C ATOM 163 C ARG A 512 13.299 -18.148 21.695 1.00 69.59 C ATOM 164 O ARG A 512 12.715 -17.069 21.645 1.00 69.38 O ATOM 165 CB ARG A 512 11.923 -20.259 21.411 1.00 69.72 C ATOM 166 CG ARG A 512 11.230 -19.537 20.228 1.00 70.34 C ATOM 167 CD ARG A 512 10.572 -20.511 19.249 1.00 70.79 C ATOM 168 NE ARG A 512 10.629 -20.046 17.856 1.00 71.10 N ATOM 169 CZ ARG A 512 9.579 -19.674 17.121 1.00 71.26 C ATOM 170 NH1 ARG A 512 9.759 -19.279 15.862 1.00 70.36 N ATOM 171 NH2 ARG A 512 8.349 -19.691 17.629 1.00 71.02 N ATOM 172 HA ARG A 512 13.475 -19.918 22.864 1.00 0.00 H ATOM 173 HB2 ARG A 512 12.648 -20.959 20.997 1.00 0.00 H ATOM 174 HB3 ARG A 512 11.160 -20.810 21.960 1.00 0.00 H ATOM 175 HG2 ARG A 512 10.465 -18.870 20.625 1.00 0.00 H ATOM 176 HG3 ARG A 512 11.976 -18.952 19.690 1.00 0.00 H ATOM 177 HD2 ARG A 512 9.527 -20.636 19.532 1.00 0.00 H ATOM 178 HD3 ARG A 512 11.083 -21.471 19.317 1.00 0.00 H ATOM 179 HE ARG A 512 11.565 -20.003 17.406 1.00 0.00 H ATOM 180 HH12 ARG A 512 8.943 -18.988 15.286 1.00 0.00 H ATOM 181 HH11 ARG A 512 10.716 -19.261 15.454 1.00 0.00 H ATOM 182 HH22 ARG A 512 7.541 -19.398 17.044 1.00 0.00 H ATOM 183 HH21 ARG A 512 8.196 -19.997 18.611 1.00 0.00 H ATOM 184 H ARG A 512 10.764 -19.171 23.455 1.00 0.00 H ATOM 185 N MET A 513 14.500 -18.349 21.156 1.00 69.58 N ATOM 186 CA MET A 513 15.168 -17.346 20.327 1.00 69.61 C ATOM 187 C MET A 513 14.537 -17.289 18.945 1.00 69.10 C ATOM 188 O MET A 513 14.463 -18.305 18.249 1.00 69.11 O ATOM 189 CB MET A 513 16.658 -17.664 20.197 1.00 70.05 C ATOM 190 CG MET A 513 17.543 -16.887 21.147 1.00 71.63 C ATOM 191 SD MET A 513 18.117 -15.346 20.413 1.00 74.98 S ATOM 192 CE MET A 513 19.240 -14.780 21.694 1.00 74.14 C ATOM 193 HA MET A 513 15.052 -16.376 20.811 1.00 0.00 H ATOM 194 HB2 MET A 513 16.799 -18.727 20.390 1.00 0.00 H ATOM 195 HB3 MET A 513 16.969 -17.437 19.177 1.00 0.00 H ATOM 196 HG2 MET A 513 18.407 -17.499 21.405 1.00 0.00 H ATOM 197 HG3 MET A 513 16.977 -16.659 22.051 1.00 0.00 H ATOM 198 HE1 MET A 513 18.689 -14.647 22.625 1.00 0.00 H ATOM 199 HE2 MET A 513 20.027 -15.520 21.838 1.00 0.00 H ATOM 200 HE3 MET A 513 19.683 -13.830 21.394 1.00 0.00 H ATOM 201 H MET A 513 14.982 -19.254 21.331 1.00 0.00 H ATOM 202 N LEU A 514 14.082 -16.098 18.559 1.00 68.42 N ATOM 203 CA LEU A 514 13.430 -15.890 17.267 1.00 67.80 C ATOM 204 C LEU A 514 14.430 -15.490 16.180 1.00 67.56 C ATOM 205 O LEU A 514 14.321 -15.924 15.040 1.00 67.53 O ATOM 206 CB LEU A 514 12.310 -14.847 17.386 1.00 67.54 C ATOM 207 CG LEU A 514 11.033 -15.200 18.161 1.00 67.23 C ATOM 208 CD1 LEU A 514 10.168 -13.967 18.380 1.00 66.42 C ATOM 209 CD2 LEU A 514 10.226 -16.282 17.468 1.00 66.23 C ATOM 210 HA LEU A 514 12.989 -16.841 16.968 1.00 0.00 H ATOM 211 HB2 LEU A 514 12.742 -13.970 17.868 1.00 0.00 H ATOM 212 HB3 LEU A 514 12.006 -14.590 16.371 1.00 0.00 H ATOM 213 HG LEU A 514 11.351 -15.587 19.129 1.00 0.00 H ATOM 214 HD21 LEU A 514 9.937 -15.938 16.475 1.00 0.00 H ATOM 215 HD22 LEU A 514 10.831 -17.184 17.380 1.00 0.00 H ATOM 216 HD23 LEU A 514 9.332 -16.498 18.053 1.00 0.00 H ATOM 217 HD11 LEU A 514 10.730 -13.227 18.950 1.00 0.00 H ATOM 218 HD12 LEU A 514 9.886 -13.546 17.415 1.00 0.00 H ATOM 219 HD13 LEU A 514 9.271 -14.248 18.931 1.00 0.00 H ATOM 220 H LEU A 514 14.195 -15.287 19.200 1.00 0.00 H ATOM 221 N GLY A 515 15.403 -14.662 16.541 1.00 67.34 N ATOM 222 CA GLY A 515 16.444 -14.244 15.604 1.00 67.39 C ATOM 223 C GLY A 515 17.459 -13.336 16.263 1.00 67.42 C ATOM 224 O GLY A 515 17.294 -12.949 17.419 1.00 67.40 O ATOM 225 HA3 GLY A 515 15.979 -13.711 14.774 1.00 0.00 H ATOM 226 HA2 GLY A 515 16.955 -15.129 15.225 1.00 0.00 H ATOM 227 H GLY A 515 15.425 -14.301 17.516 1.00 0.00 H ATOM 228 N LYS A 516 18.521 -13.005 15.533 1.00 67.79 N ATOM 229 CA LYS A 516 19.520 -12.053 16.025 1.00 68.03 C ATOM 230 C LYS A 516 20.249 -11.305 14.908 1.00 68.20 C ATOM 231 O LYS A 516 20.206 -11.707 13.741 1.00 68.06 O ATOM 232 CB LYS A 516 20.521 -12.728 16.982 1.00 68.24 C ATOM 233 CG LYS A 516 21.462 -13.754 16.364 1.00 68.57 C ATOM 234 CD LYS A 516 22.387 -14.327 17.443 1.00 69.30 C ATOM 235 CE LYS A 516 23.146 -15.554 16.959 1.00 69.55 C ATOM 236 NZ LYS A 516 23.741 -16.320 18.103 1.00 69.78 N ATOM 237 HA LYS A 516 18.962 -11.301 16.584 1.00 0.00 H ATOM 238 HB2 LYS A 516 21.132 -11.944 17.430 1.00 0.00 H ATOM 239 HB3 LYS A 516 19.948 -13.230 17.761 1.00 0.00 H ATOM 240 HG2 LYS A 516 20.878 -14.561 15.922 1.00 0.00 H ATOM 241 HG3 LYS A 516 22.062 -13.275 15.590 1.00 0.00 H ATOM 242 HD2 LYS A 516 23.106 -13.561 17.732 1.00 0.00 H ATOM 243 HD3 LYS A 516 21.786 -14.605 18.309 1.00 0.00 H ATOM 244 HE2 LYS A 516 23.947 -15.235 16.292 1.00 0.00 H ATOM 245 HE3 LYS A 516 22.460 -16.204 16.416 1.00 0.00 H ATOM 246 HZ1 LYS A 516 24.402 -15.707 18.622 1.00 0.00 H ATOM 247 HZ2 LYS A 516 22.982 -16.633 18.741 1.00 0.00 H ATOM 248 HZ3 LYS A 516 24.250 -17.149 17.736 1.00 0.00 H ATOM 249 H LYS A 516 18.645 -13.431 14.593 1.00 0.00 H ATOM 250 N GLY A 517 20.903 -10.208 15.284 1.00 68.32 N ATOM 251 CA GLY A 517 21.704 -9.412 14.361 1.00 68.72 C ATOM 252 C GLY A 517 22.502 -8.352 15.089 1.00 68.92 C ATOM 253 O GLY A 517 22.576 -8.355 16.318 1.00 68.91 O ATOM 254 HA3 GLY A 517 21.041 -8.927 13.645 1.00 0.00 H ATOM 255 HA2 GLY A 517 22.391 -10.070 13.830 1.00 0.00 H ATOM 256 H GLY A 517 20.840 -9.906 16.277 1.00 0.00 H ATOM 257 N GLU A 518 23.105 -7.448 14.324 1.00 69.25 N ATOM 258 CA GLU A 518 23.844 -6.306 14.874 1.00 69.63 C ATOM 259 C GLU A 518 23.042 -5.544 15.948 1.00 69.61 C ATOM 260 O GLU A 518 23.562 -5.267 17.040 1.00 69.66 O ATOM 261 CB GLU A 518 24.288 -5.361 13.744 1.00 69.90 C ATOM 262 CG GLU A 518 23.533 -5.573 12.427 1.00 71.15 C ATOM 263 CD GLU A 518 23.358 -4.304 11.609 1.00 73.16 C ATOM 264 OE1 GLU A 518 22.206 -4.047 11.184 1.00 72.93 O ATOM 265 OE2 GLU A 518 24.355 -3.569 11.386 1.00 74.11 O ATOM 266 HA GLU A 518 24.729 -6.703 15.371 1.00 0.00 H ATOM 267 HB2 GLU A 518 24.127 -4.334 14.071 1.00 0.00 H ATOM 268 HB3 GLU A 518 25.351 -5.520 13.561 1.00 0.00 H ATOM 269 HG2 GLU A 518 24.085 -6.296 11.826 1.00 0.00 H ATOM 270 HG3 GLU A 518 22.545 -5.973 12.657 1.00 0.00 H ATOM 271 H GLU A 518 23.051 -7.555 13.291 1.00 0.00 H ATOM 272 N PHE A 519 21.778 -5.238 15.635 1.00 69.26 N ATOM 273 CA PHE A 519 20.833 -4.581 16.555 1.00 68.98 C ATOM 274 C PHE A 519 20.656 -5.322 17.886 1.00 68.67 C ATOM 275 O PHE A 519 20.161 -4.751 18.862 1.00 68.87 O ATOM 276 CB PHE A 519 19.459 -4.439 15.879 1.00 69.08 C ATOM 277 CG PHE A 519 18.767 -5.755 15.637 1.00 69.03 C ATOM 278 CD1 PHE A 519 17.789 -6.212 16.519 1.00 69.16 C ATOM 279 CD2 PHE A 519 19.107 -6.548 14.538 1.00 68.76 C ATOM 280 CE1 PHE A 519 17.152 -7.437 16.305 1.00 68.76 C ATOM 281 CE2 PHE A 519 18.480 -7.773 14.317 1.00 68.21 C ATOM 282 CZ PHE A 519 17.500 -8.219 15.200 1.00 68.64 C ATOM 283 HA PHE A 519 21.262 -3.605 16.784 1.00 0.00 H ATOM 284 HB2 PHE A 519 18.822 -3.827 16.517 1.00 0.00 H ATOM 285 HB3 PHE A 519 19.597 -3.940 14.920 1.00 0.00 H ATOM 286 HD2 PHE A 519 19.873 -6.204 13.844 1.00 0.00 H ATOM 287 HE2 PHE A 519 18.756 -8.380 13.455 1.00 0.00 H ATOM 288 HZ PHE A 519 17.006 -9.175 15.030 1.00 0.00 H ATOM 289 HE1 PHE A 519 16.385 -7.782 16.998 1.00 0.00 H ATOM 290 HD1 PHE A 519 17.518 -5.607 17.385 1.00 0.00 H ATOM 291 H PHE A 519 21.441 -5.479 14.681 1.00 0.00 H ATOM 292 N GLY A 520 21.048 -6.593 17.911 1.00 68.21 N ATOM 293 CA GLY A 520 20.857 -7.448 19.078 1.00 67.50 C ATOM 294 C GLY A 520 20.082 -8.687 18.682 1.00 67.00 C ATOM 295 O GLY A 520 20.227 -9.192 17.566 1.00 67.23 O ATOM 296 HA3 GLY A 520 20.302 -6.902 19.841 1.00 0.00 H ATOM 297 HA2 GLY A 520 21.829 -7.740 19.476 1.00 0.00 H ATOM 298 H GLY A 520 21.508 -6.992 17.068 1.00 0.00 H ATOM 299 N SER A 521 19.242 -9.170 19.589 1.00 66.22 N ATOM 300 CA SER A 521 18.522 -10.411 19.364 1.00 65.48 C ATOM 301 C SER A 521 17.050 -10.267 19.723 1.00 64.69 C ATOM 302 O SER A 521 16.665 -9.344 20.437 1.00 64.87 O ATOM 303 CB SER A 521 19.164 -11.543 20.173 1.00 65.52 C ATOM 304 OG SER A 521 19.016 -11.317 21.562 1.00 66.18 O ATOM 305 HA SER A 521 18.583 -10.654 18.303 1.00 0.00 H ATOM 306 HB2 SER A 521 20.225 -11.598 19.931 1.00 0.00 H ATOM 307 HB3 SER A 521 18.684 -12.486 19.911 1.00 0.00 H ATOM 308 HG SER A 521 19.438 -12.060 22.063 1.00 0.00 H ATOM 309 H SER A 521 19.097 -8.650 20.478 1.00 0.00 H ATOM 310 N VAL A 522 16.232 -11.181 19.213 1.00 63.83 N ATOM 311 CA VAL A 522 14.800 -11.174 19.479 1.00 63.06 C ATOM 312 C VAL A 522 14.390 -12.546 19.973 1.00 62.84 C ATOM 313 O VAL A 522 14.801 -13.567 19.418 1.00 62.40 O ATOM 314 CB VAL A 522 13.964 -10.835 18.208 1.00 63.00 C ATOM 315 CG1 VAL A 522 12.476 -10.700 18.551 1.00 62.34 C ATOM 316 CG2 VAL A 522 14.472 -9.561 17.545 1.00 62.73 C ATOM 317 HA VAL A 522 14.604 -10.404 20.225 1.00 0.00 H ATOM 318 HB VAL A 522 14.082 -11.659 17.504 1.00 0.00 H ATOM 319 HG11 VAL A 522 12.114 -11.640 18.969 1.00 0.00 H ATOM 320 HG12 VAL A 522 12.344 -9.902 19.281 1.00 0.00 H ATOM 321 HG13 VAL A 522 11.916 -10.463 17.646 1.00 0.00 H ATOM 322 HG21 VAL A 522 14.394 -8.731 18.247 1.00 0.00 H ATOM 323 HG22 VAL A 522 15.514 -9.695 17.254 1.00 0.00 H ATOM 324 HG23 VAL A 522 13.871 -9.348 16.661 1.00 0.00 H ATOM 325 H VAL A 522 16.627 -11.926 18.604 1.00 0.00 H ATOM 326 N ARG A 523 13.571 -12.568 21.012 1.00 62.67 N ATOM 327 CA ARG A 523 12.985 -13.823 21.453 1.00 63.08 C ATOM 328 C ARG A 523 11.501 -13.683 21.747 1.00 62.81 C ATOM 329 O ARG A 523 11.012 -12.581 22.015 1.00 62.54 O ATOM 330 CB ARG A 523 13.755 -14.421 22.643 1.00 63.31 C ATOM 331 CG ARG A 523 14.474 -13.427 23.531 1.00 64.27 C ATOM 332 CD ARG A 523 15.562 -14.107 24.364 1.00 66.13 C ATOM 333 NE ARG A 523 15.015 -15.066 25.327 1.00 66.95 N ATOM 334 CZ ARG A 523 15.737 -15.723 26.236 1.00 68.21 C ATOM 335 NH1 ARG A 523 17.049 -15.527 26.325 1.00 67.97 N ATOM 336 NH2 ARG A 523 15.143 -16.576 27.066 1.00 67.54 N ATOM 337 HA ARG A 523 13.076 -14.528 20.627 1.00 0.00 H ATOM 338 HB2 ARG A 523 13.043 -14.968 23.261 1.00 0.00 H ATOM 339 HB3 ARG A 523 14.497 -15.114 22.247 1.00 0.00 H ATOM 340 HG2 ARG A 523 14.932 -12.660 22.907 1.00 0.00 H ATOM 341 HG3 ARG A 523 13.751 -12.963 24.202 1.00 0.00 H ATOM 342 HD2 ARG A 523 16.115 -13.342 24.908 1.00 0.00 H ATOM 343 HD3 ARG A 523 16.239 -14.634 23.692 1.00 0.00 H ATOM 344 HE ARG A 523 13.991 -15.247 25.300 1.00 0.00 H ATOM 345 HH12 ARG A 523 17.605 -16.043 27.036 1.00 0.00 H ATOM 346 HH11 ARG A 523 17.519 -14.857 25.683 1.00 0.00 H ATOM 347 HH22 ARG A 523 15.705 -17.089 27.775 1.00 0.00 H ATOM 348 HH21 ARG A 523 14.116 -16.730 27.006 1.00 0.00 H ATOM 349 H ARG A 523 13.346 -11.685 21.514 1.00 0.00 H ATOM 350 N GLU A 524 10.775 -14.794 21.667 1.00 62.73 N ATOM 351 CA GLU A 524 9.366 -14.768 22.041 1.00 62.84 C ATOM 352 C GLU A 524 9.226 -14.743 23.559 1.00 62.58 C ATOM 353 O GLU A 524 10.161 -15.084 24.280 1.00 62.37 O ATOM 354 CB GLU A 524 8.571 -15.915 21.395 1.00 63.29 C ATOM 355 CG GLU A 524 8.942 -17.322 21.829 1.00 64.27 C ATOM 356 CD GLU A 524 7.950 -18.356 21.322 1.00 65.24 C ATOM 357 OE1 GLU A 524 7.922 -18.621 20.099 1.00 66.10 O ATOM 358 OE2 GLU A 524 7.196 -18.904 22.152 1.00 65.75 O ATOM 359 HA GLU A 524 8.927 -13.850 21.649 1.00 0.00 H ATOM 360 HB2 GLU A 524 7.518 -15.762 21.630 1.00 0.00 H ATOM 361 HB3 GLU A 524 8.714 -15.852 20.316 1.00 0.00 H ATOM 362 HG2 GLU A 524 9.931 -17.562 21.438 1.00 0.00 H ATOM 363 HG3 GLU A 524 8.964 -17.360 22.918 1.00 0.00 H ATOM 364 H GLU A 524 11.211 -15.679 21.339 1.00 0.00 H ATOM 365 N ALA A 525 8.066 -14.305 24.033 1.00 62.35 N ATOM 366 CA ALA A 525 7.787 -14.227 25.454 1.00 62.44 C ATOM 367 C ALA A 525 6.283 -14.291 25.670 1.00 62.65 C ATOM 368 O ALA A 525 5.506 -13.972 24.761 1.00 62.65 O ATOM 369 CB ALA A 525 8.351 -12.947 26.043 1.00 62.17 C ATOM 370 HA ALA A 525 8.264 -15.067 25.959 1.00 0.00 H ATOM 371 HB1 ALA A 525 9.431 -12.925 25.894 1.00 0.00 H ATOM 372 HB2 ALA A 525 7.897 -12.089 25.547 1.00 0.00 H ATOM 373 HB3 ALA A 525 8.129 -12.911 27.110 1.00 0.00 H ATOM 374 H ALA A 525 7.330 -14.007 23.361 1.00 0.00 H ATOM 375 N GLN A 526 5.884 -14.716 26.868 1.00 62.62 N ATOM 376 CA GLN A 526 4.477 -14.762 27.252 1.00 62.79 C ATOM 377 C GLN A 526 4.202 -13.622 28.221 1.00 62.86 C ATOM 378 O GLN A 526 4.845 -13.521 29.265 1.00 62.93 O ATOM 379 CB GLN A 526 4.110 -16.114 27.893 1.00 62.76 C ATOM 380 CG GLN A 526 4.257 -17.353 26.987 1.00 62.32 C ATOM 381 CD GLN A 526 3.245 -17.416 25.843 1.00 61.65 C ATOM 382 OE1 GLN A 526 3.585 -17.818 24.729 1.00 62.42 O ATOM 383 NE2 GLN A 526 2.002 -17.029 26.115 1.00 61.28 N ATOM 384 HA GLN A 526 3.861 -14.653 26.359 1.00 0.00 H ATOM 385 HB2 GLN A 526 4.753 -16.257 28.761 1.00 0.00 H ATOM 386 HB3 GLN A 526 3.071 -16.059 28.217 1.00 0.00 H ATOM 387 HG2 GLN A 526 5.259 -17.346 26.558 1.00 0.00 H ATOM 388 HG3 GLN A 526 4.133 -18.244 27.603 1.00 0.00 H ATOM 389 HE22 GLN A 526 1.758 -16.696 27.070 1.00 0.00 H ATOM 390 HE21 GLN A 526 1.274 -17.059 25.373 1.00 0.00 H ATOM 391 H GLN A 526 6.601 -15.026 27.554 1.00 0.00 H ATOM 392 N LEU A 527 3.251 -12.767 27.870 1.00 62.77 N ATOM 393 CA LEU A 527 2.921 -11.622 28.696 1.00 62.92 C ATOM 394 C LEU A 527 1.792 -11.973 29.664 1.00 62.87 C ATOM 395 O LEU A 527 0.616 -11.727 29.390 1.00 62.86 O ATOM 396 CB LEU A 527 2.548 -10.422 27.817 1.00 62.88 C ATOM 397 CG LEU A 527 3.279 -9.091 28.007 1.00 62.84 C ATOM 398 CD1 LEU A 527 2.576 -8.000 27.199 1.00 63.00 C ATOM 399 CD2 LEU A 527 3.397 -8.685 29.471 1.00 62.66 C ATOM 400 HA LEU A 527 3.795 -11.347 29.286 1.00 0.00 H ATOM 401 HB2 LEU A 527 2.706 -10.726 26.782 1.00 0.00 H ATOM 402 HB3 LEU A 527 1.488 -10.227 27.979 1.00 0.00 H ATOM 403 HG LEU A 527 4.298 -9.222 27.642 1.00 0.00 H ATOM 404 HD21 LEU A 527 2.400 -8.582 29.900 1.00 0.00 H ATOM 405 HD22 LEU A 527 3.951 -9.450 30.015 1.00 0.00 H ATOM 406 HD23 LEU A 527 3.924 -7.734 29.542 1.00 0.00 H ATOM 407 HD11 LEU A 527 2.583 -8.270 26.143 1.00 0.00 H ATOM 408 HD12 LEU A 527 1.547 -7.901 27.543 1.00 0.00 H ATOM 409 HD13 LEU A 527 3.099 -7.054 27.337 1.00 0.00 H ATOM 410 H LEU A 527 2.731 -12.921 26.983 1.00 0.00 H TER 411 LEU A 527 ATOM 412 N VAL A 535 -0.606 -13.700 26.474 1.00 57.61 N ATOM 413 CA VAL A 535 -0.393 -13.223 25.110 1.00 57.21 C ATOM 414 C VAL A 535 1.052 -13.466 24.693 1.00 56.89 C ATOM 415 O VAL A 535 1.985 -13.149 25.442 1.00 57.01 O ATOM 416 CB VAL A 535 -0.700 -11.705 24.965 1.00 57.56 C ATOM 417 CG1 VAL A 535 -0.949 -11.351 23.507 1.00 57.14 C ATOM 418 CG2 VAL A 535 -1.896 -11.291 25.824 1.00 58.15 C ATOM 419 HA VAL A 535 -1.078 -13.777 24.468 1.00 0.00 H ATOM 420 HB VAL A 535 0.172 -11.155 25.319 1.00 0.00 H ATOM 421 HG11 VAL A 535 -0.063 -11.592 22.919 1.00 0.00 H ATOM 422 HG12 VAL A 535 -1.800 -11.923 23.136 1.00 0.00 H ATOM 423 HG13 VAL A 535 -1.162 -10.285 23.424 1.00 0.00 H ATOM 424 HG21 VAL A 535 -2.777 -11.853 25.513 1.00 0.00 H ATOM 425 HG22 VAL A 535 -1.680 -11.502 26.871 1.00 0.00 H ATOM 426 HG23 VAL A 535 -2.081 -10.224 25.697 1.00 0.00 H ATOM 427 HN3 VAL A 535 0.028 -13.190 27.121 1.00 0.00 H ATOM 428 HN2 VAL A 535 -0.403 -14.719 26.519 1.00 0.00 H ATOM 429 HN1 VAL A 535 -1.594 -13.530 26.749 1.00 0.00 H ATOM 430 N LYS A 536 1.237 -14.035 23.504 1.00 56.06 N ATOM 431 CA LYS A 536 2.574 -14.231 22.944 1.00 55.04 C ATOM 432 C LYS A 536 3.075 -12.963 22.262 1.00 53.93 C ATOM 433 O LYS A 536 2.361 -12.358 21.466 1.00 54.02 O ATOM 434 CB LYS A 536 2.584 -15.380 21.946 1.00 55.38 C ATOM 435 CG LYS A 536 3.985 -15.860 21.606 1.00 56.20 C ATOM 436 CD LYS A 536 4.090 -16.318 20.174 1.00 56.82 C ATOM 437 CE LYS A 536 3.804 -17.791 20.011 1.00 57.48 C ATOM 438 NZ LYS A 536 4.340 -18.274 18.708 1.00 57.25 N ATOM 439 HA LYS A 536 3.240 -14.473 23.772 1.00 0.00 H ATOM 440 HB2 LYS A 536 2.024 -16.214 22.370 1.00 0.00 H ATOM 441 HB3 LYS A 536 2.098 -15.048 21.029 1.00 0.00 H ATOM 442 HG2 LYS A 536 4.687 -15.042 21.767 1.00 0.00 H ATOM 443 HG3 LYS A 536 4.242 -16.692 22.262 1.00 0.00 H ATOM 444 HD2 LYS A 536 3.375 -15.755 19.574 1.00 0.00 H ATOM 445 HD3 LYS A 536 5.100 -16.117 19.816 1.00 0.00 H ATOM 446 HE2 LYS A 536 2.727 -17.955 20.042 1.00 0.00 H ATOM 447 HE3 LYS A 536 4.278 -18.343 20.823 1.00 0.00 H ATOM 448 HZ1 LYS A 536 3.887 -17.749 17.932 1.00 0.00 H ATOM 449 HZ2 LYS A 536 5.368 -18.120 18.679 1.00 0.00 H ATOM 450 HZ3 LYS A 536 4.138 -19.289 18.606 1.00 0.00 H ATOM 451 H LYS A 536 0.409 -14.349 22.959 1.00 0.00 H ATOM 452 N VAL A 537 4.311 -12.571 22.570 1.00 52.73 N ATOM 453 CA VAL A 537 4.908 -11.354 22.006 1.00 50.91 C ATOM 454 C VAL A 537 6.314 -11.595 21.463 1.00 50.37 C ATOM 455 O VAL A 537 6.891 -12.660 21.655 1.00 49.96 O ATOM 456 CB VAL A 537 4.972 -10.189 23.038 1.00 51.01 C ATOM 457 CG1 VAL A 537 3.580 -9.782 23.510 1.00 49.92 C ATOM 458 CG2 VAL A 537 5.910 -10.525 24.204 1.00 50.66 C ATOM 459 HA VAL A 537 4.248 -11.070 21.186 1.00 0.00 H ATOM 460 HB VAL A 537 5.396 -9.321 22.533 1.00 0.00 H ATOM 461 HG11 VAL A 537 2.989 -9.454 22.655 1.00 0.00 H ATOM 462 HG12 VAL A 537 3.094 -10.636 23.983 1.00 0.00 H ATOM 463 HG13 VAL A 537 3.665 -8.967 24.229 1.00 0.00 H ATOM 464 HG21 VAL A 537 5.549 -11.419 24.713 1.00 0.00 H ATOM 465 HG22 VAL A 537 6.915 -10.704 23.821 1.00 0.00 H ATOM 466 HG23 VAL A 537 5.930 -9.690 24.904 1.00 0.00 H ATOM 467 H VAL A 537 4.871 -13.146 23.231 1.00 0.00 H ATOM 468 N ALA A 538 6.856 -10.592 20.777 1.00 49.60 N ATOM 469 CA ALA A 538 8.248 -10.597 20.384 1.00 49.06 C ATOM 470 C ALA A 538 8.973 -9.603 21.282 1.00 49.00 C ATOM 471 O ALA A 538 8.445 -8.531 21.589 1.00 49.27 O ATOM 472 CB ALA A 538 8.396 -10.215 18.921 1.00 48.74 C ATOM 473 HA ALA A 538 8.675 -11.594 20.496 1.00 0.00 H ATOM 474 HB1 ALA A 538 7.853 -10.930 18.303 1.00 0.00 H ATOM 475 HB2 ALA A 538 7.989 -9.216 18.765 1.00 0.00 H ATOM 476 HB3 ALA A 538 9.451 -10.226 18.649 1.00 0.00 H ATOM 477 H ALA A 538 6.261 -9.780 20.516 1.00 0.00 H ATOM 478 N VAL A 539 10.174 -9.967 21.718 1.00 48.86 N ATOM 479 CA VAL A 539 10.941 -9.110 22.617 1.00 49.15 C ATOM 480 C VAL A 539 12.311 -8.826 22.033 1.00 49.59 C ATOM 481 O VAL A 539 13.119 -9.726 21.831 1.00 48.92 O ATOM 482 CB VAL A 539 11.055 -9.686 24.055 1.00 48.72 C ATOM 483 CG1 VAL A 539 11.830 -8.719 24.949 1.00 48.79 C ATOM 484 CG2 VAL A 539 9.680 -9.922 24.642 1.00 48.34 C ATOM 485 HA VAL A 539 10.392 -8.173 22.709 1.00 0.00 H ATOM 486 HB VAL A 539 11.587 -10.636 24.002 1.00 0.00 H ATOM 487 HG11 VAL A 539 12.830 -8.572 24.542 1.00 0.00 H ATOM 488 HG12 VAL A 539 11.308 -7.763 24.987 1.00 0.00 H ATOM 489 HG13 VAL A 539 11.903 -9.134 25.954 1.00 0.00 H ATOM 490 HG21 VAL A 539 9.136 -8.978 24.680 1.00 0.00 H ATOM 491 HG22 VAL A 539 9.137 -10.631 24.018 1.00 0.00 H ATOM 492 HG23 VAL A 539 9.781 -10.326 25.650 1.00 0.00 H ATOM 493 H VAL A 539 10.574 -10.877 21.414 1.00 0.00 H ATOM 494 N LYS A 540 12.546 -7.551 21.758 1.00 50.80 N ATOM 495 CA LYS A 540 13.773 -7.106 21.127 1.00 52.61 C ATOM 496 C LYS A 540 14.842 -6.802 22.184 1.00 53.92 C ATOM 497 O LYS A 540 14.612 -5.982 23.072 1.00 54.20 O ATOM 498 CB LYS A 540 13.466 -5.859 20.280 1.00 52.44 C ATOM 499 CG LYS A 540 14.237 -5.765 18.980 1.00 52.28 C ATOM 500 CD LYS A 540 13.790 -4.544 18.169 1.00 52.70 C ATOM 501 CE LYS A 540 14.765 -4.252 17.029 1.00 52.87 C ATOM 502 NZ LYS A 540 14.283 -3.132 16.174 1.00 51.61 N ATOM 503 HA LYS A 540 14.165 -7.894 20.483 1.00 0.00 H ATOM 504 HB2 LYS A 540 12.402 -5.864 20.043 1.00 0.00 H ATOM 505 HB3 LYS A 540 13.700 -4.978 20.877 1.00 0.00 H ATOM 506 HG2 LYS A 540 15.301 -5.678 19.201 1.00 0.00 H ATOM 507 HG3 LYS A 540 14.062 -6.667 18.394 1.00 0.00 H ATOM 508 HD2 LYS A 540 12.802 -4.736 17.752 1.00 0.00 H ATOM 509 HD3 LYS A 540 13.743 -3.677 18.828 1.00 0.00 H ATOM 510 HE2 LYS A 540 14.871 -5.146 16.415 1.00 0.00 H ATOM 511 HE3 LYS A 540 15.734 -3.985 17.451 1.00 0.00 H ATOM 512 HZ1 LYS A 540 13.361 -3.383 15.764 1.00 0.00 H ATOM 513 HZ2 LYS A 540 14.185 -2.273 16.753 1.00 0.00 H ATOM 514 HZ3 LYS A 540 14.968 -2.961 15.411 1.00 0.00 H ATOM 515 H LYS A 540 11.824 -6.844 22.004 1.00 0.00 H ATOM 516 N MET A 541 15.990 -7.484 22.103 1.00 55.82 N ATOM 517 CA MET A 541 17.125 -7.226 23.010 1.00 57.72 C ATOM 518 C MET A 541 18.083 -6.247 22.337 1.00 58.27 C ATOM 519 O MET A 541 18.388 -6.402 21.147 1.00 58.62 O ATOM 520 CB MET A 541 17.891 -8.512 23.353 1.00 58.02 C ATOM 521 CG MET A 541 17.041 -9.686 23.807 1.00 60.27 C ATOM 522 SD MET A 541 16.361 -9.457 25.449 1.00 65.39 S ATOM 523 CE MET A 541 14.896 -10.461 25.319 1.00 63.88 C ATOM 524 HA MET A 541 16.727 -6.813 23.937 1.00 0.00 H ATOM 525 HB2 MET A 541 18.441 -8.821 22.464 1.00 0.00 H ATOM 526 HB3 MET A 541 18.595 -8.279 24.152 1.00 0.00 H ATOM 527 HG2 MET A 541 17.659 -10.584 23.808 1.00 0.00 H ATOM 528 HG3 MET A 541 16.218 -9.813 23.104 1.00 0.00 H ATOM 529 HE1 MET A 541 14.263 -10.076 24.519 1.00 0.00 H ATOM 530 HE2 MET A 541 15.180 -11.489 25.096 1.00 0.00 H ATOM 531 HE3 MET A 541 14.351 -10.430 26.262 1.00 0.00 H ATOM 532 H MET A 541 16.086 -8.221 21.376 1.00 0.00 H ATOM 533 N LEU A 542 18.567 -5.260 23.094 1.00 58.99 N ATOM 534 CA LEU A 542 19.420 -4.191 22.538 1.00 59.53 C ATOM 535 C LEU A 542 20.924 -4.322 22.827 1.00 59.80 C ATOM 536 O LEU A 542 21.350 -4.958 23.800 1.00 60.34 O ATOM 537 CB LEU A 542 18.897 -2.810 22.963 1.00 59.71 C ATOM 538 CG LEU A 542 18.000 -2.047 21.969 1.00 59.73 C ATOM 539 CD1 LEU A 542 16.648 -2.706 21.748 1.00 60.34 C ATOM 540 CD2 LEU A 542 17.797 -0.616 22.427 1.00 60.50 C ATOM 541 HA LEU A 542 19.342 -4.306 21.457 1.00 0.00 H ATOM 542 HB2 LEU A 542 18.324 -2.947 23.880 1.00 0.00 H ATOM 543 HB3 LEU A 542 19.764 -2.182 23.168 1.00 0.00 H ATOM 544 HG LEU A 542 18.525 -2.065 21.014 1.00 0.00 H ATOM 545 HD21 LEU A 542 17.321 -0.614 23.408 1.00 0.00 H ATOM 546 HD22 LEU A 542 18.763 -0.115 22.489 1.00 0.00 H ATOM 547 HD23 LEU A 542 17.161 -0.094 21.712 1.00 0.00 H ATOM 548 HD11 LEU A 542 16.795 -3.711 21.352 1.00 0.00 H ATOM 549 HD12 LEU A 542 16.113 -2.762 22.696 1.00 0.00 H ATOM 550 HD13 LEU A 542 16.069 -2.116 21.038 1.00 0.00 H ATOM 551 H LEU A 542 18.336 -5.243 24.108 1.00 0.00 H TER 552 LEU A 542 ATOM 553 N SER A 549 24.189 4.923 30.128 1.00 78.66 N ATOM 554 CA SER A 549 23.342 5.736 31.001 1.00 78.74 C ATOM 555 C SER A 549 22.514 6.707 30.176 1.00 78.64 C ATOM 556 O SER A 549 21.285 6.740 30.274 1.00 78.59 O ATOM 557 CB SER A 549 24.190 6.528 32.001 1.00 78.82 C ATOM 558 OG SER A 549 25.189 5.721 32.599 1.00 79.20 O ATOM 559 HA SER A 549 22.682 5.062 31.547 1.00 0.00 H ATOM 560 HB2 SER A 549 23.539 6.921 32.782 1.00 0.00 H ATOM 561 HB3 SER A 549 24.670 7.356 31.479 1.00 0.00 H ATOM 562 HG SER A 549 25.714 6.266 33.237 1.00 0.00 H ATOM 563 HN3 SER A 549 24.828 5.544 29.591 1.00 0.00 H ATOM 564 HN2 SER A 549 23.590 4.385 29.469 1.00 0.00 H ATOM 565 HN1 SER A 549 24.749 4.264 30.706 1.00 0.00 H ATOM 566 N SER A 550 23.214 7.503 29.374 1.00 78.58 N ATOM 567 CA SER A 550 22.610 8.487 28.488 1.00 78.48 C ATOM 568 C SER A 550 21.800 7.816 27.381 1.00 78.46 C ATOM 569 O SER A 550 20.692 8.253 27.058 1.00 78.38 O ATOM 570 CB SER A 550 23.705 9.367 27.876 1.00 78.52 C ATOM 571 OG SER A 550 23.232 10.045 26.726 1.00 78.40 O ATOM 572 HA SER A 550 21.928 9.103 29.075 1.00 0.00 H ATOM 573 HB2 SER A 550 24.551 8.740 27.597 1.00 0.00 H ATOM 574 HB3 SER A 550 24.027 10.101 28.615 1.00 0.00 H ATOM 575 HG SER A 550 23.958 10.605 26.352 1.00 0.00 H ATOM 576 H SER A 550 24.250 7.418 29.380 1.00 0.00 H ATOM 577 N ASP A 551 22.370 6.759 26.803 1.00 78.34 N ATOM 578 CA ASP A 551 21.719 5.989 25.743 1.00 78.25 C ATOM 579 C ASP A 551 20.413 5.341 26.207 1.00 77.92 C ATOM 580 O ASP A 551 19.405 5.381 25.493 1.00 78.02 O ATOM 581 CB ASP A 551 22.685 4.940 25.176 1.00 78.39 C ATOM 582 CG ASP A 551 23.697 5.538 24.199 1.00 78.78 C ATOM 583 OD1 ASP A 551 23.493 6.683 23.738 1.00 79.49 O ATOM 584 OD2 ASP A 551 24.696 4.859 23.880 1.00 79.02 O ATOM 585 HA ASP A 551 21.453 6.688 24.950 1.00 0.00 H ATOM 586 HB2 ASP A 551 23.227 4.481 26.003 1.00 0.00 H ATOM 587 HB3 ASP A 551 22.106 4.177 24.655 1.00 0.00 H ATOM 588 H ASP A 551 23.318 6.469 27.119 1.00 0.00 H ATOM 589 N ILE A 552 20.439 4.763 27.407 1.00 77.40 N ATOM 590 CA ILE A 552 19.255 4.154 28.027 1.00 76.97 C ATOM 591 C ILE A 552 18.235 5.237 28.425 1.00 76.77 C ATOM 592 O ILE A 552 17.057 4.954 28.662 1.00 76.80 O ATOM 593 CB ILE A 552 19.657 3.247 29.237 1.00 76.84 C ATOM 594 CG1 ILE A 552 20.659 2.174 28.785 1.00 76.51 C ATOM 595 CG2 ILE A 552 18.431 2.593 29.879 1.00 76.62 C ATOM 596 CD1 ILE A 552 21.265 1.344 29.903 1.00 76.09 C ATOM 597 HA ILE A 552 18.773 3.507 27.294 1.00 0.00 H ATOM 598 HB ILE A 552 20.128 3.881 29.989 1.00 0.00 H ATOM 599 HG12 ILE A 552 20.144 1.497 28.103 1.00 0.00 H ATOM 600 HG13 ILE A 552 21.471 2.672 28.256 1.00 0.00 H ATOM 601 HD11 ILE A 552 21.800 1.999 30.591 1.00 0.00 H ATOM 602 HD12 ILE A 552 20.471 0.823 30.438 1.00 0.00 H ATOM 603 HD13 ILE A 552 21.958 0.617 29.479 1.00 0.00 H ATOM 604 HG21 ILE A 552 17.754 3.368 30.238 1.00 0.00 H ATOM 605 HG22 ILE A 552 17.921 1.976 29.139 1.00 0.00 H ATOM 606 HG23 ILE A 552 18.749 1.971 30.716 1.00 0.00 H ATOM 607 H ILE A 552 21.339 4.742 27.928 1.00 0.00 H ATOM 608 N GLU A 553 18.701 6.480 28.464 1.00 76.46 N ATOM 609 CA GLU A 553 17.874 7.623 28.822 1.00 76.16 C ATOM 610 C GLU A 553 16.889 7.983 27.705 1.00 75.92 C ATOM 611 O GLU A 553 15.677 8.000 27.926 1.00 76.09 O ATOM 612 CB GLU A 553 18.779 8.816 29.146 1.00 76.21 C ATOM 613 CG GLU A 553 18.132 9.933 29.950 1.00 76.16 C ATOM 614 CD GLU A 553 19.061 11.125 30.137 1.00 75.73 C ATOM 615 OE1 GLU A 553 18.553 12.252 30.309 1.00 75.69 O ATOM 616 OE2 GLU A 553 20.299 10.940 30.105 1.00 75.41 O ATOM 617 HA GLU A 553 17.282 7.361 29.699 1.00 0.00 H ATOM 618 HB2 GLU A 553 19.633 8.445 29.713 1.00 0.00 H ATOM 619 HB3 GLU A 553 19.127 9.239 28.204 1.00 0.00 H ATOM 620 HG2 GLU A 553 17.235 10.266 29.428 1.00 0.00 H ATOM 621 HG3 GLU A 553 17.857 9.545 30.931 1.00 0.00 H ATOM 622 H GLU A 553 19.701 6.644 28.228 1.00 0.00 H ATOM 623 N GLU A 554 17.415 8.261 26.513 1.00 75.54 N ATOM 624 CA GLU A 554 16.599 8.720 25.385 1.00 75.24 C ATOM 625 C GLU A 554 15.801 7.583 24.735 1.00 74.77 C ATOM 626 O GLU A 554 14.771 7.826 24.091 1.00 74.74 O ATOM 627 CB GLU A 554 17.464 9.431 24.332 1.00 75.36 C ATOM 628 CG GLU A 554 16.675 10.385 23.422 1.00 75.76 C ATOM 629 CD GLU A 554 17.167 10.390 21.978 1.00 76.36 C ATOM 630 OE1 GLU A 554 18.364 10.678 21.753 1.00 76.81 O ATOM 631 OE2 GLU A 554 16.351 10.109 21.067 1.00 75.77 O ATOM 632 HA GLU A 554 15.880 9.431 25.792 1.00 0.00 H ATOM 633 HB2 GLU A 554 18.232 10.006 24.849 1.00 0.00 H ATOM 634 HB3 GLU A 554 17.938 8.673 23.708 1.00 0.00 H ATOM 635 HG2 GLU A 554 15.628 10.083 23.429 1.00 0.00 H ATOM 636 HG3 GLU A 554 16.763 11.396 23.821 1.00 0.00 H ATOM 637 H GLU A 554 18.440 8.148 26.378 1.00 0.00 H ATOM 638 N PHE A 555 16.292 6.354 24.890 1.00 74.09 N ATOM 639 CA PHE A 555 15.534 5.157 24.524 1.00 73.42 C ATOM 640 C PHE A 555 14.127 5.262 25.097 1.00 73.19 C ATOM 641 O PHE A 555 13.138 5.132 24.374 1.00 72.99 O ATOM 642 CB PHE A 555 16.224 3.890 25.052 1.00 73.30 C ATOM 643 CG PHE A 555 15.368 2.653 24.977 1.00 72.81 C ATOM 644 CD1 PHE A 555 15.490 1.775 23.908 1.00 72.94 C ATOM 645 CD2 PHE A 555 14.437 2.366 25.977 1.00 72.65 C ATOM 646 CE1 PHE A 555 14.698 0.630 23.829 1.00 72.59 C ATOM 647 CE2 PHE A 555 13.635 1.231 25.905 1.00 72.76 C ATOM 648 CZ PHE A 555 13.769 0.357 24.829 1.00 72.21 C ATOM 649 HA PHE A 555 15.486 5.087 23.437 1.00 0.00 H ATOM 650 HB2 PHE A 555 17.126 3.720 24.464 1.00 0.00 H ATOM 651 HB3 PHE A 555 16.497 4.056 26.094 1.00 0.00 H ATOM 652 HD2 PHE A 555 14.337 3.041 26.827 1.00 0.00 H ATOM 653 HE2 PHE A 555 12.905 1.027 26.688 1.00 0.00 H ATOM 654 HZ PHE A 555 13.149 -0.537 24.770 1.00 0.00 H ATOM 655 HE1 PHE A 555 14.806 -0.051 22.985 1.00 0.00 H ATOM 656 HD1 PHE A 555 16.214 1.984 23.121 1.00 0.00 H ATOM 657 H PHE A 555 17.247 6.242 25.285 1.00 0.00 H ATOM 658 N LEU A 556 14.058 5.519 26.401 1.00 72.77 N ATOM 659 CA LEU A 556 12.799 5.613 27.116 1.00 72.39 C ATOM 660 C LEU A 556 12.001 6.819 26.639 1.00 72.15 C ATOM 661 O LEU A 556 10.780 6.745 26.489 1.00 71.83 O ATOM 662 CB LEU A 556 13.065 5.702 28.621 1.00 72.44 C ATOM 663 CG LEU A 556 12.094 4.956 29.538 1.00 72.65 C ATOM 664 CD1 LEU A 556 12.786 4.586 30.843 1.00 72.76 C ATOM 665 CD2 LEU A 556 10.831 5.767 29.797 1.00 72.11 C ATOM 666 HA LEU A 556 12.210 4.719 26.914 1.00 0.00 H ATOM 667 HB2 LEU A 556 14.063 5.304 28.804 1.00 0.00 H ATOM 668 HB3 LEU A 556 13.038 6.756 28.899 1.00 0.00 H ATOM 669 HG LEU A 556 11.787 4.040 29.034 1.00 0.00 H ATOM 670 HD21 LEU A 556 11.098 6.711 30.273 1.00 0.00 H ATOM 671 HD22 LEU A 556 10.328 5.965 28.851 1.00 0.00 H ATOM 672 HD23 LEU A 556 10.167 5.203 30.452 1.00 0.00 H ATOM 673 HD11 LEU A 556 13.642 3.945 30.630 1.00 0.00 H ATOM 674 HD12 LEU A 556 13.125 5.493 31.343 1.00 0.00 H ATOM 675 HD13 LEU A 556 12.085 4.056 31.487 1.00 0.00 H ATOM 676 H LEU A 556 14.943 5.658 26.929 1.00 0.00 H ATOM 677 N ARG A 557 12.703 7.923 26.393 1.00 72.04 N ATOM 678 CA ARG A 557 12.079 9.150 25.909 1.00 72.04 C ATOM 679 C ARG A 557 11.328 8.896 24.598 1.00 71.49 C ATOM 680 O ARG A 557 10.136 9.198 24.491 1.00 71.58 O ATOM 681 CB ARG A 557 13.139 10.255 25.735 1.00 72.55 C ATOM 682 CG ARG A 557 12.612 11.710 25.696 1.00 73.91 C ATOM 683 CD ARG A 557 11.962 12.104 24.348 1.00 76.51 C ATOM 684 NE ARG A 557 12.750 11.696 23.180 1.00 77.68 N ATOM 685 CZ ARG A 557 13.609 12.477 22.527 1.00 78.48 C ATOM 686 NH1 ARG A 557 13.805 13.733 22.913 1.00 78.61 N ATOM 687 NH2 ARG A 557 14.274 11.998 21.482 1.00 78.45 N ATOM 688 HA ARG A 557 11.353 9.486 26.649 1.00 0.00 H ATOM 689 HB2 ARG A 557 13.840 10.177 26.566 1.00 0.00 H ATOM 690 HB3 ARG A 557 13.665 10.067 24.799 1.00 0.00 H ATOM 691 HG2 ARG A 557 11.868 11.827 26.484 1.00 0.00 H ATOM 692 HG3 ARG A 557 13.448 12.384 25.884 1.00 0.00 H ATOM 693 HD2 ARG A 557 11.844 13.187 24.324 1.00 0.00 H ATOM 694 HD3 ARG A 557 10.982 11.632 24.286 1.00 0.00 H ATOM 695 HE ARG A 557 12.629 10.722 22.835 1.00 0.00 H ATOM 696 HH12 ARG A 557 14.477 14.336 22.398 1.00 0.00 H ATOM 697 HH11 ARG A 557 13.286 14.113 23.730 1.00 0.00 H ATOM 698 HH22 ARG A 557 14.945 12.605 20.970 1.00 0.00 H ATOM 699 HH21 ARG A 557 14.123 11.016 21.176 1.00 0.00 H ATOM 700 H ARG A 557 13.731 7.911 26.551 1.00 0.00 H ATOM 701 N GLU A 558 12.028 8.333 23.613 1.00 70.63 N ATOM 702 CA GLU A 558 11.443 8.079 22.298 1.00 69.82 C ATOM 703 C GLU A 558 10.451 6.915 22.309 1.00 68.86 C ATOM 704 O GLU A 558 9.512 6.892 21.516 1.00 68.63 O ATOM 705 CB GLU A 558 12.531 7.837 21.259 1.00 70.08 C ATOM 706 CG GLU A 558 12.064 8.111 19.841 1.00 71.19 C ATOM 707 CD GLU A 558 13.174 8.010 18.827 1.00 72.25 C ATOM 708 OE1 GLU A 558 14.106 7.196 19.026 1.00 72.70 O ATOM 709 OE2 GLU A 558 13.106 8.748 17.823 1.00 73.63 O ATOM 710 HA GLU A 558 10.884 8.975 22.028 1.00 0.00 H ATOM 711 HB2 GLU A 558 13.375 8.490 21.480 1.00 0.00 H ATOM 712 HB3 GLU A 558 12.851 6.797 21.325 1.00 0.00 H ATOM 713 HG2 GLU A 558 11.291 7.387 19.583 1.00 0.00 H ATOM 714 HG3 GLU A 558 11.646 9.117 19.801 1.00 0.00 H ATOM 715 H GLU A 558 13.019 8.067 23.785 1.00 0.00 H ATOM 716 N ALA A 559 10.670 5.958 23.213 1.00 67.82 N ATOM 717 CA ALA A 559 9.712 4.886 23.465 1.00 66.49 C ATOM 718 C ALA A 559 8.318 5.454 23.712 1.00 65.65 C ATOM 719 O ALA A 559 7.336 4.928 23.202 1.00 65.44 O ATOM 720 CB ALA A 559 10.157 4.042 24.642 1.00 66.54 C ATOM 721 HA ALA A 559 9.670 4.251 22.580 1.00 0.00 H ATOM 722 HB1 ALA A 559 11.131 3.603 24.425 1.00 0.00 H ATOM 723 HB2 ALA A 559 10.229 4.669 25.531 1.00 0.00 H ATOM 724 HB3 ALA A 559 9.430 3.248 24.814 1.00 0.00 H ATOM 725 H ALA A 559 11.556 5.977 23.758 1.00 0.00 H ATOM 726 N ALA A 560 8.248 6.546 24.469 1.00 64.93 N ATOM 727 CA ALA A 560 6.978 7.166 24.854 1.00 64.18 C ATOM 728 C ALA A 560 6.241 7.777 23.669 1.00 63.56 C ATOM 729 O ALA A 560 5.008 7.773 23.614 1.00 63.61 O ATOM 730 CB ALA A 560 7.207 8.216 25.935 1.00 64.27 C ATOM 731 HA ALA A 560 6.343 6.373 25.249 1.00 0.00 H ATOM 732 HB1 ALA A 560 7.652 7.743 26.810 1.00 0.00 H ATOM 733 HB2 ALA A 560 7.879 8.986 25.555 1.00 0.00 H ATOM 734 HB3 ALA A 560 6.253 8.667 26.210 1.00 0.00 H ATOM 735 H ALA A 560 9.134 6.978 24.802 1.00 0.00 H ATOM 736 N CYS A 561 6.997 8.304 22.717 1.00 62.80 N ATOM 737 CA CYS A 561 6.392 8.871 21.527 1.00 62.11 C ATOM 738 C CYS A 561 5.917 7.781 20.550 1.00 60.85 C ATOM 739 O CYS A 561 4.853 7.916 19.944 1.00 60.32 O ATOM 740 CB CYS A 561 7.353 9.857 20.879 1.00 62.45 C ATOM 741 SG CYS A 561 7.800 11.203 22.017 1.00 66.07 S ATOM 742 HA CYS A 561 5.495 9.418 21.818 1.00 0.00 H ATOM 743 HB2 CYS A 561 6.880 10.284 19.995 1.00 0.00 H ATOM 744 HB3 CYS A 561 8.259 9.327 20.585 1.00 0.00 H ATOM 745 HG CYS A 561 8.670 12.068 21.385 1.00 0.00 H ATOM 746 H CYS A 561 8.031 8.311 22.824 1.00 0.00 H ATOM 747 N MET A 562 6.694 6.699 20.434 1.00 59.38 N ATOM 748 CA MET A 562 6.337 5.542 19.588 1.00 58.15 C ATOM 749 C MET A 562 5.096 4.788 20.069 1.00 56.94 C ATOM 750 O MET A 562 4.345 4.237 19.259 1.00 56.41 O ATOM 751 CB MET A 562 7.509 4.569 19.474 1.00 58.23 C ATOM 752 CG MET A 562 8.703 5.139 18.756 1.00 59.30 C ATOM 753 SD MET A 562 10.020 3.933 18.583 1.00 62.82 S ATOM 754 CE MET A 562 11.357 4.990 18.005 1.00 64.20 C ATOM 755 HA MET A 562 6.099 5.959 18.610 1.00 0.00 H ATOM 756 HB2 MET A 562 7.817 4.282 20.479 1.00 0.00 H ATOM 757 HB3 MET A 562 7.171 3.685 18.932 1.00 0.00 H ATOM 758 HG2 MET A 562 9.079 5.993 19.320 1.00 0.00 H ATOM 759 HG3 MET A 562 8.394 5.468 17.764 1.00 0.00 H ATOM 760 HE1 MET A 562 11.066 5.461 17.066 1.00 0.00 H ATOM 761 HE2 MET A 562 11.559 5.758 18.751 1.00 0.00 H ATOM 762 HE3 MET A 562 12.252 4.388 17.849 1.00 0.00 H ATOM 763 H MET A 562 7.589 6.671 20.963 1.00 0.00 H ATOM 764 N LYS A 563 4.888 4.771 21.387 1.00 55.66 N ATOM 765 CA LYS A 563 3.728 4.111 21.985 1.00 54.63 C ATOM 766 C LYS A 563 2.410 4.683 21.486 1.00 53.57 C ATOM 767 O LYS A 563 1.404 3.976 21.431 1.00 53.13 O ATOM 768 CB LYS A 563 3.776 4.179 23.521 1.00 55.05 C ATOM 769 CG LYS A 563 2.525 3.626 24.231 1.00 55.70 C ATOM 770 CD LYS A 563 2.348 2.112 24.044 1.00 56.29 C ATOM 771 CE LYS A 563 0.881 1.704 24.174 1.00 56.95 C ATOM 772 NZ LYS A 563 0.714 0.226 24.110 1.00 57.19 N ATOM 773 HA LYS A 563 3.778 3.068 21.672 1.00 0.00 H ATOM 774 HB2 LYS A 563 4.639 3.606 23.859 1.00 0.00 H ATOM 775 HB3 LYS A 563 3.898 5.223 23.811 1.00 0.00 H ATOM 776 HG2 LYS A 563 2.609 3.837 25.297 1.00 0.00 H ATOM 777 HG3 LYS A 563 1.646 4.131 23.830 1.00 0.00 H ATOM 778 HD2 LYS A 563 2.708 1.832 23.054 1.00 0.00 H ATOM 779 HD3 LYS A 563 2.931 1.590 24.803 1.00 0.00 H ATOM 780 HE2 LYS A 563 0.314 2.160 23.362 1.00 0.00 H ATOM 781 HE3 LYS A 563 0.497 2.062 25.129 1.00 0.00 H ATOM 782 HZ1 LYS A 563 1.072 -0.123 23.198 1.00 0.00 H ATOM 783 HZ2 LYS A 563 1.248 -0.216 24.886 1.00 0.00 H ATOM 784 HZ3 LYS A 563 -0.294 -0.012 24.202 1.00 0.00 H ATOM 785 H LYS A 563 5.574 5.243 22.010 1.00 0.00 H ATOM 786 N GLU A 564 2.404 5.957 21.118 1.00 52.47 N ATOM 787 CA GLU A 564 1.155 6.543 20.662 1.00 51.62 C ATOM 788 C GLU A 564 0.875 6.387 19.157 1.00 49.82 C ATOM 789 O GLU A 564 -0.168 6.840 18.690 1.00 49.75 O ATOM 790 CB GLU A 564 0.979 7.987 21.160 1.00 52.54 C ATOM 791 CG GLU A 564 1.995 8.994 20.654 1.00 55.70 C ATOM 792 CD GLU A 564 1.428 10.398 20.593 1.00 59.97 C ATOM 793 OE1 GLU A 564 0.502 10.711 21.383 1.00 61.30 O ATOM 794 OE2 GLU A 564 1.913 11.188 19.747 1.00 61.26 O ATOM 795 HA GLU A 564 0.377 5.942 21.132 1.00 0.00 H ATOM 796 HB2 GLU A 564 -0.010 8.328 20.853 1.00 0.00 H ATOM 797 HB3 GLU A 564 1.036 7.974 22.248 1.00 0.00 H ATOM 798 HG2 GLU A 564 2.855 8.991 21.323 1.00 0.00 H ATOM 799 HG3 GLU A 564 2.313 8.700 19.654 1.00 0.00 H ATOM 800 H GLU A 564 3.275 6.525 21.155 1.00 0.00 H ATOM 801 N PHE A 565 1.771 5.731 18.409 1.00 48.00 N ATOM 802 CA PHE A 565 1.467 5.395 17.000 1.00 46.11 C ATOM 803 C PHE A 565 0.240 4.510 16.988 1.00 44.54 C ATOM 804 O PHE A 565 0.190 3.528 17.723 1.00 44.35 O ATOM 805 CB PHE A 565 2.582 4.610 16.299 1.00 46.46 C ATOM 806 CG PHE A 565 3.843 5.380 16.080 1.00 46.79 C ATOM 807 CD1 PHE A 565 3.824 6.754 15.899 1.00 46.93 C ATOM 808 CD2 PHE A 565 5.059 4.711 16.033 1.00 47.65 C ATOM 809 CE1 PHE A 565 5.011 7.455 15.704 1.00 48.73 C ATOM 810 CE2 PHE A 565 6.248 5.405 15.828 1.00 48.93 C ATOM 811 CZ PHE A 565 6.221 6.774 15.671 1.00 47.11 C ATOM 812 HA PHE A 565 1.335 6.339 16.472 1.00 0.00 H ATOM 813 HB2 PHE A 565 2.818 3.737 16.908 1.00 0.00 H ATOM 814 HB3 PHE A 565 2.210 4.284 15.328 1.00 0.00 H ATOM 815 HD2 PHE A 565 5.083 3.628 16.158 1.00 0.00 H ATOM 816 HE2 PHE A 565 7.196 4.868 15.792 1.00 0.00 H ATOM 817 HZ PHE A 565 7.151 7.323 15.521 1.00 0.00 H ATOM 818 HE1 PHE A 565 4.991 8.537 15.577 1.00 0.00 H ATOM 819 HD1 PHE A 565 2.874 7.289 15.909 1.00 0.00 H ATOM 820 H PHE A 565 2.686 5.456 18.820 1.00 0.00 H ATOM 821 N ASP A 566 -0.730 4.850 16.149 1.00 42.58 N ATOM 822 CA ASP A 566 -1.936 4.050 16.037 1.00 41.62 C ATOM 823 C ASP A 566 -2.448 4.062 14.606 1.00 39.85 C ATOM 824 O ASP A 566 -3.200 4.955 14.203 1.00 40.01 O ATOM 825 CB ASP A 566 -3.003 4.533 17.042 1.00 42.95 C ATOM 826 CG ASP A 566 -4.267 3.676 17.026 1.00 45.51 C ATOM 827 OD1 ASP A 566 -4.255 2.552 16.468 1.00 47.77 O ATOM 828 OD2 ASP A 566 -5.289 4.144 17.580 1.00 50.14 O ATOM 829 HA ASP A 566 -1.702 3.016 16.290 1.00 0.00 H ATOM 830 HB2 ASP A 566 -2.575 4.504 18.044 1.00 0.00 H ATOM 831 HB3 ASP A 566 -3.275 5.559 16.794 1.00 0.00 H ATOM 832 H ASP A 566 -0.625 5.703 15.563 1.00 0.00 H ATOM 833 N HIS A 567 -2.041 3.042 13.851 1.00 36.37 N ATOM 834 CA HIS A 567 -2.331 2.950 12.444 1.00 33.78 C ATOM 835 C HIS A 567 -2.164 1.502 11.954 1.00 33.00 C ATOM 836 O HIS A 567 -1.217 0.834 12.341 1.00 32.12 O ATOM 837 CB HIS A 567 -1.405 3.879 11.646 1.00 32.89 C ATOM 838 CG HIS A 567 -1.721 3.901 10.194 1.00 30.91 C ATOM 839 ND1 HIS A 567 -2.539 4.855 9.630 1.00 29.82 N ATOM 840 CD2 HIS A 567 -1.397 3.040 9.202 1.00 25.79 C ATOM 841 CE1 HIS A 567 -2.667 4.607 8.340 1.00 27.08 C ATOM 842 NE2 HIS A 567 -1.999 3.497 8.062 1.00 30.43 N ATOM 843 HA HIS A 567 -3.365 3.259 12.287 1.00 0.00 H ATOM 844 HB2 HIS A 567 -1.504 4.891 12.039 1.00 0.00 H ATOM 845 HB3 HIS A 567 -0.377 3.540 11.774 1.00 0.00 H ATOM 846 HD2 HIS A 567 -0.774 2.150 9.294 1.00 0.00 H ATOM 847 HE1 HIS A 567 -3.226 5.212 7.626 1.00 0.00 H ATOM 848 H HIS A 567 -1.491 2.281 14.297 1.00 0.00 H ATOM 849 N PRO A 568 -3.079 1.037 11.085 1.00 32.51 N ATOM 850 CA PRO A 568 -3.125 -0.336 10.570 1.00 32.19 C ATOM 851 C PRO A 568 -1.854 -0.788 9.824 1.00 30.87 C ATOM 852 O PRO A 568 -1.592 -1.982 9.722 1.00 30.49 O ATOM 853 CB PRO A 568 -4.318 -0.313 9.595 1.00 32.06 C ATOM 854 CG PRO A 568 -4.707 1.145 9.434 1.00 33.99 C ATOM 855 CD PRO A 568 -4.297 1.785 10.730 1.00 32.94 C ATOM 856 HA PRO A 568 -3.213 -1.044 11.394 1.00 0.00 H ATOM 857 HD3 PRO A 568 -4.083 2.845 10.596 1.00 0.00 H ATOM 858 HD2 PRO A 568 -5.069 1.665 11.490 1.00 0.00 H ATOM 859 HG3 PRO A 568 -5.781 1.243 9.278 1.00 0.00 H ATOM 860 HG2 PRO A 568 -4.176 1.596 8.596 1.00 0.00 H ATOM 861 HB2 PRO A 568 -4.028 -0.735 8.633 1.00 0.00 H ATOM 862 HB3 PRO A 568 -5.152 -0.884 10.004 1.00 0.00 H ATOM 863 N HIS A 569 -1.088 0.161 9.308 1.00 29.83 N ATOM 864 CA HIS A 569 0.143 -0.142 8.565 1.00 28.17 C ATOM 865 C HIS A 569 1.424 0.296 9.255 1.00 28.54 C ATOM 866 O HIS A 569 2.482 0.382 8.627 1.00 27.41 O ATOM 867 CB HIS A 569 0.039 0.395 7.157 1.00 26.35 C ATOM 868 CG HIS A 569 -1.100 -0.214 6.397 1.00 27.61 C ATOM 869 ND1 HIS A 569 -1.129 -1.551 6.055 1.00 24.02 N ATOM 870 CD2 HIS A 569 -2.272 0.313 5.966 1.00 26.58 C ATOM 871 CE1 HIS A 569 -2.272 -1.817 5.435 1.00 27.65 C ATOM 872 NE2 HIS A 569 -2.976 -0.704 5.365 1.00 25.91 N ATOM 873 HA HIS A 569 0.224 -1.228 8.530 1.00 0.00 H ATOM 874 HB2 HIS A 569 -0.108 1.474 7.203 1.00 0.00 H ATOM 875 HB3 HIS A 569 0.968 0.178 6.630 1.00 0.00 H ATOM 876 HD2 HIS A 569 -2.596 1.348 6.075 1.00 0.00 H ATOM 877 HE1 HIS A 569 -2.577 -2.790 5.049 1.00 0.00 H ATOM 878 H HIS A 569 -1.367 1.155 9.433 1.00 0.00 H ATOM 879 N VAL A 570 1.316 0.508 10.560 1.00 29.58 N ATOM 880 CA VAL A 570 2.463 0.699 11.439 1.00 31.11 C ATOM 881 C VAL A 570 2.395 -0.301 12.573 1.00 33.20 C ATOM 882 O VAL A 570 1.361 -0.431 13.211 1.00 33.49 O ATOM 883 CB VAL A 570 2.514 2.132 11.987 1.00 30.82 C ATOM 884 CG1 VAL A 570 3.687 2.317 12.980 1.00 30.11 C ATOM 885 CG2 VAL A 570 2.631 3.108 10.839 1.00 27.55 C ATOM 886 HA VAL A 570 3.375 0.537 10.864 1.00 0.00 H ATOM 887 HB VAL A 570 1.591 2.326 12.534 1.00 0.00 H ATOM 888 HG11 VAL A 570 3.564 1.630 13.818 1.00 0.00 H ATOM 889 HG12 VAL A 570 4.628 2.107 12.472 1.00 0.00 H ATOM 890 HG13 VAL A 570 3.692 3.343 13.347 1.00 0.00 H ATOM 891 HG21 VAL A 570 3.543 2.900 10.279 1.00 0.00 H ATOM 892 HG22 VAL A 570 1.767 3.000 10.183 1.00 0.00 H ATOM 893 HG23 VAL A 570 2.667 4.125 11.230 1.00 0.00 H ATOM 894 H VAL A 570 0.364 0.540 10.977 1.00 0.00 H ATOM 895 N ALA A 571 3.490 -1.037 12.804 1.00 35.16 N ATOM 896 CA ALA A 571 3.528 -1.985 13.913 1.00 37.80 C ATOM 897 C ALA A 571 3.302 -1.260 15.244 1.00 40.01 C ATOM 898 O ALA A 571 3.931 -0.225 15.545 1.00 40.18 O ATOM 899 CB ALA A 571 4.841 -2.775 13.930 1.00 37.88 C ATOM 900 HA ALA A 571 2.720 -2.703 13.771 1.00 0.00 H ATOM 901 HB1 ALA A 571 4.942 -3.330 12.997 1.00 0.00 H ATOM 902 HB2 ALA A 571 5.678 -2.084 14.036 1.00 0.00 H ATOM 903 HB3 ALA A 571 4.834 -3.471 14.769 1.00 0.00 H ATOM 904 H ALA A 571 4.321 -0.932 12.187 1.00 0.00 H ATOM 905 N LYS A 572 2.359 -1.791 16.016 1.00 42.50 N ATOM 906 CA LYS A 572 2.050 -1.269 17.333 1.00 45.22 C ATOM 907 C LYS A 572 3.258 -1.514 18.219 1.00 46.48 C ATOM 908 O LYS A 572 4.046 -2.440 17.973 1.00 47.01 O ATOM 909 CB LYS A 572 0.833 -2.003 17.912 1.00 45.74 C ATOM 910 CG LYS A 572 -0.490 -1.627 17.252 1.00 48.37 C ATOM 911 CD LYS A 572 -1.599 -2.660 17.519 1.00 53.19 C ATOM 912 CE LYS A 572 -2.671 -2.588 16.429 1.00 54.54 C ATOM 913 NZ LYS A 572 -4.032 -2.815 16.982 1.00 57.79 N ATOM 914 HA LYS A 572 1.820 -0.205 17.277 1.00 0.00 H ATOM 915 HB2 LYS A 572 0.987 -3.075 17.786 1.00 0.00 H ATOM 916 HB3 LYS A 572 0.765 -1.769 18.974 1.00 0.00 H ATOM 917 HG2 LYS A 572 -0.812 -0.661 17.640 1.00 0.00 H ATOM 918 HG3 LYS A 572 -0.335 -1.551 16.176 1.00 0.00 H ATOM 919 HD2 LYS A 572 -1.164 -3.659 17.530 1.00 0.00 H ATOM 920 HD3 LYS A 572 -2.056 -2.454 18.487 1.00 0.00 H ATOM 921 HE2 LYS A 572 -2.463 -3.350 15.677 1.00 0.00 H ATOM 922 HE3 LYS A 572 -2.638 -1.602 15.965 1.00 0.00 H ATOM 923 HZ1 LYS A 572 -4.074 -3.757 17.422 1.00 0.00 H ATOM 924 HZ2 LYS A 572 -4.240 -2.088 17.696 1.00 0.00 H ATOM 925 HZ3 LYS A 572 -4.731 -2.759 16.214 1.00 0.00 H ATOM 926 H LYS A 572 1.824 -2.610 15.663 1.00 0.00 H ATOM 927 N LEU A 573 3.418 -0.666 19.223 1.00 47.84 N ATOM 928 CA LEU A 573 4.355 -0.915 20.305 1.00 49.75 C ATOM 929 C LEU A 573 3.504 -1.399 21.471 1.00 50.44 C ATOM 930 O LEU A 573 2.558 -0.711 21.870 1.00 50.45 O ATOM 931 CB LEU A 573 5.068 0.382 20.687 1.00 50.16 C ATOM 932 CG LEU A 573 6.441 0.326 21.354 1.00 51.32 C ATOM 933 CD1 LEU A 573 7.515 0.063 20.311 1.00 52.94 C ATOM 934 CD2 LEU A 573 6.704 1.643 22.042 1.00 51.66 C ATOM 935 HA LEU A 573 5.118 -1.641 20.025 1.00 0.00 H ATOM 936 HB2 LEU A 573 5.186 0.960 19.770 1.00 0.00 H ATOM 937 HB3 LEU A 573 4.407 0.917 21.369 1.00 0.00 H ATOM 938 HG LEU A 573 6.461 -0.482 22.086 1.00 0.00 H ATOM 939 HD21 LEU A 573 6.684 2.446 21.306 1.00 0.00 H ATOM 940 HD22 LEU A 573 5.935 1.818 22.794 1.00 0.00 H ATOM 941 HD23 LEU A 573 7.683 1.612 22.521 1.00 0.00 H ATOM 942 HD11 LEU A 573 7.316 -0.889 19.818 1.00 0.00 H ATOM 943 HD12 LEU A 573 7.507 0.865 19.573 1.00 0.00 H ATOM 944 HD13 LEU A 573 8.490 0.025 20.797 1.00 0.00 H ATOM 945 H LEU A 573 2.854 0.208 19.238 1.00 0.00 H ATOM 946 N VAL A 574 3.799 -2.590 21.987 1.00 51.70 N ATOM 947 CA VAL A 574 3.111 -3.078 23.187 1.00 52.87 C ATOM 948 C VAL A 574 3.648 -2.296 24.393 1.00 53.62 C ATOM 949 O VAL A 574 2.872 -1.738 25.162 1.00 53.64 O ATOM 950 CB VAL A 574 3.259 -4.610 23.391 1.00 52.89 C ATOM 951 CG1 VAL A 574 2.615 -5.050 24.706 1.00 52.98 C ATOM 952 CG2 VAL A 574 2.648 -5.370 22.224 1.00 52.73 C ATOM 953 HA VAL A 574 2.040 -2.909 23.071 1.00 0.00 H ATOM 954 HB VAL A 574 4.323 -4.841 23.436 1.00 0.00 H ATOM 955 HG11 VAL A 574 3.100 -4.537 25.536 1.00 0.00 H ATOM 956 HG12 VAL A 574 1.554 -4.799 24.692 1.00 0.00 H ATOM 957 HG13 VAL A 574 2.733 -6.127 24.824 1.00 0.00 H ATOM 958 HG21 VAL A 574 1.589 -5.125 22.147 1.00 0.00 H ATOM 959 HG22 VAL A 574 3.155 -5.086 21.302 1.00 0.00 H ATOM 960 HG23 VAL A 574 2.764 -6.441 22.389 1.00 0.00 H ATOM 961 H VAL A 574 4.525 -3.181 21.534 1.00 0.00 H ATOM 962 N GLY A 575 4.977 -2.237 24.514 1.00 54.61 N ATOM 963 CA GLY A 575 5.656 -1.456 25.547 1.00 56.17 C ATOM 964 C GLY A 575 7.162 -1.644 25.535 1.00 57.19 C ATOM 965 O GLY A 575 7.716 -2.230 24.599 1.00 56.97 O ATOM 966 HA3 GLY A 575 5.275 -1.762 26.521 1.00 0.00 H ATOM 967 HA2 GLY A 575 5.436 -0.401 25.387 1.00 0.00 H ATOM 968 H GLY A 575 5.558 -2.774 23.839 1.00 0.00 H ATOM 969 N VAL A 576 7.821 -1.132 26.576 1.00 58.49 N ATOM 970 CA VAL A 576 9.271 -1.303 26.767 1.00 59.81 C ATOM 971 C VAL A 576 9.595 -1.780 28.181 1.00 60.90 C ATOM 972 O VAL A 576 8.818 -1.555 29.112 1.00 60.94 O ATOM 973 CB VAL A 576 10.064 -0.003 26.493 1.00 59.82 C ATOM 974 CG1 VAL A 576 10.108 0.300 24.998 1.00 60.01 C ATOM 975 CG2 VAL A 576 9.483 1.170 27.291 1.00 59.62 C ATOM 976 HA VAL A 576 9.576 -2.057 26.042 1.00 0.00 H ATOM 977 HB VAL A 576 11.091 -0.150 26.829 1.00 0.00 H ATOM 978 HG11 VAL A 576 10.593 -0.525 24.476 1.00 0.00 H ATOM 979 HG12 VAL A 576 9.092 0.422 24.623 1.00 0.00 H ATOM 980 HG13 VAL A 576 10.671 1.218 24.831 1.00 0.00 H ATOM 981 HG21 VAL A 576 8.444 1.325 27.002 1.00 0.00 H ATOM 982 HG22 VAL A 576 9.535 0.945 28.356 1.00 0.00 H ATOM 983 HG23 VAL A 576 10.058 2.071 27.080 1.00 0.00 H ATOM 984 H VAL A 576 7.287 -0.588 27.284 1.00 0.00 H ATOM 985 N SER A 577 10.751 -2.422 28.332 1.00 62.58 N ATOM 986 CA SER A 577 11.167 -2.988 29.615 1.00 64.30 C ATOM 987 C SER A 577 12.686 -2.983 29.790 1.00 65.35 C ATOM 988 O SER A 577 13.433 -2.745 28.831 1.00 65.39 O ATOM 989 CB SER A 577 10.614 -4.411 29.771 1.00 64.35 C ATOM 990 OG SER A 577 11.119 -5.050 30.934 1.00 64.65 O ATOM 991 HA SER A 577 10.754 -2.352 30.398 1.00 0.00 H ATOM 992 HB2 SER A 577 10.896 -4.997 28.896 1.00 0.00 H ATOM 993 HB3 SER A 577 9.527 -4.362 29.839 1.00 0.00 H ATOM 994 HG SER A 577 10.862 -4.527 31.734 1.00 0.00 H ATOM 995 H SER A 577 11.380 -2.525 27.510 1.00 0.00 H ATOM 996 N LEU A 578 13.123 -3.250 31.025 1.00 66.73 N ATOM 997 CA LEU A 578 14.545 -3.239 31.402 1.00 67.71 C ATOM 998 C LEU A 578 14.968 -4.511 32.163 1.00 68.36 C ATOM 999 O LEU A 578 14.356 -4.887 33.168 1.00 68.30 O ATOM 1000 CB LEU A 578 14.863 -1.990 32.231 1.00 67.82 C ATOM 1001 CG LEU A 578 14.337 -0.653 31.692 1.00 67.82 C ATOM 1002 CD1 LEU A 578 14.186 0.361 32.816 1.00 67.73 C ATOM 1003 CD2 LEU A 578 15.210 -0.113 30.550 1.00 67.32 C ATOM 1004 HA LEU A 578 15.121 -3.218 30.477 1.00 0.00 H ATOM 1005 HB2 LEU A 578 14.439 -2.136 33.224 1.00 0.00 H ATOM 1006 HB3 LEU A 578 15.947 -1.912 32.308 1.00 0.00 H ATOM 1007 HG LEU A 578 13.348 -0.832 31.270 1.00 0.00 H ATOM 1008 HD21 LEU A 578 16.226 0.040 30.913 1.00 0.00 H ATOM 1009 HD22 LEU A 578 15.220 -0.832 29.731 1.00 0.00 H ATOM 1010 HD23 LEU A 578 14.801 0.834 30.199 1.00 0.00 H ATOM 1011 HD11 LEU A 578 13.483 -0.021 33.556 1.00 0.00 H ATOM 1012 HD12 LEU A 578 15.155 0.528 33.286 1.00 0.00 H ATOM 1013 HD13 LEU A 578 13.812 1.300 32.409 1.00 0.00 H ATOM 1014 H LEU A 578 12.421 -3.477 31.758 1.00 0.00 H ATOM 1015 N ARG A 579 16.020 -5.155 31.663 1.00 69.21 N ATOM 1016 CA ARG A 579 16.517 -6.415 32.199 1.00 70.12 C ATOM 1017 C ARG A 579 17.947 -6.227 32.699 1.00 70.54 C ATOM 1018 O ARG A 579 18.627 -5.280 32.291 1.00 70.76 O ATOM 1019 CB ARG A 579 16.502 -7.469 31.095 1.00 70.25 C ATOM 1020 CG ARG A 579 16.543 -8.909 31.569 1.00 70.85 C ATOM 1021 CD ARG A 579 17.332 -9.745 30.580 1.00 72.47 C ATOM 1022 NE ARG A 579 16.998 -11.168 30.631 1.00 73.00 N ATOM 1023 CZ ARG A 579 17.754 -12.129 30.108 1.00 73.18 C ATOM 1024 NH1 ARG A 579 17.370 -13.392 30.194 1.00 73.91 N ATOM 1025 NH2 ARG A 579 18.899 -11.831 29.507 1.00 73.43 N ATOM 1026 HA ARG A 579 15.883 -6.737 33.025 1.00 0.00 H ATOM 1027 HB2 ARG A 579 15.591 -7.333 30.512 1.00 0.00 H ATOM 1028 HB3 ARG A 579 17.369 -7.300 30.457 1.00 0.00 H ATOM 1029 HG2 ARG A 579 17.021 -8.956 32.548 1.00 0.00 H ATOM 1030 HG3 ARG A 579 15.527 -9.296 31.643 1.00 0.00 H ATOM 1031 HD2 ARG A 579 18.394 -9.630 30.799 1.00 0.00 H ATOM 1032 HD3 ARG A 579 17.128 -9.377 29.575 1.00 0.00 H ATOM 1033 HE ARG A 579 16.115 -11.445 31.105 1.00 0.00 H ATOM 1034 HH12 ARG A 579 17.961 -14.144 29.785 1.00 0.00 H ATOM 1035 HH11 ARG A 579 16.477 -13.633 30.670 1.00 0.00 H ATOM 1036 HH22 ARG A 579 19.485 -12.588 29.100 1.00 0.00 H ATOM 1037 HH21 ARG A 579 19.210 -10.841 29.443 1.00 0.00 H ATOM 1038 H ARG A 579 16.512 -4.737 30.848 1.00 0.00 H ATOM 1039 N SER A 580 18.401 -7.129 33.573 1.00 71.05 N ATOM 1040 CA SER A 580 19.791 -7.127 34.040 1.00 71.32 C ATOM 1041 C SER A 580 20.261 -8.504 34.501 1.00 71.45 C ATOM 1042 O SER A 580 19.821 -9.012 35.535 1.00 71.71 O ATOM 1043 CB SER A 580 19.985 -6.104 35.154 1.00 71.33 C ATOM 1044 OG SER A 580 21.277 -5.536 35.065 1.00 72.21 O ATOM 1045 HA SER A 580 20.406 -6.848 33.184 1.00 0.00 H ATOM 1046 HB2 SER A 580 19.871 -6.595 36.120 1.00 0.00 H ATOM 1047 HB3 SER A 580 19.236 -5.318 35.058 1.00 0.00 H ATOM 1048 HG SER A 580 21.396 -4.873 35.791 1.00 0.00 H ATOM 1049 H SER A 580 17.749 -7.855 33.933 1.00 0.00 H TER 1050 SER A 580 ATOM 1051 N ILE A 588 20.120 -4.252 29.817 1.00 62.93 N ATOM 1052 CA ILE A 588 19.789 -4.147 28.391 1.00 62.58 C ATOM 1053 C ILE A 588 18.347 -3.630 28.195 1.00 61.86 C ATOM 1054 O ILE A 588 17.410 -4.148 28.819 1.00 61.90 O ATOM 1055 CB ILE A 588 20.060 -5.492 27.642 1.00 62.92 C ATOM 1056 CG1 ILE A 588 21.568 -5.659 27.385 1.00 63.55 C ATOM 1057 CG2 ILE A 588 19.271 -5.580 26.323 1.00 63.66 C ATOM 1058 CD1 ILE A 588 21.960 -6.901 26.556 1.00 64.28 C ATOM 1059 HA ILE A 588 20.451 -3.408 27.939 1.00 0.00 H ATOM 1060 HB ILE A 588 19.715 -6.306 28.280 1.00 0.00 H ATOM 1061 HG12 ILE A 588 21.920 -4.774 26.854 1.00 0.00 H ATOM 1062 HG13 ILE A 588 22.070 -5.726 28.350 1.00 0.00 H ATOM 1063 HD11 ILE A 588 21.631 -7.801 27.075 1.00 0.00 H ATOM 1064 HD12 ILE A 588 21.482 -6.849 25.578 1.00 0.00 H ATOM 1065 HD13 ILE A 588 23.043 -6.926 26.432 1.00 0.00 H ATOM 1066 HG21 ILE A 588 18.204 -5.514 26.534 1.00 0.00 H ATOM 1067 HG22 ILE A 588 19.565 -4.758 25.670 1.00 0.00 H ATOM 1068 HG23 ILE A 588 19.488 -6.530 25.834 1.00 0.00 H ATOM 1069 HN3 ILE A 588 19.462 -4.914 30.277 1.00 0.00 H ATOM 1070 HN2 ILE A 588 20.038 -3.315 30.261 1.00 0.00 H ATOM 1071 HN1 ILE A 588 21.094 -4.601 29.921 1.00 0.00 H ATOM 1072 N PRO A 589 18.173 -2.580 27.356 1.00 61.17 N ATOM 1073 CA PRO A 589 16.825 -2.094 27.024 1.00 60.37 C ATOM 1074 C PRO A 589 16.070 -3.132 26.194 1.00 59.20 C ATOM 1075 O PRO A 589 16.670 -3.795 25.344 1.00 59.56 O ATOM 1076 CB PRO A 589 17.094 -0.840 26.176 1.00 60.31 C ATOM 1077 CG PRO A 589 18.519 -0.462 26.460 1.00 60.98 C ATOM 1078 CD PRO A 589 19.219 -1.764 26.709 1.00 61.22 C ATOM 1079 HA PRO A 589 16.218 -1.897 27.907 1.00 0.00 H ATOM 1080 HD3 PRO A 589 19.549 -2.218 25.774 1.00 0.00 H ATOM 1081 HD2 PRO A 589 20.076 -1.629 27.369 1.00 0.00 H ATOM 1082 HG3 PRO A 589 18.578 0.180 27.339 1.00 0.00 H ATOM 1083 HG2 PRO A 589 18.958 0.053 25.605 1.00 0.00 H ATOM 1084 HB2 PRO A 589 16.962 -1.060 25.117 1.00 0.00 H ATOM 1085 HB3 PRO A 589 16.421 -0.033 26.465 1.00 0.00 H ATOM 1086 N MET A 590 14.773 -3.279 26.448 1.00 57.61 N ATOM 1087 CA MET A 590 13.951 -4.224 25.684 1.00 56.12 C ATOM 1088 C MET A 590 12.712 -3.575 25.091 1.00 54.31 C ATOM 1089 O MET A 590 12.050 -2.773 25.740 1.00 53.85 O ATOM 1090 CB MET A 590 13.542 -5.412 26.555 1.00 56.20 C ATOM 1091 CG MET A 590 14.707 -6.280 26.986 1.00 57.77 C ATOM 1092 SD MET A 590 14.178 -7.763 27.854 1.00 61.02 S ATOM 1093 CE MET A 590 13.176 -7.065 29.165 1.00 57.61 C ATOM 1094 HA MET A 590 14.569 -4.572 24.856 1.00 0.00 H ATOM 1095 HB2 MET A 590 13.048 -5.030 27.448 1.00 0.00 H ATOM 1096 HB3 MET A 590 12.843 -6.029 25.990 1.00 0.00 H ATOM 1097 HG2 MET A 590 15.350 -5.699 27.647 1.00 0.00 H ATOM 1098 HG3 MET A 590 15.270 -6.575 26.100 1.00 0.00 H ATOM 1099 HE1 MET A 590 13.789 -6.402 29.775 1.00 0.00 H ATOM 1100 HE2 MET A 590 12.351 -6.501 28.729 1.00 0.00 H ATOM 1101 HE3 MET A 590 12.780 -7.869 29.785 1.00 0.00 H ATOM 1102 H MET A 590 14.333 -2.714 27.202 1.00 0.00 H ATOM 1103 N VAL A 591 12.403 -3.947 23.854 1.00 52.74 N ATOM 1104 CA VAL A 591 11.201 -3.464 23.170 1.00 51.14 C ATOM 1105 C VAL A 591 10.205 -4.622 23.042 1.00 49.81 C ATOM 1106 O VAL A 591 10.549 -5.679 22.504 1.00 49.62 O ATOM 1107 CB VAL A 591 11.546 -2.879 21.775 1.00 51.40 C ATOM 1108 CG1 VAL A 591 10.325 -2.272 21.141 1.00 51.10 C ATOM 1109 CG2 VAL A 591 12.670 -1.825 21.886 1.00 51.29 C ATOM 1110 HA VAL A 591 10.755 -2.660 23.755 1.00 0.00 H ATOM 1111 HB VAL A 591 11.899 -3.694 21.143 1.00 0.00 H ATOM 1112 HG11 VAL A 591 9.559 -3.038 21.024 1.00 0.00 H ATOM 1113 HG12 VAL A 591 9.947 -1.472 21.777 1.00 0.00 H ATOM 1114 HG13 VAL A 591 10.588 -1.867 20.164 1.00 0.00 H ATOM 1115 HG21 VAL A 591 12.343 -1.014 22.537 1.00 0.00 H ATOM 1116 HG22 VAL A 591 13.563 -2.290 22.304 1.00 0.00 H ATOM 1117 HG23 VAL A 591 12.894 -1.429 20.895 1.00 0.00 H ATOM 1118 H VAL A 591 13.036 -4.604 23.354 1.00 0.00 H ATOM 1119 N ILE A 592 8.994 -4.418 23.557 1.00 48.48 N ATOM 1120 CA ILE A 592 7.949 -5.447 23.573 1.00 47.59 C ATOM 1121 C ILE A 592 6.930 -5.188 22.465 1.00 46.73 C ATOM 1122 O ILE A 592 6.272 -4.142 22.440 1.00 47.01 O ATOM 1123 CB ILE A 592 7.257 -5.558 24.972 1.00 47.98 C ATOM 1124 CG1 ILE A 592 8.230 -6.114 26.023 1.00 48.32 C ATOM 1125 CG2 ILE A 592 6.077 -6.511 24.938 1.00 47.40 C ATOM 1126 CD1 ILE A 592 9.265 -5.136 26.514 1.00 49.81 C ATOM 1127 HA ILE A 592 8.426 -6.409 23.383 1.00 0.00 H ATOM 1128 HB ILE A 592 6.930 -4.550 25.227 1.00 0.00 H ATOM 1129 HG12 ILE A 592 7.647 -6.448 26.881 1.00 0.00 H ATOM 1130 HG13 ILE A 592 8.750 -6.966 25.585 1.00 0.00 H ATOM 1131 HD11 ILE A 592 9.872 -4.799 25.674 1.00 0.00 H ATOM 1132 HD12 ILE A 592 8.767 -4.281 26.971 1.00 0.00 H ATOM 1133 HD13 ILE A 592 9.902 -5.623 27.252 1.00 0.00 H ATOM 1134 HG21 ILE A 592 5.342 -6.152 24.218 1.00 0.00 H ATOM 1135 HG22 ILE A 592 6.421 -7.503 24.644 1.00 0.00 H ATOM 1136 HG23 ILE A 592 5.623 -6.561 25.928 1.00 0.00 H ATOM 1137 H ILE A 592 8.779 -3.486 23.967 1.00 0.00 H ATOM 1138 N LEU A 593 6.820 -6.155 21.554 1.00 45.20 N ATOM 1139 CA LEU A 593 6.083 -6.013 20.297 1.00 43.84 C ATOM 1140 C LEU A 593 5.074 -7.152 20.111 1.00 42.81 C ATOM 1141 O LEU A 593 5.330 -8.268 20.575 1.00 42.69 O ATOM 1142 CB LEU A 593 7.055 -6.102 19.113 1.00 43.45 C ATOM 1143 CG LEU A 593 8.075 -5.071 18.624 1.00 44.35 C ATOM 1144 CD1 LEU A 593 7.710 -3.638 19.001 1.00 43.38 C ATOM 1145 CD2 LEU A 593 9.476 -5.456 19.053 1.00 43.60 C ATOM 1146 HA LEU A 593 5.571 -5.052 20.334 1.00 0.00 H ATOM 1147 HB2 LEU A 593 7.647 -6.994 19.315 1.00 0.00 H ATOM 1148 HB3 LEU A 593 6.414 -6.280 18.249 1.00 0.00 H ATOM 1149 HG LEU A 593 8.050 -5.085 17.534 1.00 0.00 H ATOM 1150 HD21 LEU A 593 9.520 -5.507 20.141 1.00 0.00 H ATOM 1151 HD22 LEU A 593 9.729 -6.429 18.632 1.00 0.00 H ATOM 1152 HD23 LEU A 593 10.183 -4.708 18.694 1.00 0.00 H ATOM 1153 HD11 LEU A 593 6.746 -3.382 18.561 1.00 0.00 H ATOM 1154 HD12 LEU A 593 7.650 -3.553 20.086 1.00 0.00 H ATOM 1155 HD13 LEU A 593 8.474 -2.959 18.624 1.00 0.00 H ATOM 1156 H LEU A 593 7.286 -7.065 21.748 1.00 0.00 H ATOM 1157 N PRO A 594 3.965 -6.900 19.376 1.00 41.66 N ATOM 1158 CA PRO A 594 3.045 -8.022 19.110 1.00 40.97 C ATOM 1159 C PRO A 594 3.737 -9.077 18.255 1.00 40.18 C ATOM 1160 O PRO A 594 4.523 -8.724 17.360 1.00 39.60 O ATOM 1161 CB PRO A 594 1.874 -7.382 18.356 1.00 40.94 C ATOM 1162 CG PRO A 594 2.149 -5.886 18.302 1.00 42.41 C ATOM 1163 CD PRO A 594 3.613 -5.689 18.615 1.00 41.72 C ATOM 1164 HA PRO A 594 2.718 -8.528 20.019 1.00 0.00 H ATOM 1165 HD3 PRO A 594 4.202 -5.618 17.700 1.00 0.00 H ATOM 1166 HD2 PRO A 594 3.767 -4.792 19.215 1.00 0.00 H ATOM 1167 HG3 PRO A 594 1.536 -5.367 19.039 1.00 0.00 H ATOM 1168 HG2 PRO A 594 1.924 -5.500 17.308 1.00 0.00 H ATOM 1169 HB2 PRO A 594 1.810 -7.789 17.347 1.00 0.00 H ATOM 1170 HB3 PRO A 594 0.939 -7.573 18.883 1.00 0.00 H ATOM 1171 N PHE A 595 3.494 -10.356 18.553 1.00 39.08 N ATOM 1172 CA PHE A 595 4.136 -11.421 17.797 1.00 38.61 C ATOM 1173 C PHE A 595 3.451 -11.545 16.442 1.00 37.52 C ATOM 1174 O PHE A 595 2.245 -11.772 16.372 1.00 37.91 O ATOM 1175 CB PHE A 595 4.145 -12.779 18.530 1.00 38.64 C ATOM 1176 CG PHE A 595 4.854 -13.871 17.756 1.00 39.78 C ATOM 1177 CD1 PHE A 595 6.243 -13.872 17.633 1.00 39.91 C ATOM 1178 CD2 PHE A 595 4.132 -14.883 17.131 1.00 40.35 C ATOM 1179 CE1 PHE A 595 6.899 -14.866 16.904 1.00 41.26 C ATOM 1180 CE2 PHE A 595 4.777 -15.889 16.404 1.00 39.80 C ATOM 1181 CZ PHE A 595 6.159 -15.882 16.285 1.00 40.75 C ATOM 1182 HA PHE A 595 5.184 -11.149 17.673 1.00 0.00 H ATOM 1183 HB2 PHE A 595 4.647 -12.652 19.489 1.00 0.00 H ATOM 1184 HB3 PHE A 595 3.114 -13.088 18.700 1.00 0.00 H ATOM 1185 HD2 PHE A 595 3.045 -14.892 17.209 1.00 0.00 H ATOM 1186 HE2 PHE A 595 4.193 -16.679 15.931 1.00 0.00 H ATOM 1187 HZ PHE A 595 6.665 -16.661 15.714 1.00 0.00 H ATOM 1188 HE1 PHE A 595 7.985 -14.852 16.817 1.00 0.00 H ATOM 1189 HD1 PHE A 595 6.825 -13.085 18.113 1.00 0.00 H ATOM 1190 H PHE A 595 2.843 -10.592 19.329 1.00 0.00 H ATOM 1191 N MET A 596 4.220 -11.373 15.375 1.00 35.78 N ATOM 1192 CA MET A 596 3.669 -11.476 14.034 1.00 34.82 C ATOM 1193 C MET A 596 4.251 -12.695 13.350 1.00 34.23 C ATOM 1194 O MET A 596 5.380 -12.662 12.836 1.00 34.49 O ATOM 1195 CB MET A 596 3.934 -10.188 13.250 1.00 34.38 C ATOM 1196 CG MET A 596 3.349 -8.953 13.940 1.00 35.66 C ATOM 1197 SD MET A 596 3.791 -7.379 13.120 1.00 35.35 S ATOM 1198 CE MET A 596 2.858 -7.637 11.620 1.00 32.24 C ATOM 1199 HA MET A 596 2.587 -11.600 14.082 1.00 0.00 H ATOM 1200 HB2 MET A 596 5.011 -10.055 13.148 1.00 0.00 H ATOM 1201 HB3 MET A 596 3.486 -10.282 12.261 1.00 0.00 H ATOM 1202 HG2 MET A 596 3.718 -8.923 14.965 1.00 0.00 H ATOM 1203 HG3 MET A 596 2.263 -9.045 13.948 1.00 0.00 H ATOM 1204 HE1 MET A 596 3.217 -8.537 11.121 1.00 0.00 H ATOM 1205 HE2 MET A 596 1.802 -7.752 11.866 1.00 0.00 H ATOM 1206 HE3 MET A 596 2.987 -6.779 10.961 1.00 0.00 H ATOM 1207 H MET A 596 5.231 -11.162 15.500 1.00 0.00 H ATOM 1208 N LYS A 597 3.469 -13.778 13.346 1.00 33.75 N ATOM 1209 CA LYS A 597 3.958 -15.087 12.903 1.00 33.84 C ATOM 1210 C LYS A 597 4.434 -15.146 11.461 1.00 32.87 C ATOM 1211 O LYS A 597 5.342 -15.910 11.152 1.00 33.25 O ATOM 1212 CB LYS A 597 2.897 -16.173 13.155 1.00 34.39 C ATOM 1213 CG LYS A 597 1.609 -15.946 12.399 1.00 37.73 C ATOM 1214 CD LYS A 597 0.531 -16.918 12.909 1.00 43.95 C ATOM 1215 CE LYS A 597 -0.755 -16.721 12.135 1.00 44.81 C ATOM 1216 NZ LYS A 597 -1.690 -17.820 12.445 1.00 49.41 N ATOM 1217 HA LYS A 597 4.846 -15.273 13.507 1.00 0.00 H ATOM 1218 HB2 LYS A 597 3.310 -17.135 12.852 1.00 0.00 H ATOM 1219 HB3 LYS A 597 2.672 -16.195 14.221 1.00 0.00 H ATOM 1220 HG2 LYS A 597 1.274 -14.920 12.552 1.00 0.00 H ATOM 1221 HG3 LYS A 597 1.778 -16.117 11.336 1.00 0.00 H ATOM 1222 HD2 LYS A 597 0.878 -17.943 12.778 1.00 0.00 H ATOM 1223 HD3 LYS A 597 0.348 -16.731 13.967 1.00 0.00 H ATOM 1224 HE2 LYS A 597 -0.539 -16.718 11.067 1.00 0.00 H ATOM 1225 HE3 LYS A 597 -1.206 -15.770 12.416 1.00 0.00 H ATOM 1226 HZ1 LYS A 597 -1.258 -18.727 12.176 1.00 0.00 H ATOM 1227 HZ2 LYS A 597 -1.895 -17.822 13.465 1.00 0.00 H ATOM 1228 HZ3 LYS A 597 -2.573 -17.683 11.912 1.00 0.00 H ATOM 1229 H LYS A 597 2.484 -13.690 13.667 1.00 0.00 H ATOM 1230 N HIS A 598 3.837 -14.349 10.575 1.00 32.22 N ATOM 1231 CA HIS A 598 4.234 -14.351 9.165 1.00 31.89 C ATOM 1232 C HIS A 598 5.624 -13.765 8.887 1.00 31.23 C ATOM 1233 O HIS A 598 6.107 -13.845 7.760 1.00 31.49 O ATOM 1234 CB HIS A 598 3.168 -13.699 8.280 1.00 31.25 C ATOM 1235 CG HIS A 598 1.868 -14.437 8.295 1.00 34.22 C ATOM 1236 ND1 HIS A 598 0.644 -13.798 8.335 1.00 33.58 N ATOM 1237 CD2 HIS A 598 1.608 -15.767 8.343 1.00 33.59 C ATOM 1238 CE1 HIS A 598 -0.315 -14.709 8.360 1.00 37.38 C ATOM 1239 NE2 HIS A 598 0.245 -15.909 8.379 1.00 34.54 N ATOM 1240 HA HIS A 598 4.313 -15.405 8.900 1.00 0.00 H ATOM 1241 HB2 HIS A 598 2.995 -12.683 8.634 1.00 0.00 H ATOM 1242 HB3 HIS A 598 3.538 -13.667 7.255 1.00 0.00 H ATOM 1243 HD2 HIS A 598 2.344 -16.571 8.351 1.00 0.00 H ATOM 1244 HE1 HIS A 598 -1.386 -14.506 8.364 1.00 0.00 H ATOM 1245 H HIS A 598 3.076 -13.714 10.890 1.00 0.00 H ATOM 1246 N GLY A 599 6.248 -13.205 9.922 1.00 30.38 N ATOM 1247 CA GLY A 599 7.566 -12.566 9.813 1.00 29.82 C ATOM 1248 C GLY A 599 7.652 -11.343 8.897 1.00 29.02 C ATOM 1249 O GLY A 599 6.633 -10.702 8.558 1.00 28.67 O ATOM 1250 HA3 GLY A 599 8.267 -13.312 9.439 1.00 0.00 H ATOM 1251 HA2 GLY A 599 7.868 -12.255 10.813 1.00 0.00 H ATOM 1252 H GLY A 599 5.780 -13.221 10.851 1.00 0.00 H ATOM 1253 N ASP A 600 8.874 -11.036 8.471 1.00 26.99 N ATOM 1254 CA ASP A 600 9.123 -9.835 7.674 1.00 24.90 C ATOM 1255 C ASP A 600 8.972 -10.031 6.179 1.00 23.83 C ATOM 1256 O ASP A 600 9.058 -11.163 5.649 1.00 23.34 O ATOM 1257 CB ASP A 600 10.479 -9.164 8.055 1.00 25.11 C ATOM 1258 CG ASP A 600 11.711 -9.890 7.473 1.00 25.75 C ATOM 1259 OD1 ASP A 600 11.926 -9.861 6.264 1.00 27.99 O ATOM 1260 OD2 ASP A 600 12.477 -10.495 8.226 1.00 30.64 O ATOM 1261 HA ASP A 600 8.324 -9.142 7.937 1.00 0.00 H ATOM 1262 HB2 ASP A 600 10.474 -8.140 7.682 1.00 0.00 H ATOM 1263 HB3 ASP A 600 10.566 -9.154 9.141 1.00 0.00 H ATOM 1264 H ASP A 600 9.669 -11.663 8.709 1.00 0.00 H ATOM 1265 N LEU A 601 8.741 -8.915 5.496 1.00 21.80 N ATOM 1266 CA LEU A 601 8.521 -8.905 4.077 1.00 22.24 C ATOM 1267 C LEU A 601 9.721 -9.375 3.249 1.00 22.18 C ATOM 1268 O LEU A 601 9.546 -9.987 2.186 1.00 22.28 O ATOM 1269 CB LEU A 601 8.070 -7.518 3.612 1.00 21.24 C ATOM 1270 CG LEU A 601 7.713 -7.336 2.155 1.00 22.39 C ATOM 1271 CD1 LEU A 601 6.581 -8.302 1.729 1.00 26.52 C ATOM 1272 CD2 LEU A 601 7.368 -5.842 1.780 1.00 20.60 C ATOM 1273 HA LEU A 601 7.731 -9.634 3.900 1.00 0.00 H ATOM 1274 HB2 LEU A 601 7.190 -7.251 4.197 1.00 0.00 H ATOM 1275 HB3 LEU A 601 8.879 -6.822 3.837 1.00 0.00 H ATOM 1276 HG LEU A 601 8.609 -7.590 1.588 1.00 0.00 H ATOM 1277 HD21 LEU A 601 6.516 -5.508 2.372 1.00 0.00 H ATOM 1278 HD22 LEU A 601 8.229 -5.208 1.990 1.00 0.00 H ATOM 1279 HD23 LEU A 601 7.121 -5.783 0.720 1.00 0.00 H ATOM 1280 HD11 LEU A 601 6.907 -9.331 1.881 1.00 0.00 H ATOM 1281 HD12 LEU A 601 5.693 -8.108 2.331 1.00 0.00 H ATOM 1282 HD13 LEU A 601 6.348 -8.145 0.676 1.00 0.00 H ATOM 1283 H LEU A 601 8.719 -8.011 6.010 1.00 0.00 H ATOM 1284 N HIS A 602 10.935 -9.062 3.684 1.00 22.22 N ATOM 1285 CA HIS A 602 12.089 -9.502 2.861 1.00 23.32 C ATOM 1286 C HIS A 602 12.174 -11.054 2.776 1.00 22.73 C ATOM 1287 O HIS A 602 12.282 -11.634 1.716 1.00 22.19 O ATOM 1288 CB HIS A 602 13.417 -8.925 3.407 1.00 22.82 C ATOM 1289 CG HIS A 602 14.599 -9.278 2.557 1.00 26.26 C ATOM 1290 ND1 HIS A 602 15.469 -10.306 2.872 1.00 28.46 N ATOM 1291 CD2 HIS A 602 15.034 -8.765 1.384 1.00 29.24 C ATOM 1292 CE1 HIS A 602 16.386 -10.407 1.925 1.00 28.31 C ATOM 1293 NE2 HIS A 602 16.150 -9.481 1.015 1.00 29.66 N ATOM 1294 HA HIS A 602 11.929 -9.115 1.854 1.00 0.00 H ATOM 1295 HB2 HIS A 602 13.332 -7.839 3.452 1.00 0.00 H ATOM 1296 HB3 HIS A 602 13.580 -9.317 4.411 1.00 0.00 H ATOM 1297 HD2 HIS A 602 14.585 -7.939 0.833 1.00 0.00 H ATOM 1298 HE1 HIS A 602 17.199 -11.132 1.900 1.00 0.00 H ATOM 1299 H HIS A 602 11.072 -8.529 4.567 1.00 0.00 H ATOM 1300 N ALA A 603 12.101 -11.690 3.922 1.00 23.70 N ATOM 1301 CA ALA A 603 12.099 -13.155 4.021 1.00 25.06 C ATOM 1302 C ALA A 603 10.970 -13.796 3.179 1.00 25.66 C ATOM 1303 O ALA A 603 11.172 -14.838 2.523 1.00 26.34 O ATOM 1304 CB ALA A 603 12.024 -13.558 5.507 1.00 25.69 C ATOM 1305 HA ALA A 603 13.028 -13.540 3.600 1.00 0.00 H ATOM 1306 HB1 ALA A 603 12.888 -13.155 6.036 1.00 0.00 H ATOM 1307 HB2 ALA A 603 11.109 -13.158 5.945 1.00 0.00 H ATOM 1308 HB3 ALA A 603 12.022 -14.645 5.588 1.00 0.00 H ATOM 1309 H ALA A 603 12.042 -11.132 4.798 1.00 0.00 H ATOM 1310 N PHE A 604 9.823 -13.119 3.092 1.00 25.56 N ATOM 1311 CA PHE A 604 8.660 -13.598 2.339 1.00 24.70 C ATOM 1312 C PHE A 604 8.915 -13.492 0.831 1.00 24.95 C ATOM 1313 O PHE A 604 8.660 -14.424 0.070 1.00 24.11 O ATOM 1314 CB PHE A 604 7.428 -12.764 2.730 1.00 25.72 C ATOM 1315 CG PHE A 604 6.213 -13.124 1.958 1.00 26.48 C ATOM 1316 CD1 PHE A 604 5.837 -12.373 0.858 1.00 27.79 C ATOM 1317 CD2 PHE A 604 5.478 -14.269 2.300 1.00 28.76 C ATOM 1318 CE1 PHE A 604 4.719 -12.692 0.119 1.00 30.29 C ATOM 1319 CE2 PHE A 604 4.341 -14.622 1.552 1.00 28.48 C ATOM 1320 CZ PHE A 604 3.961 -13.829 0.468 1.00 30.09 C ATOM 1321 HA PHE A 604 8.483 -14.646 2.580 1.00 0.00 H ATOM 1322 HB2 PHE A 604 7.225 -12.920 3.790 1.00 0.00 H ATOM 1323 HB3 PHE A 604 7.651 -11.712 2.555 1.00 0.00 H ATOM 1324 HD2 PHE A 604 5.788 -14.884 3.145 1.00 0.00 H ATOM 1325 HE2 PHE A 604 3.762 -15.507 1.816 1.00 0.00 H ATOM 1326 HZ PHE A 604 3.075 -14.089 -0.111 1.00 0.00 H ATOM 1327 HE1 PHE A 604 4.423 -12.072 -0.727 1.00 0.00 H ATOM 1328 HD1 PHE A 604 6.438 -11.511 0.570 1.00 0.00 H ATOM 1329 H PHE A 604 9.751 -12.205 3.583 1.00 0.00 H ATOM 1330 N LEU A 605 9.475 -12.364 0.407 1.00 24.75 N ATOM 1331 CA LEU A 605 9.792 -12.157 -0.996 1.00 27.10 C ATOM 1332 C LEU A 605 10.821 -13.200 -1.448 1.00 28.83 C ATOM 1333 O LEU A 605 10.717 -13.752 -2.574 1.00 28.85 O ATOM 1334 CB LEU A 605 10.322 -10.746 -1.220 1.00 26.71 C ATOM 1335 CG LEU A 605 9.385 -9.545 -0.974 1.00 28.38 C ATOM 1336 CD1 LEU A 605 10.231 -8.235 -0.900 1.00 23.17 C ATOM 1337 CD2 LEU A 605 8.276 -9.412 -2.047 1.00 26.10 C ATOM 1338 HA LEU A 605 8.885 -12.274 -1.589 1.00 0.00 H ATOM 1339 HB2 LEU A 605 11.182 -10.620 -0.562 1.00 0.00 H ATOM 1340 HB3 LEU A 605 10.649 -10.689 -2.258 1.00 0.00 H ATOM 1341 HG LEU A 605 8.875 -9.718 -0.026 1.00 0.00 H ATOM 1342 HD21 LEU A 605 8.734 -9.279 -3.027 1.00 0.00 H ATOM 1343 HD22 LEU A 605 7.665 -10.314 -2.050 1.00 0.00 H ATOM 1344 HD23 LEU A 605 7.651 -8.549 -1.817 1.00 0.00 H ATOM 1345 HD11 LEU A 605 10.947 -8.312 -0.082 1.00 0.00 H ATOM 1346 HD12 LEU A 605 10.765 -8.095 -1.840 1.00 0.00 H ATOM 1347 HD13 LEU A 605 9.570 -7.386 -0.726 1.00 0.00 H ATOM 1348 H LEU A 605 9.691 -11.613 1.094 1.00 0.00 H ATOM 1349 N LEU A 606 11.801 -13.449 -0.571 1.00 30.43 N ATOM 1350 CA LEU A 606 12.848 -14.452 -0.834 1.00 33.36 C ATOM 1351 C LEU A 606 12.195 -15.828 -0.974 1.00 34.69 C ATOM 1352 O LEU A 606 12.440 -16.528 -1.951 1.00 35.18 O ATOM 1353 CB LEU A 606 13.866 -14.465 0.302 1.00 32.77 C ATOM 1354 CG LEU A 606 15.291 -14.288 -0.227 1.00 36.99 C ATOM 1355 CD1 LEU A 606 15.334 -12.975 -1.013 1.00 37.72 C ATOM 1356 CD2 LEU A 606 16.281 -14.263 0.907 1.00 36.81 C ATOM 1357 HA LEU A 606 13.370 -14.199 -1.757 1.00 0.00 H ATOM 1358 HB2 LEU A 606 13.639 -13.652 0.992 1.00 0.00 H ATOM 1359 HB3 LEU A 606 13.798 -15.417 0.829 1.00 0.00 H ATOM 1360 HG LEU A 606 15.562 -15.124 -0.872 1.00 0.00 H ATOM 1361 HD21 LEU A 606 16.047 -13.433 1.574 1.00 0.00 H ATOM 1362 HD22 LEU A 606 16.224 -15.201 1.459 1.00 0.00 H ATOM 1363 HD23 LEU A 606 17.287 -14.136 0.507 1.00 0.00 H ATOM 1364 HD11 LEU A 606 14.625 -13.024 -1.839 1.00 0.00 H ATOM 1365 HD12 LEU A 606 15.068 -12.149 -0.353 1.00 0.00 H ATOM 1366 HD13 LEU A 606 16.340 -12.820 -1.404 1.00 0.00 H ATOM 1367 H LEU A 606 11.824 -12.918 0.323 1.00 0.00 H ATOM 1368 N ALA A 607 11.334 -16.169 -0.013 1.00 36.10 N ATOM 1369 CA ALA A 607 10.603 -17.446 -0.013 1.00 38.67 C ATOM 1370 C ALA A 607 9.677 -17.647 -1.210 1.00 40.38 C ATOM 1371 O ALA A 607 9.357 -18.778 -1.554 1.00 41.81 O ATOM 1372 CB ALA A 607 9.852 -17.659 1.318 1.00 37.50 C ATOM 1373 HA ALA A 607 11.369 -18.215 -0.114 1.00 0.00 H ATOM 1374 HB1 ALA A 607 10.568 -17.667 2.140 1.00 0.00 H ATOM 1375 HB2 ALA A 607 9.138 -16.849 1.464 1.00 0.00 H ATOM 1376 HB3 ALA A 607 9.322 -18.611 1.286 1.00 0.00 H ATOM 1377 H ALA A 607 11.173 -15.503 0.770 1.00 0.00 H ATOM 1378 N SER A 608 9.254 -16.577 -1.863 1.00 42.60 N ATOM 1379 CA SER A 608 8.588 -16.747 -3.146 1.00 45.10 C ATOM 1380 C SER A 608 9.555 -17.274 -4.245 1.00 46.65 C ATOM 1381 O SER A 608 9.177 -18.150 -5.059 1.00 46.26 O ATOM 1382 CB SER A 608 7.897 -15.457 -3.573 1.00 44.91 C ATOM 1383 OG SER A 608 8.804 -14.556 -4.169 1.00 48.03 O ATOM 1384 HA SER A 608 7.822 -17.511 -3.017 1.00 0.00 H ATOM 1385 HB2 SER A 608 7.454 -14.985 -2.696 1.00 0.00 H ATOM 1386 HB3 SER A 608 7.112 -15.696 -4.291 1.00 0.00 H ATOM 1387 HG SER A 608 9.517 -14.330 -3.520 1.00 0.00 H ATOM 1388 H SER A 608 9.396 -15.627 -1.465 1.00 0.00 H ATOM 1389 N ARG A 609 10.789 -16.755 -4.237 1.00 47.18 N ATOM 1390 CA ARG A 609 11.808 -17.053 -5.267 1.00 49.16 C ATOM 1391 C ARG A 609 12.539 -18.375 -5.059 1.00 49.99 C ATOM 1392 O ARG A 609 12.750 -19.130 -6.017 1.00 51.38 O ATOM 1393 CB ARG A 609 12.845 -15.918 -5.340 1.00 49.14 C ATOM 1394 CG ARG A 609 12.542 -14.855 -6.371 1.00 47.70 C ATOM 1395 CD ARG A 609 13.791 -14.020 -6.734 1.00 43.24 C ATOM 1396 NE ARG A 609 14.403 -13.363 -5.575 1.00 39.22 N ATOM 1397 CZ ARG A 609 15.653 -13.566 -5.156 1.00 39.60 C ATOM 1398 NH1 ARG A 609 16.463 -14.410 -5.802 1.00 36.45 N ATOM 1399 NH2 ARG A 609 16.098 -12.927 -4.081 1.00 37.39 N ATOM 1400 HA ARG A 609 11.255 -17.139 -6.202 1.00 0.00 H ATOM 1401 HB2 ARG A 609 12.895 -15.439 -4.362 1.00 0.00 H ATOM 1402 HB3 ARG A 609 13.814 -16.357 -5.578 1.00 0.00 H ATOM 1403 HG2 ARG A 609 12.168 -15.338 -7.274 1.00 0.00 H ATOM 1404 HG3 ARG A 609 11.777 -14.188 -5.973 1.00 0.00 H ATOM 1405 HD2 ARG A 609 13.499 -13.254 -7.453 1.00 0.00 H ATOM 1406 HD3 ARG A 609 14.530 -14.680 -7.188 1.00 0.00 H ATOM 1407 HE ARG A 609 13.819 -12.689 -5.040 1.00 0.00 H ATOM 1408 HH12 ARG A 609 17.435 -14.559 -5.464 1.00 0.00 H ATOM 1409 HH11 ARG A 609 16.121 -14.918 -6.643 1.00 0.00 H ATOM 1410 HH22 ARG A 609 17.072 -13.082 -3.750 1.00 0.00 H ATOM 1411 HH21 ARG A 609 15.473 -12.272 -3.570 1.00 0.00 H ATOM 1412 H ARG A 609 11.045 -16.107 -3.465 1.00 0.00 H ATOM 1413 N ILE A 610 12.933 -18.651 -3.816 1.00 50.58 N ATOM 1414 CA ILE A 610 13.649 -19.877 -3.459 1.00 51.24 C ATOM 1415 C ILE A 610 12.968 -20.564 -2.274 1.00 51.60 C ATOM 1416 O ILE A 610 12.247 -21.545 -2.432 1.00 52.69 O ATOM 1417 CB ILE A 610 15.129 -19.574 -3.060 1.00 51.06 C ATOM 1418 CG1 ILE A 610 15.182 -18.874 -1.693 1.00 50.96 C ATOM 1419 CG2 ILE A 610 15.837 -18.749 -4.154 1.00 52.14 C ATOM 1420 CD1 ILE A 610 16.581 -18.415 -1.225 1.00 49.00 C ATOM 1421 HA ILE A 610 13.635 -20.526 -4.335 1.00 0.00 H ATOM 1422 HB ILE A 610 15.667 -20.518 -2.971 1.00 0.00 H ATOM 1423 HG12 ILE A 610 14.541 -17.994 -1.743 1.00 0.00 H ATOM 1424 HG13 ILE A 610 14.790 -19.566 -0.947 1.00 0.00 H ATOM 1425 HD11 ILE A 610 17.240 -19.280 -1.150 1.00 0.00 H ATOM 1426 HD12 ILE A 610 16.990 -17.707 -1.946 1.00 0.00 H ATOM 1427 HD13 ILE A 610 16.497 -17.935 -0.250 1.00 0.00 H ATOM 1428 HG21 ILE A 610 15.834 -19.309 -5.089 1.00 0.00 H ATOM 1429 HG22 ILE A 610 15.311 -17.805 -4.293 1.00 0.00 H ATOM 1430 HG23 ILE A 610 16.865 -18.552 -3.851 1.00 0.00 H ATOM 1431 H ILE A 610 12.722 -17.963 -3.065 1.00 0.00 H TER 1432 ILE A 610 ATOM 1433 N PRO A 614 8.028 -22.734 -4.061 1.00 48.79 N ATOM 1434 CA PRO A 614 8.281 -21.345 -4.424 1.00 49.28 C ATOM 1435 C PRO A 614 6.972 -20.678 -4.818 1.00 49.89 C ATOM 1436 O PRO A 614 6.477 -20.901 -5.918 1.00 49.10 O ATOM 1437 CB PRO A 614 9.215 -21.451 -5.644 1.00 49.15 C ATOM 1438 CG PRO A 614 9.085 -22.828 -6.129 1.00 49.08 C ATOM 1439 CD PRO A 614 8.779 -23.667 -4.916 1.00 49.54 C ATOM 1440 HA PRO A 614 8.713 -20.756 -3.614 1.00 0.00 H ATOM 1441 HD3 PRO A 614 8.173 -24.534 -5.180 1.00 0.00 H ATOM 1442 HD2 PRO A 614 9.694 -24.000 -4.426 1.00 0.00 H ATOM 1443 HG3 PRO A 614 10.015 -23.156 -6.592 1.00 0.00 H ATOM 1444 HG2 PRO A 614 8.274 -22.900 -6.854 1.00 0.00 H ATOM 1445 HB2 PRO A 614 8.911 -20.746 -6.417 1.00 0.00 H ATOM 1446 HB3 PRO A 614 10.245 -21.247 -5.352 1.00 0.00 H ATOM 1447 N PHE A 615 6.399 -19.886 -3.922 1.00 50.71 N ATOM 1448 CA PHE A 615 5.064 -19.357 -4.210 1.00 51.41 C ATOM 1449 C PHE A 615 4.995 -18.241 -5.235 1.00 50.72 C ATOM 1450 O PHE A 615 5.970 -17.493 -5.469 1.00 50.29 O ATOM 1451 CB PHE A 615 4.260 -19.033 -2.951 1.00 51.98 C ATOM 1452 CG PHE A 615 5.004 -18.296 -1.900 1.00 53.67 C ATOM 1453 CD1 PHE A 615 5.083 -16.920 -1.936 1.00 54.29 C ATOM 1454 CD2 PHE A 615 5.554 -18.976 -0.824 1.00 55.78 C ATOM 1455 CE1 PHE A 615 5.750 -16.236 -0.949 1.00 56.06 C ATOM 1456 CE2 PHE A 615 6.226 -18.293 0.182 1.00 55.99 C ATOM 1457 CZ PHE A 615 6.323 -16.923 0.115 1.00 56.48 C ATOM 1458 HA PHE A 615 4.577 -20.198 -4.704 1.00 0.00 H ATOM 1459 HB2 PHE A 615 3.402 -18.428 -3.245 1.00 0.00 H ATOM 1460 HB3 PHE A 615 3.911 -19.972 -2.522 1.00 0.00 H ATOM 1461 HD2 PHE A 615 5.458 -20.060 -0.767 1.00 0.00 H ATOM 1462 HE2 PHE A 615 6.671 -18.837 1.015 1.00 0.00 H ATOM 1463 HZ PHE A 615 6.850 -16.375 0.897 1.00 0.00 H ATOM 1464 HE1 PHE A 615 5.830 -15.150 -1.000 1.00 0.00 H ATOM 1465 HD1 PHE A 615 4.613 -16.372 -2.753 1.00 0.00 H ATOM 1466 H PHE A 615 6.886 -19.646 -3.035 1.00 0.00 H ATOM 1467 N ASN A 616 3.850 -18.147 -5.894 1.00 50.01 N ATOM 1468 CA ASN A 616 3.705 -17.028 -6.779 1.00 50.01 C ATOM 1469 C ASN A 616 2.558 -16.072 -6.505 1.00 49.18 C ATOM 1470 O ASN A 616 1.395 -16.470 -6.282 1.00 48.72 O ATOM 1471 CB ASN A 616 3.909 -17.378 -8.257 1.00 50.65 C ATOM 1472 CG ASN A 616 4.726 -16.311 -8.991 1.00 51.89 C ATOM 1473 OD1 ASN A 616 5.755 -16.610 -9.602 1.00 51.42 O ATOM 1474 ND2 ASN A 616 4.278 -15.048 -8.905 1.00 53.52 N ATOM 1475 HA ASN A 616 4.559 -16.408 -6.506 1.00 0.00 H ATOM 1476 HB2 ASN A 616 4.433 -18.331 -8.324 1.00 0.00 H ATOM 1477 HB3 ASN A 616 2.934 -17.466 -8.736 1.00 0.00 H ATOM 1478 HD22 ASN A 616 3.405 -14.841 -8.379 1.00 0.00 H ATOM 1479 HD21 ASN A 616 4.804 -14.277 -9.364 1.00 0.00 H ATOM 1480 H ASN A 616 3.093 -18.850 -5.775 1.00 0.00 H ATOM 1481 N LEU A 617 2.967 -14.807 -6.504 1.00 48.32 N ATOM 1482 CA LEU A 617 2.181 -13.640 -6.138 1.00 47.51 C ATOM 1483 C LEU A 617 1.951 -12.809 -7.407 1.00 46.99 C ATOM 1484 O LEU A 617 2.903 -12.507 -8.131 1.00 46.23 O ATOM 1485 CB LEU A 617 2.983 -12.799 -5.128 1.00 47.45 C ATOM 1486 CG LEU A 617 4.035 -13.515 -4.260 1.00 46.02 C ATOM 1487 CD1 LEU A 617 5.269 -12.638 -3.973 1.00 44.97 C ATOM 1488 CD2 LEU A 617 3.402 -14.027 -2.981 1.00 43.52 C ATOM 1489 HA LEU A 617 1.230 -13.938 -5.697 1.00 0.00 H ATOM 1490 HB2 LEU A 617 3.502 -12.024 -5.692 1.00 0.00 H ATOM 1491 HB3 LEU A 617 2.266 -12.335 -4.451 1.00 0.00 H ATOM 1492 HG LEU A 617 4.402 -14.368 -4.831 1.00 0.00 H ATOM 1493 HD21 LEU A 617 2.989 -13.188 -2.421 1.00 0.00 H ATOM 1494 HD22 LEU A 617 2.605 -14.729 -3.227 1.00 0.00 H ATOM 1495 HD23 LEU A 617 4.158 -14.530 -2.379 1.00 0.00 H ATOM 1496 HD11 LEU A 617 5.744 -12.363 -4.914 1.00 0.00 H ATOM 1497 HD12 LEU A 617 4.958 -11.737 -3.445 1.00 0.00 H ATOM 1498 HD13 LEU A 617 5.975 -13.196 -3.358 1.00 0.00 H ATOM 1499 H LEU A 617 3.950 -14.634 -6.795 1.00 0.00 H ATOM 1500 N PRO A 618 0.684 -12.437 -7.686 1.00 46.91 N ATOM 1501 CA PRO A 618 0.416 -11.587 -8.867 1.00 46.39 C ATOM 1502 C PRO A 618 1.028 -10.176 -8.736 1.00 46.10 C ATOM 1503 O PRO A 618 1.415 -9.776 -7.635 1.00 45.27 O ATOM 1504 CB PRO A 618 -1.115 -11.519 -8.915 1.00 46.79 C ATOM 1505 CG PRO A 618 -1.584 -11.966 -7.527 1.00 47.25 C ATOM 1506 CD PRO A 618 -0.547 -12.907 -7.031 1.00 46.70 C ATOM 1507 HA PRO A 618 0.864 -11.995 -9.773 1.00 0.00 H ATOM 1508 HD3 PRO A 618 -0.457 -12.852 -5.946 1.00 0.00 H ATOM 1509 HD2 PRO A 618 -0.778 -13.931 -7.324 1.00 0.00 H ATOM 1510 HG3 PRO A 618 -2.550 -12.467 -7.596 1.00 0.00 H ATOM 1511 HG2 PRO A 618 -1.668 -11.108 -6.860 1.00 0.00 H ATOM 1512 HB2 PRO A 618 -1.446 -10.501 -9.121 1.00 0.00 H ATOM 1513 HB3 PRO A 618 -1.503 -12.188 -9.683 1.00 0.00 H ATOM 1514 N LEU A 619 1.128 -9.440 -9.846 1.00 45.45 N ATOM 1515 CA LEU A 619 1.567 -8.043 -9.794 1.00 44.94 C ATOM 1516 C LEU A 619 0.729 -7.256 -8.772 1.00 44.01 C ATOM 1517 O LEU A 619 1.263 -6.384 -8.065 1.00 43.80 O ATOM 1518 CB LEU A 619 1.550 -7.384 -11.190 1.00 45.40 C ATOM 1519 CG LEU A 619 1.872 -5.878 -11.333 1.00 46.56 C ATOM 1520 CD1 LEU A 619 3.348 -5.523 -11.064 1.00 46.68 C ATOM 1521 CD2 LEU A 619 1.445 -5.341 -12.699 1.00 47.46 C ATOM 1522 HA LEU A 619 2.604 -8.025 -9.460 1.00 0.00 H ATOM 1523 HB2 LEU A 619 2.275 -7.921 -11.802 1.00 0.00 H ATOM 1524 HB3 LEU A 619 0.550 -7.533 -11.598 1.00 0.00 H ATOM 1525 HG LEU A 619 1.287 -5.390 -10.553 1.00 0.00 H ATOM 1526 HD21 LEU A 619 1.974 -5.883 -13.483 1.00 0.00 H ATOM 1527 HD22 LEU A 619 0.371 -5.478 -12.822 1.00 0.00 H ATOM 1528 HD23 LEU A 619 1.687 -4.280 -12.763 1.00 0.00 H ATOM 1529 HD11 LEU A 619 3.611 -5.813 -10.047 1.00 0.00 H ATOM 1530 HD12 LEU A 619 3.983 -6.057 -11.771 1.00 0.00 H ATOM 1531 HD13 LEU A 619 3.490 -4.449 -11.185 1.00 0.00 H ATOM 1532 H LEU A 619 0.890 -9.866 -10.764 1.00 0.00 H ATOM 1533 N GLN A 620 -0.555 -7.619 -8.661 1.00 42.48 N ATOM 1534 CA GLN A 620 -1.521 -6.972 -7.771 1.00 41.25 C ATOM 1535 C GLN A 620 -1.086 -7.027 -6.315 1.00 39.33 C ATOM 1536 O GLN A 620 -1.286 -6.080 -5.543 1.00 38.26 O ATOM 1537 CB GLN A 620 -2.910 -7.626 -7.923 1.00 41.81 C ATOM 1538 CG GLN A 620 -3.917 -7.226 -6.844 1.00 44.64 C ATOM 1539 CD GLN A 620 -5.293 -7.892 -6.988 1.00 49.94 C ATOM 1540 OE1 GLN A 620 -6.218 -7.573 -6.236 1.00 51.24 O ATOM 1541 NE2 GLN A 620 -5.426 -8.820 -7.940 1.00 49.41 N ATOM 1542 HA GLN A 620 -1.574 -5.923 -8.063 1.00 0.00 H ATOM 1543 HB2 GLN A 620 -3.317 -7.341 -8.893 1.00 0.00 H ATOM 1544 HB3 GLN A 620 -2.784 -8.708 -7.888 1.00 0.00 H ATOM 1545 HG2 GLN A 620 -3.505 -7.500 -5.873 1.00 0.00 H ATOM 1546 HG3 GLN A 620 -4.054 -6.146 -6.888 1.00 0.00 H ATOM 1547 HE22 GLN A 620 -4.619 -9.057 -8.551 1.00 0.00 H ATOM 1548 HE21 GLN A 620 -6.337 -9.305 -8.070 1.00 0.00 H ATOM 1549 H GLN A 620 -0.888 -8.412 -9.245 1.00 0.00 H ATOM 1550 N THR A 621 -0.508 -8.156 -5.937 1.00 37.41 N ATOM 1551 CA THR A 621 -0.091 -8.368 -4.566 1.00 35.43 C ATOM 1552 C THR A 621 1.147 -7.518 -4.233 1.00 33.95 C ATOM 1553 O THR A 621 1.232 -6.983 -3.145 1.00 33.15 O ATOM 1554 CB THR A 621 0.146 -9.878 -4.285 1.00 36.33 C ATOM 1555 OG1 THR A 621 -1.107 -10.585 -4.393 1.00 37.61 O ATOM 1556 CG2 THR A 621 0.714 -10.102 -2.892 1.00 34.57 C ATOM 1557 HA THR A 621 -0.895 -8.041 -3.907 1.00 0.00 H ATOM 1558 HB THR A 621 0.864 -10.249 -5.017 1.00 0.00 H ATOM 1559 HG1 THR A 621 -0.958 -11.547 -4.214 1.00 0.00 H ATOM 1560 HG23 THR A 621 1.662 -9.572 -2.798 1.00 0.00 H ATOM 1561 HG21 THR A 621 0.011 -9.725 -2.149 1.00 0.00 H ATOM 1562 HG22 THR A 621 0.875 -11.168 -2.734 1.00 0.00 H ATOM 1563 H THR A 621 -0.350 -8.907 -6.639 1.00 0.00 H ATOM 1564 N LEU A 622 2.072 -7.415 -5.186 1.00 32.18 N ATOM 1565 CA LEU A 622 3.314 -6.656 -5.046 1.00 31.92 C ATOM 1566 C LEU A 622 3.031 -5.155 -4.969 1.00 31.00 C ATOM 1567 O LEU A 622 3.607 -4.441 -4.157 1.00 29.03 O ATOM 1568 CB LEU A 622 4.201 -6.929 -6.245 1.00 32.80 C ATOM 1569 CG LEU A 622 4.676 -8.387 -6.349 1.00 33.79 C ATOM 1570 CD1 LEU A 622 5.378 -8.606 -7.647 1.00 35.46 C ATOM 1571 CD2 LEU A 622 5.543 -8.777 -5.173 1.00 35.20 C ATOM 1572 HA LEU A 622 3.809 -6.967 -4.126 1.00 0.00 H ATOM 1573 HB2 LEU A 622 3.642 -6.684 -7.148 1.00 0.00 H ATOM 1574 HB3 LEU A 622 5.078 -6.286 -6.177 1.00 0.00 H ATOM 1575 HG LEU A 622 3.800 -9.035 -6.320 1.00 0.00 H ATOM 1576 HD21 LEU A 622 6.420 -8.131 -5.140 1.00 0.00 H ATOM 1577 HD22 LEU A 622 4.973 -8.666 -4.250 1.00 0.00 H ATOM 1578 HD23 LEU A 622 5.858 -9.814 -5.284 1.00 0.00 H ATOM 1579 HD11 LEU A 622 4.695 -8.392 -8.469 1.00 0.00 H ATOM 1580 HD12 LEU A 622 6.241 -7.943 -7.708 1.00 0.00 H ATOM 1581 HD13 LEU A 622 5.710 -9.642 -7.709 1.00 0.00 H ATOM 1582 H LEU A 622 1.900 -7.906 -6.087 1.00 0.00 H ATOM 1583 N VAL A 623 2.097 -4.696 -5.801 1.00 29.36 N ATOM 1584 CA VAL A 623 1.719 -3.295 -5.761 1.00 29.06 C ATOM 1585 C VAL A 623 0.948 -3.012 -4.471 1.00 28.09 C ATOM 1586 O VAL A 623 1.097 -1.947 -3.871 1.00 28.17 O ATOM 1587 CB VAL A 623 0.943 -2.852 -7.032 1.00 28.26 C ATOM 1588 CG1 VAL A 623 0.320 -1.501 -6.806 1.00 28.80 C ATOM 1589 CG2 VAL A 623 1.874 -2.798 -8.229 1.00 29.68 C ATOM 1590 HA VAL A 623 2.626 -2.691 -5.758 1.00 0.00 H ATOM 1591 HB VAL A 623 0.158 -3.580 -7.234 1.00 0.00 H ATOM 1592 HG11 VAL A 623 -0.370 -1.557 -5.964 1.00 0.00 H ATOM 1593 HG12 VAL A 623 1.102 -0.773 -6.589 1.00 0.00 H ATOM 1594 HG13 VAL A 623 -0.222 -1.198 -7.702 1.00 0.00 H ATOM 1595 HG21 VAL A 623 2.674 -2.083 -8.034 1.00 0.00 H ATOM 1596 HG22 VAL A 623 2.302 -3.786 -8.400 1.00 0.00 H ATOM 1597 HG23 VAL A 623 1.313 -2.486 -9.110 1.00 0.00 H ATOM 1598 H VAL A 623 1.640 -5.340 -6.478 1.00 0.00 H ATOM 1599 N ARG A 624 0.116 -3.950 -4.041 1.00 27.94 N ATOM 1600 CA ARG A 624 -0.566 -3.788 -2.762 1.00 27.41 C ATOM 1601 C ARG A 624 0.396 -3.727 -1.576 1.00 26.17 C ATOM 1602 O ARG A 624 0.179 -2.974 -0.655 1.00 24.79 O ATOM 1603 CB ARG A 624 -1.584 -4.888 -2.530 1.00 28.76 C ATOM 1604 CG ARG A 624 -2.421 -4.668 -1.285 1.00 32.71 C ATOM 1605 CD ARG A 624 -3.744 -5.494 -1.326 1.00 41.74 C ATOM 1606 NE ARG A 624 -4.295 -5.633 -2.683 1.00 47.52 N ATOM 1607 CZ ARG A 624 -5.515 -5.246 -3.073 1.00 50.75 C ATOM 1608 NH1 ARG A 624 -6.372 -4.686 -2.222 1.00 52.47 N ATOM 1609 NH2 ARG A 624 -5.881 -5.428 -4.332 1.00 52.43 N ATOM 1610 HA ARG A 624 -1.079 -2.828 -2.825 1.00 0.00 H ATOM 1611 HB2 ARG A 624 -2.249 -4.934 -3.392 1.00 0.00 H ATOM 1612 HB3 ARG A 624 -1.055 -5.836 -2.430 1.00 0.00 H ATOM 1613 HG2 ARG A 624 -1.842 -4.970 -0.412 1.00 0.00 H ATOM 1614 HG3 ARG A 624 -2.668 -3.609 -1.207 1.00 0.00 H ATOM 1615 HD2 ARG A 624 -4.484 -4.996 -0.700 1.00 0.00 H ATOM 1616 HD3 ARG A 624 -3.545 -6.489 -0.928 1.00 0.00 H ATOM 1617 HE ARG A 624 -3.683 -6.070 -3.402 1.00 0.00 H ATOM 1618 HH12 ARG A 624 -7.315 -4.394 -2.550 1.00 0.00 H ATOM 1619 HH11 ARG A 624 -6.099 -4.541 -1.229 1.00 0.00 H ATOM 1620 HH22 ARG A 624 -6.827 -5.131 -4.647 1.00 0.00 H ATOM 1621 HH21 ARG A 624 -5.223 -5.868 -5.006 1.00 0.00 H ATOM 1622 H ARG A 624 -0.050 -4.801 -4.615 1.00 0.00 H ATOM 1623 N PHE A 625 1.471 -4.505 -1.604 1.00 24.33 N ATOM 1624 CA PHE A 625 2.467 -4.336 -0.525 1.00 23.11 C ATOM 1625 C PHE A 625 2.995 -2.893 -0.500 1.00 21.57 C ATOM 1626 O PHE A 625 3.170 -2.330 0.580 1.00 21.43 O ATOM 1627 CB PHE A 625 3.645 -5.290 -0.700 1.00 22.90 C ATOM 1628 CG PHE A 625 3.326 -6.729 -0.482 1.00 25.28 C ATOM 1629 CD1 PHE A 625 2.347 -7.132 0.440 1.00 25.18 C ATOM 1630 CD2 PHE A 625 4.059 -7.703 -1.159 1.00 27.70 C ATOM 1631 CE1 PHE A 625 2.081 -8.490 0.645 1.00 27.88 C ATOM 1632 CE2 PHE A 625 3.804 -9.067 -0.942 1.00 28.50 C ATOM 1633 CZ PHE A 625 2.807 -9.451 -0.026 1.00 29.09 C ATOM 1634 HA PHE A 625 1.965 -4.563 0.416 1.00 0.00 H ATOM 1635 HB2 PHE A 625 4.024 -5.177 -1.716 1.00 0.00 H ATOM 1636 HB3 PHE A 625 4.421 -5.004 0.010 1.00 0.00 H ATOM 1637 HD2 PHE A 625 4.836 -7.403 -1.862 1.00 0.00 H ATOM 1638 HE2 PHE A 625 4.375 -9.824 -1.480 1.00 0.00 H ATOM 1639 HZ PHE A 625 2.609 -10.508 0.153 1.00 0.00 H ATOM 1640 HE1 PHE A 625 1.296 -8.790 1.339 1.00 0.00 H ATOM 1641 HD1 PHE A 625 1.790 -6.381 1.000 1.00 0.00 H ATOM 1642 H PHE A 625 1.608 -5.208 -2.358 1.00 0.00 H ATOM 1643 N MET A 626 3.210 -2.301 -1.674 1.00 21.61 N ATOM 1644 CA MET A 626 3.749 -0.922 -1.760 1.00 22.28 C ATOM 1645 C MET A 626 2.740 0.084 -1.225 1.00 22.73 C ATOM 1646 O MET A 626 3.112 0.990 -0.501 1.00 22.13 O ATOM 1647 CB MET A 626 4.159 -0.553 -3.180 1.00 22.49 C ATOM 1648 CG MET A 626 5.271 -1.440 -3.792 1.00 24.78 C ATOM 1649 SD MET A 626 5.450 -1.051 -5.518 1.00 29.81 S ATOM 1650 CE MET A 626 6.586 -2.311 -6.022 1.00 28.61 C ATOM 1651 HA MET A 626 4.646 -0.891 -1.141 1.00 0.00 H ATOM 1652 HB2 MET A 626 3.278 -0.628 -3.817 1.00 0.00 H ATOM 1653 HB3 MET A 626 4.514 0.478 -3.173 1.00 0.00 H ATOM 1654 HG2 MET A 626 5.002 -2.490 -3.681 1.00 0.00 H ATOM 1655 HG3 MET A 626 6.213 -1.251 -3.276 1.00 0.00 H ATOM 1656 HE1 MET A 626 7.510 -2.214 -5.453 1.00 0.00 H ATOM 1657 HE2 MET A 626 6.145 -3.291 -5.837 1.00 0.00 H ATOM 1658 HE3 MET A 626 6.799 -2.202 -7.085 1.00 0.00 H ATOM 1659 H MET A 626 2.995 -2.818 -2.550 1.00 0.00 H ATOM 1660 N VAL A 627 1.462 -0.091 -1.572 1.00 23.11 N ATOM 1661 CA VAL A 627 0.399 0.758 -1.036 1.00 23.47 C ATOM 1662 C VAL A 627 0.363 0.712 0.482 1.00 22.26 C ATOM 1663 O VAL A 627 0.297 1.770 1.140 1.00 23.15 O ATOM 1664 CB VAL A 627 -0.997 0.357 -1.600 1.00 23.74 C ATOM 1665 CG1 VAL A 627 -2.111 1.076 -0.827 1.00 23.63 C ATOM 1666 CG2 VAL A 627 -1.076 0.661 -3.056 1.00 23.57 C ATOM 1667 HA VAL A 627 0.625 1.776 -1.353 1.00 0.00 H ATOM 1668 HB VAL A 627 -1.132 -0.717 -1.471 1.00 0.00 H ATOM 1669 HG11 VAL A 627 -2.059 0.798 0.226 1.00 0.00 H ATOM 1670 HG12 VAL A 627 -1.983 2.154 -0.926 1.00 0.00 H ATOM 1671 HG13 VAL A 627 -3.080 0.785 -1.233 1.00 0.00 H ATOM 1672 HG21 VAL A 627 -0.923 1.729 -3.212 1.00 0.00 H ATOM 1673 HG22 VAL A 627 -0.305 0.101 -3.585 1.00 0.00 H ATOM 1674 HG23 VAL A 627 -2.058 0.374 -3.433 1.00 0.00 H ATOM 1675 H VAL A 627 1.217 -0.850 -2.240 1.00 0.00 H ATOM 1676 N ASP A 628 0.412 -0.499 1.040 1.00 21.50 N ATOM 1677 CA ASP A 628 0.400 -0.709 2.491 1.00 20.82 C ATOM 1678 C ASP A 628 1.540 0.079 3.135 1.00 20.56 C ATOM 1679 O ASP A 628 1.341 0.825 4.082 1.00 19.67 O ATOM 1680 CB ASP A 628 0.543 -2.207 2.844 1.00 21.82 C ATOM 1681 CG ASP A 628 -0.772 -2.998 2.664 1.00 26.01 C ATOM 1682 OD1 ASP A 628 -1.781 -2.403 2.222 1.00 22.82 O ATOM 1683 OD2 ASP A 628 -0.764 -4.198 2.959 1.00 25.98 O ATOM 1684 HA ASP A 628 -0.558 -0.358 2.875 1.00 0.00 H ATOM 1685 HB2 ASP A 628 1.304 -2.645 2.198 1.00 0.00 H ATOM 1686 HB3 ASP A 628 0.859 -2.290 3.884 1.00 0.00 H ATOM 1687 H ASP A 628 0.461 -1.331 0.418 1.00 0.00 H ATOM 1688 N ILE A 629 2.743 -0.048 2.573 1.00 19.78 N ATOM 1689 CA ILE A 629 3.914 0.598 3.191 1.00 19.72 C ATOM 1690 C ILE A 629 3.817 2.111 3.072 1.00 19.98 C ATOM 1691 O ILE A 629 4.114 2.824 4.023 1.00 20.83 O ATOM 1692 CB ILE A 629 5.222 0.111 2.566 1.00 18.78 C ATOM 1693 CG1 ILE A 629 5.411 -1.371 2.897 1.00 18.48 C ATOM 1694 CG2 ILE A 629 6.422 0.981 3.125 1.00 17.02 C ATOM 1695 CD1 ILE A 629 6.243 -2.092 1.870 1.00 20.94 C ATOM 1696 HA ILE A 629 3.918 0.321 4.245 1.00 0.00 H ATOM 1697 HB ILE A 629 5.193 0.223 1.482 1.00 0.00 H ATOM 1698 HG12 ILE A 629 5.904 -1.453 3.866 1.00 0.00 H ATOM 1699 HG13 ILE A 629 4.431 -1.845 2.948 1.00 0.00 H ATOM 1700 HD11 ILE A 629 5.756 -2.025 0.897 1.00 0.00 H ATOM 1701 HD12 ILE A 629 7.230 -1.632 1.816 1.00 0.00 H ATOM 1702 HD13 ILE A 629 6.344 -3.139 2.156 1.00 0.00 H ATOM 1703 HG21 ILE A 629 6.261 2.028 2.868 1.00 0.00 H ATOM 1704 HG22 ILE A 629 6.472 0.875 4.209 1.00 0.00 H ATOM 1705 HG23 ILE A 629 7.356 0.637 2.682 1.00 0.00 H ATOM 1706 H ILE A 629 2.854 -0.602 1.700 1.00 0.00 H ATOM 1707 N ALA A 630 3.326 2.566 1.922 1.00 21.12 N ATOM 1708 CA ALA A 630 3.090 3.985 1.679 1.00 23.03 C ATOM 1709 C ALA A 630 2.079 4.601 2.648 1.00 22.59 C ATOM 1710 O ALA A 630 2.311 5.694 3.115 1.00 23.05 O ATOM 1711 CB ALA A 630 2.699 4.227 0.217 1.00 22.13 C ATOM 1712 HA ALA A 630 4.032 4.499 1.871 1.00 0.00 H ATOM 1713 HB1 ALA A 630 3.504 3.887 -0.434 1.00 0.00 H ATOM 1714 HB2 ALA A 630 1.788 3.674 -0.010 1.00 0.00 H ATOM 1715 HB3 ALA A 630 2.528 5.292 0.059 1.00 0.00 H ATOM 1716 H ALA A 630 3.102 1.885 1.169 1.00 0.00 H ATOM 1717 N CYS A 631 0.981 3.895 2.961 1.00 24.63 N ATOM 1718 CA CYS A 631 0.039 4.307 4.039 1.00 23.81 C ATOM 1719 C CYS A 631 0.675 4.462 5.420 1.00 23.60 C ATOM 1720 O CYS A 631 0.420 5.435 6.129 1.00 22.12 O ATOM 1721 CB CYS A 631 -1.169 3.353 4.127 1.00 24.67 C ATOM 1722 SG CYS A 631 -2.157 3.345 2.585 1.00 28.90 S ATOM 1723 HA CYS A 631 -0.293 5.302 3.742 1.00 0.00 H ATOM 1724 HB2 CYS A 631 -1.807 3.670 4.952 1.00 0.00 H ATOM 1725 HB3 CYS A 631 -0.806 2.343 4.317 1.00 0.00 H ATOM 1726 HG CYS A 631 -1.362 2.936 1.533 1.00 0.00 H ATOM 1727 H CYS A 631 0.780 3.024 2.429 1.00 0.00 H ATOM 1728 N GLY A 632 1.489 3.490 5.834 1.00 21.72 N ATOM 1729 CA GLY A 632 2.094 3.557 7.137 1.00 20.52 C ATOM 1730 C GLY A 632 3.108 4.670 7.172 1.00 19.42 C ATOM 1731 O GLY A 632 3.225 5.359 8.174 1.00 21.40 O ATOM 1732 HA3 GLY A 632 2.588 2.610 7.356 1.00 0.00 H ATOM 1733 HA2 GLY A 632 1.324 3.745 7.885 1.00 0.00 H ATOM 1734 H GLY A 632 1.687 2.680 5.212 1.00 0.00 H ATOM 1735 N MET A 633 3.797 4.889 6.059 1.00 19.29 N ATOM 1736 CA MET A 633 4.851 5.919 6.023 1.00 20.05 C ATOM 1737 C MET A 633 4.192 7.308 5.935 1.00 21.71 C ATOM 1738 O MET A 633 4.663 8.275 6.534 1.00 20.53 O ATOM 1739 CB MET A 633 5.767 5.700 4.840 1.00 18.39 C ATOM 1740 CG MET A 633 6.775 4.489 5.008 1.00 20.30 C ATOM 1741 SD MET A 633 7.751 4.563 6.544 1.00 22.39 S ATOM 1742 CE MET A 633 8.627 6.147 6.374 1.00 22.29 C ATOM 1743 HA MET A 633 5.450 5.854 6.931 1.00 0.00 H ATOM 1744 HB2 MET A 633 5.150 5.511 3.961 1.00 0.00 H ATOM 1745 HB3 MET A 633 6.348 6.609 4.686 1.00 0.00 H ATOM 1746 HG2 MET A 633 7.462 4.492 4.162 1.00 0.00 H ATOM 1747 HG3 MET A 633 6.203 3.561 5.007 1.00 0.00 H ATOM 1748 HE1 MET A 633 9.247 6.123 5.478 1.00 0.00 H ATOM 1749 HE2 MET A 633 7.901 6.956 6.293 1.00 0.00 H ATOM 1750 HE3 MET A 633 9.257 6.308 7.249 1.00 0.00 H ATOM 1751 H MET A 633 3.592 4.330 5.206 1.00 0.00 H ATOM 1752 N GLU A 634 3.101 7.391 5.164 1.00 23.39 N ATOM 1753 CA GLU A 634 2.265 8.596 5.164 1.00 25.39 C ATOM 1754 C GLU A 634 1.859 8.992 6.592 1.00 25.32 C ATOM 1755 O GLU A 634 1.997 10.169 7.003 1.00 25.86 O ATOM 1756 CB GLU A 634 1.035 8.397 4.264 1.00 26.12 C ATOM 1757 CG GLU A 634 0.200 9.672 4.096 1.00 31.24 C ATOM 1758 CD GLU A 634 -1.066 9.440 3.262 1.00 34.41 C ATOM 1759 OE1 GLU A 634 -1.383 10.292 2.398 1.00 37.65 O ATOM 1760 OE2 GLU A 634 -1.736 8.410 3.479 1.00 37.25 O ATOM 1761 HA GLU A 634 2.852 9.419 4.756 1.00 0.00 H ATOM 1762 HB2 GLU A 634 1.374 8.072 3.280 1.00 0.00 H ATOM 1763 HB3 GLU A 634 0.404 7.624 4.704 1.00 0.00 H ATOM 1764 HG2 GLU A 634 -0.092 10.031 5.083 1.00 0.00 H ATOM 1765 HG3 GLU A 634 0.811 10.428 3.602 1.00 0.00 H ATOM 1766 H GLU A 634 2.842 6.588 4.555 1.00 0.00 H ATOM 1767 N TYR A 635 1.369 8.021 7.349 1.00 25.43 N ATOM 1768 CA TYR A 635 1.015 8.234 8.755 1.00 26.28 C ATOM 1769 C TYR A 635 2.201 8.712 9.591 1.00 26.95 C ATOM 1770 O TYR A 635 2.090 9.703 10.307 1.00 26.02 O ATOM 1771 CB TYR A 635 0.457 6.963 9.382 1.00 26.58 C ATOM 1772 CG TYR A 635 0.184 7.118 10.863 1.00 29.76 C ATOM 1773 CD1 TYR A 635 -0.969 7.803 11.318 1.00 32.88 C ATOM 1774 CD2 TYR A 635 1.073 6.614 11.812 1.00 29.45 C ATOM 1775 CE1 TYR A 635 -1.228 7.935 12.694 1.00 34.99 C ATOM 1776 CE2 TYR A 635 0.835 6.754 13.178 1.00 33.01 C ATOM 1777 CZ TYR A 635 -0.316 7.412 13.609 1.00 35.05 C ATOM 1778 OH TYR A 635 -0.532 7.535 14.956 1.00 36.19 O ATOM 1779 HA TYR A 635 0.253 9.014 8.756 1.00 0.00 H ATOM 1780 HB3 TYR A 635 1.178 6.158 9.242 1.00 0.00 H ATOM 1781 HB2 TYR A 635 -0.475 6.705 8.880 1.00 0.00 H ATOM 1782 HD2 TYR A 635 1.974 6.099 11.478 1.00 0.00 H ATOM 1783 HE2 TYR A 635 1.543 6.352 13.903 1.00 0.00 H ATOM 1784 HE1 TYR A 635 -2.130 8.440 13.040 1.00 0.00 H ATOM 1785 HD1 TYR A 635 -1.662 8.232 10.595 1.00 0.00 H ATOM 1786 HH TYR A 635 -1.381 8.020 15.110 1.00 0.00 H ATOM 1787 H TYR A 635 1.231 7.078 6.932 1.00 0.00 H ATOM 1788 N LEU A 636 3.334 8.012 9.508 1.00 26.78 N ATOM 1789 CA LEU A 636 4.509 8.428 10.293 1.00 27.87 C ATOM 1790 C LEU A 636 4.968 9.841 9.960 1.00 28.70 C ATOM 1791 O LEU A 636 5.252 10.622 10.869 1.00 28.69 O ATOM 1792 CB LEU A 636 5.666 7.434 10.133 1.00 27.41 C ATOM 1793 CG LEU A 636 5.457 6.044 10.745 1.00 27.37 C ATOM 1794 CD1 LEU A 636 6.645 5.159 10.353 1.00 27.29 C ATOM 1795 CD2 LEU A 636 5.357 6.153 12.247 1.00 26.32 C ATOM 1796 HA LEU A 636 4.194 8.431 11.337 1.00 0.00 H ATOM 1797 HB2 LEU A 636 5.847 7.304 9.066 1.00 0.00 H ATOM 1798 HB3 LEU A 636 6.548 7.873 10.599 1.00 0.00 H ATOM 1799 HG LEU A 636 4.532 5.605 10.373 1.00 0.00 H ATOM 1800 HD21 LEU A 636 6.277 6.585 12.641 1.00 0.00 H ATOM 1801 HD22 LEU A 636 4.513 6.792 12.508 1.00 0.00 H ATOM 1802 HD23 LEU A 636 5.209 5.161 12.673 1.00 0.00 H ATOM 1803 HD11 LEU A 636 6.698 5.085 9.267 1.00 0.00 H ATOM 1804 HD12 LEU A 636 7.566 5.600 10.734 1.00 0.00 H ATOM 1805 HD13 LEU A 636 6.513 4.165 10.780 1.00 0.00 H ATOM 1806 H LEU A 636 3.387 7.176 8.892 1.00 0.00 H ATOM 1807 N SER A 637 5.049 10.165 8.668 1.00 30.23 N ATOM 1808 CA SER A 637 5.500 11.503 8.273 1.00 32.85 C ATOM 1809 C SER A 637 4.480 12.557 8.688 1.00 33.98 C ATOM 1810 O SER A 637 4.868 13.680 9.045 1.00 35.13 O ATOM 1811 CB SER A 637 5.830 11.588 6.781 1.00 33.71 C ATOM 1812 OG SER A 637 4.711 11.191 5.989 1.00 37.16 O ATOM 1813 HA SER A 637 6.431 11.705 8.803 1.00 0.00 H ATOM 1814 HB2 SER A 637 6.673 10.932 6.563 1.00 0.00 H ATOM 1815 HB3 SER A 637 6.097 12.615 6.532 1.00 0.00 H ATOM 1816 HG SER A 637 4.467 10.257 6.209 1.00 0.00 H ATOM 1817 H SER A 637 4.792 9.468 7.940 1.00 0.00 H ATOM 1818 N SER A 638 3.199 12.184 8.696 1.00 33.99 N ATOM 1819 CA SER A 638 2.131 13.082 9.222 1.00 35.50 C ATOM 1820 C SER A 638 2.333 13.419 10.703 1.00 36.08 C ATOM 1821 O SER A 638 1.934 14.498 11.164 1.00 38.11 O ATOM 1822 CB SER A 638 0.732 12.515 8.971 1.00 34.06 C ATOM 1823 OG SER A 638 0.321 11.641 10.016 1.00 34.52 O ATOM 1824 HA SER A 638 2.213 14.015 8.664 1.00 0.00 H ATOM 1825 HB2 SER A 638 0.738 11.963 8.031 1.00 0.00 H ATOM 1826 HB3 SER A 638 0.024 13.340 8.902 1.00 0.00 H ATOM 1827 HG SER A 638 0.957 10.885 10.081 1.00 0.00 H ATOM 1828 H SER A 638 2.940 11.247 8.327 1.00 0.00 H ATOM 1829 N ARG A 639 2.975 12.514 11.433 1.00 35.89 N ATOM 1830 CA ARG A 639 3.339 12.737 12.833 1.00 36.68 C ATOM 1831 C ARG A 639 4.753 13.302 12.981 1.00 36.00 C ATOM 1832 O ARG A 639 5.303 13.280 14.084 1.00 36.86 O ATOM 1833 CB ARG A 639 3.241 11.412 13.626 1.00 37.09 C ATOM 1834 CG ARG A 639 1.840 10.938 14.091 1.00 40.93 C ATOM 1835 CD ARG A 639 0.691 11.410 13.195 1.00 48.37 C ATOM 1836 NE ARG A 639 -0.632 11.023 13.693 1.00 53.31 N ATOM 1837 CZ ARG A 639 -1.313 11.688 14.623 1.00 56.19 C ATOM 1838 NH1 ARG A 639 -2.510 11.254 14.998 1.00 57.26 N ATOM 1839 NH2 ARG A 639 -0.801 12.784 15.179 1.00 56.88 N ATOM 1840 HA ARG A 639 2.637 13.470 13.231 1.00 0.00 H ATOM 1841 HB2 ARG A 639 3.655 10.626 12.995 1.00 0.00 H ATOM 1842 HB3 ARG A 639 3.858 11.523 14.518 1.00 0.00 H ATOM 1843 HG2 ARG A 639 1.835 9.848 14.108 1.00 0.00 H ATOM 1844 HG3 ARG A 639 1.667 11.317 15.098 1.00 0.00 H ATOM 1845 HD2 ARG A 639 0.827 10.979 12.203 1.00 0.00 H ATOM 1846 HD3 ARG A 639 0.730 12.497 13.126 1.00 0.00 H ATOM 1847 HE ARG A 639 -1.069 10.169 13.292 1.00 0.00 H ATOM 1848 HH12 ARG A 639 -3.046 11.770 15.724 1.00 0.00 H ATOM 1849 HH11 ARG A 639 -2.912 10.398 14.565 1.00 0.00 H ATOM 1850 HH22 ARG A 639 -1.339 13.299 15.905 1.00 0.00 H ATOM 1851 HH21 ARG A 639 0.137 13.126 14.887 1.00 0.00 H ATOM 1852 H ARG A 639 3.230 11.608 10.991 1.00 0.00 H ATOM 1853 N ASN A 640 5.361 13.770 11.885 1.00 35.11 N ATOM 1854 CA ASN A 640 6.743 14.276 11.905 1.00 35.06 C ATOM 1855 C ASN A 640 7.840 13.263 12.270 1.00 33.87 C ATOM 1856 O ASN A 640 8.915 13.638 12.748 1.00 33.50 O ATOM 1857 CB ASN A 640 6.860 15.517 12.817 1.00 35.51 C ATOM 1858 CG ASN A 640 5.967 16.629 12.360 1.00 38.65 C ATOM 1859 OD1 ASN A 640 6.003 17.006 11.196 1.00 41.90 O ATOM 1860 ND2 ASN A 640 5.117 17.129 13.256 1.00 41.77 N ATOM 1861 HA ASN A 640 6.934 14.531 10.863 1.00 0.00 H ATOM 1862 HB2 ASN A 640 6.583 15.236 13.833 1.00 0.00 H ATOM 1863 HB3 ASN A 640 7.892 15.866 12.807 1.00 0.00 H ATOM 1864 HD22 ASN A 640 5.125 16.776 14.234 1.00 0.00 H ATOM 1865 HD21 ASN A 640 4.446 17.873 12.977 1.00 0.00 H ATOM 1866 H ASN A 640 4.838 13.777 10.986 1.00 0.00 H ATOM 1867 N PHE A 641 7.573 11.986 12.048 1.00 31.62 N ATOM 1868 CA PHE A 641 8.480 10.947 12.492 1.00 31.10 C ATOM 1869 C PHE A 641 9.305 10.447 11.299 1.00 29.87 C ATOM 1870 O PHE A 641 8.746 10.059 10.295 1.00 30.91 O ATOM 1871 CB PHE A 641 7.687 9.804 13.137 1.00 31.28 C ATOM 1872 CG PHE A 641 8.545 8.759 13.779 1.00 34.19 C ATOM 1873 CD1 PHE A 641 8.887 8.862 15.124 1.00 38.19 C ATOM 1874 CD2 PHE A 641 9.015 7.678 13.037 1.00 35.60 C ATOM 1875 CE1 PHE A 641 9.680 7.895 15.729 1.00 39.30 C ATOM 1876 CE2 PHE A 641 9.811 6.701 13.619 1.00 36.84 C ATOM 1877 CZ PHE A 641 10.146 6.806 14.961 1.00 39.66 C ATOM 1878 HA PHE A 641 9.164 11.347 13.241 1.00 0.00 H ATOM 1879 HB2 PHE A 641 7.032 10.227 13.899 1.00 0.00 H ATOM 1880 HB3 PHE A 641 7.083 9.326 12.365 1.00 0.00 H ATOM 1881 HD2 PHE A 641 8.753 7.598 11.982 1.00 0.00 H ATOM 1882 HE2 PHE A 641 10.170 5.859 13.027 1.00 0.00 H ATOM 1883 HZ PHE A 641 10.772 6.044 15.425 1.00 0.00 H ATOM 1884 HE1 PHE A 641 9.939 7.976 16.785 1.00 0.00 H ATOM 1885 HD1 PHE A 641 8.529 9.710 15.708 1.00 0.00 H ATOM 1886 H PHE A 641 6.700 11.724 11.548 1.00 0.00 H ATOM 1887 N ILE A 642 10.630 10.494 11.428 1.00 28.12 N ATOM 1888 CA ILE A 642 11.562 10.035 10.399 1.00 27.38 C ATOM 1889 C ILE A 642 12.051 8.640 10.786 1.00 26.71 C ATOM 1890 O ILE A 642 12.653 8.449 11.827 1.00 27.41 O ATOM 1891 CB ILE A 642 12.750 11.028 10.207 1.00 28.09 C ATOM 1892 CG1 ILE A 642 12.199 12.421 9.849 1.00 29.14 C ATOM 1893 CG2 ILE A 642 13.718 10.522 9.108 1.00 26.82 C ATOM 1894 CD1 ILE A 642 13.077 13.614 10.353 1.00 34.13 C ATOM 1895 HA ILE A 642 11.050 9.992 9.438 1.00 0.00 H ATOM 1896 HB ILE A 642 13.312 11.095 11.138 1.00 0.00 H ATOM 1897 HG12 ILE A 642 12.122 12.489 8.764 1.00 0.00 H ATOM 1898 HG13 ILE A 642 11.206 12.518 10.289 1.00 0.00 H ATOM 1899 HD11 ILE A 642 13.155 13.572 11.439 1.00 0.00 H ATOM 1900 HD12 ILE A 642 14.072 13.543 9.913 1.00 0.00 H ATOM 1901 HD13 ILE A 642 12.614 14.555 10.056 1.00 0.00 H ATOM 1902 HG21 ILE A 642 14.116 9.549 9.396 1.00 0.00 H ATOM 1903 HG22 ILE A 642 13.179 10.431 8.165 1.00 0.00 H ATOM 1904 HG23 ILE A 642 14.538 11.231 8.993 1.00 0.00 H ATOM 1905 H ILE A 642 11.024 10.879 12.310 1.00 0.00 H ATOM 1906 N HIS A 643 11.737 7.664 9.945 1.00 25.41 N ATOM 1907 CA HIS A 643 12.082 6.269 10.178 1.00 25.13 C ATOM 1908 C HIS A 643 13.600 6.006 10.142 1.00 24.70 C ATOM 1909 O HIS A 643 14.148 5.378 11.057 1.00 25.89 O ATOM 1910 CB HIS A 643 11.395 5.404 9.108 1.00 24.64 C ATOM 1911 CG HIS A 643 11.393 3.945 9.437 1.00 25.57 C ATOM 1912 ND1 HIS A 643 12.549 3.211 9.556 1.00 24.83 N ATOM 1913 CD2 HIS A 643 10.374 3.085 9.684 1.00 28.28 C ATOM 1914 CE1 HIS A 643 12.248 1.963 9.872 1.00 26.21 C ATOM 1915 NE2 HIS A 643 10.932 1.855 9.924 1.00 27.90 N ATOM 1916 HA HIS A 643 11.739 6.012 11.180 1.00 0.00 H ATOM 1917 HB2 HIS A 643 10.362 5.737 9.005 1.00 0.00 H ATOM 1918 HB3 HIS A 643 11.917 5.545 8.162 1.00 0.00 H ATOM 1919 HD2 HIS A 643 9.311 3.326 9.691 1.00 0.00 H ATOM 1920 HE1 HIS A 643 12.963 1.161 10.058 1.00 0.00 H ATOM 1921 H HIS A 643 11.219 7.907 9.077 1.00 0.00 H ATOM 1922 N ARG A 644 14.268 6.468 9.085 1.00 24.03 N ATOM 1923 CA ARG A 644 15.747 6.286 8.910 1.00 25.67 C ATOM 1924 C ARG A 644 16.205 4.905 8.463 1.00 24.83 C ATOM 1925 O ARG A 644 17.341 4.746 7.976 1.00 25.50 O ATOM 1926 CB ARG A 644 16.516 6.646 10.215 1.00 26.28 C ATOM 1927 CG ARG A 644 16.384 8.080 10.650 1.00 28.32 C ATOM 1928 CD ARG A 644 17.521 8.399 11.646 1.00 35.18 C ATOM 1929 NE ARG A 644 17.508 9.794 12.093 1.00 39.28 N ATOM 1930 CZ ARG A 644 18.602 10.456 12.470 1.00 40.99 C ATOM 1931 NH1 ARG A 644 18.500 11.709 12.868 1.00 41.99 N ATOM 1932 NH2 ARG A 644 19.802 9.868 12.439 1.00 41.43 N ATOM 1933 HA ARG A 644 15.982 6.970 8.095 1.00 0.00 H ATOM 1934 HB2 ARG A 644 16.139 6.012 11.017 1.00 0.00 H ATOM 1935 HB3 ARG A 644 17.573 6.436 10.055 1.00 0.00 H ATOM 1936 HG2 ARG A 644 16.460 8.736 9.783 1.00 0.00 H ATOM 1937 HG3 ARG A 644 15.419 8.230 11.134 1.00 0.00 H ATOM 1938 HD2 ARG A 644 18.476 8.197 11.161 1.00 0.00 H ATOM 1939 HD3 ARG A 644 17.413 7.753 12.517 1.00 0.00 H ATOM 1940 HE ARG A 644 16.597 10.295 12.118 1.00 0.00 H ATOM 1941 HH12 ARG A 644 19.349 12.232 13.163 1.00 0.00 H ATOM 1942 HH11 ARG A 644 17.570 12.175 12.886 1.00 0.00 H ATOM 1943 HH22 ARG A 644 20.648 10.396 12.736 1.00 0.00 H ATOM 1944 HH21 ARG A 644 19.890 8.883 12.118 1.00 0.00 H ATOM 1945 H ARG A 644 13.740 6.978 8.348 1.00 0.00 H ATOM 1946 N ASP A 645 15.372 3.877 8.655 1.00 23.74 N ATOM 1947 CA ASP A 645 15.790 2.530 8.250 1.00 22.72 C ATOM 1948 C ASP A 645 14.699 1.767 7.503 1.00 22.21 C ATOM 1949 O ASP A 645 14.551 0.558 7.718 1.00 20.67 O ATOM 1950 CB ASP A 645 16.242 1.749 9.494 1.00 23.66 C ATOM 1951 CG ASP A 645 17.097 0.528 9.173 1.00 25.92 C ATOM 1952 OD1 ASP A 645 17.572 0.332 8.032 1.00 27.95 O ATOM 1953 OD2 ASP A 645 17.288 -0.248 10.122 1.00 29.04 O ATOM 1954 HA ASP A 645 16.619 2.636 7.550 1.00 0.00 H ATOM 1955 HB2 ASP A 645 16.822 2.418 10.129 1.00 0.00 H ATOM 1956 HB3 ASP A 645 15.355 1.416 10.033 1.00 0.00 H ATOM 1957 H ASP A 645 14.438 4.030 9.087 1.00 0.00 H ATOM 1958 N LEU A 646 13.985 2.449 6.600 1.00 20.29 N ATOM 1959 CA LEU A 646 12.930 1.770 5.820 1.00 21.38 C ATOM 1960 C LEU A 646 13.555 0.784 4.831 1.00 20.23 C ATOM 1961 O LEU A 646 14.421 1.133 4.025 1.00 20.76 O ATOM 1962 CB LEU A 646 12.071 2.769 5.036 1.00 20.34 C ATOM 1963 CG LEU A 646 10.900 2.136 4.249 1.00 19.48 C ATOM 1964 CD1 LEU A 646 10.050 1.244 5.151 1.00 16.77 C ATOM 1965 CD2 LEU A 646 10.050 3.288 3.761 1.00 17.83 C ATOM 1966 HA LEU A 646 12.295 1.243 6.532 1.00 0.00 H ATOM 1967 HB2 LEU A 646 11.656 3.488 5.742 1.00 0.00 H ATOM 1968 HB3 LEU A 646 12.716 3.288 4.327 1.00 0.00 H ATOM 1969 HG LEU A 646 11.279 1.520 3.434 1.00 0.00 H ATOM 1970 HD21 LEU A 646 9.686 3.857 4.616 1.00 0.00 H ATOM 1971 HD22 LEU A 646 10.650 3.935 3.121 1.00 0.00 H ATOM 1972 HD23 LEU A 646 9.203 2.899 3.195 1.00 0.00 H ATOM 1973 HD11 LEU A 646 10.670 0.445 5.558 1.00 0.00 H ATOM 1974 HD12 LEU A 646 9.641 1.839 5.967 1.00 0.00 H ATOM 1975 HD13 LEU A 646 9.235 0.813 4.570 1.00 0.00 H ATOM 1976 H LEU A 646 14.173 3.460 6.447 1.00 0.00 H ATOM 1977 N ALA A 647 13.105 -0.458 4.899 1.00 19.97 N ATOM 1978 CA ALA A 647 13.620 -1.498 4.022 1.00 20.38 C ATOM 1979 C ALA A 647 12.632 -2.664 4.169 1.00 20.54 C ATOM 1980 O ALA A 647 11.927 -2.751 5.178 1.00 20.43 O ATOM 1981 CB ALA A 647 15.044 -1.923 4.479 1.00 20.26 C ATOM 1982 HA ALA A 647 13.705 -1.167 2.987 1.00 0.00 H ATOM 1983 HB1 ALA A 647 15.709 -1.060 4.442 1.00 0.00 H ATOM 1984 HB2 ALA A 647 14.998 -2.304 5.499 1.00 0.00 H ATOM 1985 HB3 ALA A 647 15.420 -2.702 3.816 1.00 0.00 H ATOM 1986 H ALA A 647 12.368 -0.696 5.593 1.00 0.00 H ATOM 1987 N ALA A 648 12.564 -3.539 3.166 1.00 21.20 N ATOM 1988 CA ALA A 648 11.679 -4.760 3.199 1.00 21.10 C ATOM 1989 C ALA A 648 11.862 -5.584 4.482 1.00 21.48 C ATOM 1990 O ALA A 648 10.876 -6.032 5.128 1.00 21.44 O ATOM 1991 CB ALA A 648 11.880 -5.590 1.894 1.00 20.69 C ATOM 1992 HA ALA A 648 10.638 -4.437 3.228 1.00 0.00 H ATOM 1993 HB1 ALA A 648 11.619 -4.977 1.031 1.00 0.00 H ATOM 1994 HB2 ALA A 648 12.922 -5.900 1.819 1.00 0.00 H ATOM 1995 HB3 ALA A 648 11.239 -6.471 1.923 1.00 0.00 H ATOM 1996 H ALA A 648 13.148 -3.372 2.322 1.00 0.00 H ATOM 1997 N ARG A 649 13.120 -5.697 4.957 1.00 21.47 N ATOM 1998 CA ARG A 649 13.416 -6.465 6.173 1.00 21.06 C ATOM 1999 C ARG A 649 12.760 -5.836 7.400 1.00 21.45 C ATOM 2000 O ARG A 649 12.564 -6.502 8.413 1.00 21.79 O ATOM 2001 CB ARG A 649 14.959 -6.607 6.388 1.00 22.42 C ATOM 2002 CG ARG A 649 15.613 -5.243 6.697 1.00 23.57 C ATOM 2003 CD ARG A 649 17.164 -5.279 6.998 1.00 28.09 C ATOM 2004 NE ARG A 649 17.653 -3.891 6.990 1.00 29.41 N ATOM 2005 CZ ARG A 649 18.017 -3.216 5.904 1.00 26.41 C ATOM 2006 NH1 ARG A 649 18.015 -3.789 4.723 1.00 27.53 N ATOM 2007 NH2 ARG A 649 18.382 -1.948 6.005 1.00 27.09 N ATOM 2008 HA ARG A 649 12.997 -7.462 6.040 1.00 0.00 H ATOM 2009 HB2 ARG A 649 15.140 -7.285 7.222 1.00 0.00 H ATOM 2010 HB3 ARG A 649 15.407 -7.019 5.484 1.00 0.00 H ATOM 2011 HG2 ARG A 649 15.453 -4.592 5.837 1.00 0.00 H ATOM 2012 HG3 ARG A 649 15.112 -4.821 7.568 1.00 0.00 H ATOM 2013 HD2 ARG A 649 17.678 -5.859 6.231 1.00 0.00 H ATOM 2014 HD3 ARG A 649 17.343 -5.730 7.974 1.00 0.00 H ATOM 2015 HE ARG A 649 17.719 -3.400 7.905 1.00 0.00 H ATOM 2016 HH12 ARG A 649 18.302 -3.248 3.882 1.00 0.00 H ATOM 2017 HH11 ARG A 649 17.726 -4.784 4.628 1.00 0.00 H ATOM 2018 HH22 ARG A 649 18.667 -1.420 5.156 1.00 0.00 H ATOM 2019 HH21 ARG A 649 18.384 -1.480 6.934 1.00 0.00 H ATOM 2020 H ARG A 649 13.898 -5.229 4.450 1.00 0.00 H ATOM 2021 N ASN A 650 12.417 -4.552 7.327 1.00 21.08 N ATOM 2022 CA ASN A 650 11.847 -3.846 8.478 1.00 21.41 C ATOM 2023 C ASN A 650 10.336 -3.606 8.316 1.00 21.11 C ATOM 2024 O ASN A 650 9.731 -2.806 9.030 1.00 22.27 O ATOM 2025 CB ASN A 650 12.608 -2.539 8.723 1.00 21.95 C ATOM 2026 CG ASN A 650 13.970 -2.786 9.315 1.00 25.51 C ATOM 2027 OD1 ASN A 650 14.143 -3.726 10.133 1.00 23.74 O ATOM 2028 ND2 ASN A 650 14.940 -1.932 8.967 1.00 23.18 N ATOM 2029 HA ASN A 650 11.963 -4.480 9.357 1.00 0.00 H ATOM 2030 HB2 ASN A 650 12.725 -2.016 7.774 1.00 0.00 H ATOM 2031 HB3 ASN A 650 12.032 -1.919 9.410 1.00 0.00 H ATOM 2032 HD22 ASN A 650 14.743 -1.172 8.285 1.00 0.00 H ATOM 2033 HD21 ASN A 650 15.890 -2.029 9.378 1.00 0.00 H ATOM 2034 H ASN A 650 12.557 -4.038 6.434 1.00 0.00 H ATOM 2035 N CYS A 651 9.746 -4.320 7.381 1.00 21.04 N ATOM 2036 CA CYS A 651 8.280 -4.326 7.191 1.00 22.89 C ATOM 2037 C CYS A 651 7.777 -5.697 7.595 1.00 23.46 C ATOM 2038 O CYS A 651 8.344 -6.716 7.169 1.00 23.95 O ATOM 2039 CB CYS A 651 7.959 -4.041 5.718 1.00 21.86 C ATOM 2040 SG CYS A 651 8.377 -2.338 5.275 1.00 22.73 S ATOM 2041 HA CYS A 651 7.797 -3.559 7.797 1.00 0.00 H ATOM 2042 HB2 CYS A 651 6.894 -4.202 5.548 1.00 0.00 H ATOM 2043 HB3 CYS A 651 8.533 -4.723 5.090 1.00 0.00 H ATOM 2044 HG CYS A 651 9.725 -2.129 5.481 1.00 0.00 H ATOM 2045 H CYS A 651 10.334 -4.903 6.751 1.00 0.00 H ATOM 2046 N MET A 652 6.748 -5.737 8.429 1.00 23.13 N ATOM 2047 CA MET A 652 6.263 -7.027 8.935 1.00 23.87 C ATOM 2048 C MET A 652 4.944 -7.398 8.253 1.00 24.49 C ATOM 2049 O MET A 652 4.175 -6.520 7.864 1.00 24.60 O ATOM 2050 CB MET A 652 6.102 -6.973 10.456 1.00 23.28 C ATOM 2051 CG MET A 652 7.384 -6.763 11.235 1.00 23.70 C ATOM 2052 SD MET A 652 8.550 -8.100 11.031 1.00 27.82 S ATOM 2053 CE MET A 652 7.672 -9.425 11.869 1.00 26.82 C ATOM 2054 HA MET A 652 6.995 -7.800 8.701 1.00 0.00 H ATOM 2055 HB2 MET A 652 5.424 -6.153 10.694 1.00 0.00 H ATOM 2056 HB3 MET A 652 5.660 -7.914 10.782 1.00 0.00 H ATOM 2057 HG2 MET A 652 7.138 -6.675 12.293 1.00 0.00 H ATOM 2058 HG3 MET A 652 7.851 -5.839 10.894 1.00 0.00 H ATOM 2059 HE1 MET A 652 7.500 -9.145 12.908 1.00 0.00 H ATOM 2060 HE2 MET A 652 6.716 -9.595 11.374 1.00 0.00 H ATOM 2061 HE3 MET A 652 8.269 -10.336 11.831 1.00 0.00 H ATOM 2062 H MET A 652 6.284 -4.855 8.725 1.00 0.00 H ATOM 2063 N LEU A 653 4.687 -8.699 8.121 1.00 25.65 N ATOM 2064 CA LEU A 653 3.424 -9.175 7.587 1.00 27.87 C ATOM 2065 C LEU A 653 2.448 -9.524 8.715 1.00 28.41 C ATOM 2066 O LEU A 653 2.765 -10.333 9.578 1.00 29.38 O ATOM 2067 CB LEU A 653 3.668 -10.377 6.678 1.00 28.05 C ATOM 2068 CG LEU A 653 4.210 -10.003 5.312 1.00 29.34 C ATOM 2069 CD1 LEU A 653 4.785 -11.231 4.628 1.00 30.35 C ATOM 2070 CD2 LEU A 653 3.105 -9.369 4.460 1.00 32.41 C ATOM 2071 HA LEU A 653 2.969 -8.379 6.998 1.00 0.00 H ATOM 2072 HB2 LEU A 653 4.385 -11.038 7.165 1.00 0.00 H ATOM 2073 HB3 LEU A 653 2.724 -10.904 6.542 1.00 0.00 H ATOM 2074 HG LEU A 653 5.009 -9.271 5.432 1.00 0.00 H ATOM 2075 HD21 LEU A 653 2.288 -10.081 4.338 1.00 0.00 H ATOM 2076 HD22 LEU A 653 2.735 -8.472 4.956 1.00 0.00 H ATOM 2077 HD23 LEU A 653 3.508 -9.105 3.482 1.00 0.00 H ATOM 2078 HD11 LEU A 653 5.593 -11.639 5.236 1.00 0.00 H ATOM 2079 HD12 LEU A 653 4.002 -11.980 4.511 1.00 0.00 H ATOM 2080 HD13 LEU A 653 5.172 -10.952 3.648 1.00 0.00 H ATOM 2081 H LEU A 653 5.409 -9.390 8.408 1.00 0.00 H ATOM 2082 N ALA A 654 1.274 -8.894 8.713 1.00 29.80 N ATOM 2083 CA ALA A 654 0.303 -9.144 9.768 1.00 31.33 C ATOM 2084 C ALA A 654 -0.480 -10.413 9.443 1.00 32.63 C ATOM 2085 O ALA A 654 -0.284 -11.038 8.391 1.00 31.36 O ATOM 2086 CB ALA A 654 -0.627 -7.965 9.942 1.00 31.27 C ATOM 2087 HA ALA A 654 0.832 -9.282 10.711 1.00 0.00 H ATOM 2088 HB1 ALA A 654 -0.046 -7.081 10.205 1.00 0.00 H ATOM 2089 HB2 ALA A 654 -1.163 -7.786 9.010 1.00 0.00 H ATOM 2090 HB3 ALA A 654 -1.341 -8.181 10.737 1.00 0.00 H ATOM 2091 H ALA A 654 1.050 -8.220 7.953 1.00 0.00 H ATOM 2092 N GLU A 655 -1.362 -10.792 10.362 1.00 33.96 N ATOM 2093 CA GLU A 655 -2.169 -11.993 10.176 1.00 35.48 C ATOM 2094 C GLU A 655 -2.976 -11.966 8.856 1.00 34.60 C ATOM 2095 O GLU A 655 -3.091 -12.967 8.167 1.00 35.58 O ATOM 2096 CB GLU A 655 -3.084 -12.173 11.394 1.00 36.87 C ATOM 2097 CG GLU A 655 -2.900 -13.525 12.057 1.00 42.23 C ATOM 2098 CD GLU A 655 -4.157 -13.998 12.743 1.00 48.56 C ATOM 2099 OE1 GLU A 655 -4.819 -13.166 13.413 1.00 50.65 O ATOM 2100 OE2 GLU A 655 -4.481 -15.204 12.611 1.00 52.11 O ATOM 2101 HA GLU A 655 -1.500 -12.850 10.095 1.00 0.00 H ATOM 2102 HB2 GLU A 655 -2.859 -11.392 12.121 1.00 0.00 H ATOM 2103 HB3 GLU A 655 -4.121 -12.079 11.071 1.00 0.00 H ATOM 2104 HG2 GLU A 655 -2.619 -14.254 11.297 1.00 0.00 H ATOM 2105 HG3 GLU A 655 -2.103 -13.448 12.797 1.00 0.00 H ATOM 2106 H GLU A 655 -1.479 -10.225 11.226 1.00 0.00 H ATOM 2107 N ASP A 656 -3.517 -10.818 8.493 1.00 34.31 N ATOM 2108 CA ASP A 656 -4.313 -10.716 7.275 1.00 33.86 C ATOM 2109 C ASP A 656 -3.433 -10.416 6.038 1.00 32.51 C ATOM 2110 O ASP A 656 -3.920 -9.958 5.018 1.00 31.73 O ATOM 2111 CB ASP A 656 -5.397 -9.655 7.459 1.00 34.61 C ATOM 2112 CG ASP A 656 -4.821 -8.253 7.675 1.00 38.71 C ATOM 2113 OD1 ASP A 656 -3.574 -8.092 7.798 1.00 37.34 O ATOM 2114 OD2 ASP A 656 -5.625 -7.303 7.729 1.00 41.58 O ATOM 2115 HA ASP A 656 -4.790 -11.679 7.091 1.00 0.00 H ATOM 2116 HB2 ASP A 656 -6.026 -9.641 6.569 1.00 0.00 H ATOM 2117 HB3 ASP A 656 -6.002 -9.921 8.326 1.00 0.00 H ATOM 2118 H ASP A 656 -3.374 -9.974 9.084 1.00 0.00 H ATOM 2119 N MET A 657 -2.136 -10.722 6.146 1.00 31.53 N ATOM 2120 CA MET A 657 -1.142 -10.450 5.112 1.00 30.88 C ATOM 2121 C MET A 657 -1.027 -8.991 4.709 1.00 29.61 C ATOM 2122 O MET A 657 -0.518 -8.724 3.633 1.00 29.75 O ATOM 2123 CB MET A 657 -1.344 -11.299 3.852 1.00 31.78 C ATOM 2124 CG MET A 657 -1.274 -12.800 4.074 1.00 33.46 C ATOM 2125 SD MET A 657 0.304 -13.335 4.721 1.00 40.20 S ATOM 2126 CE MET A 657 1.426 -12.868 3.399 1.00 38.33 C ATOM 2127 HA MET A 657 -0.206 -10.731 5.594 1.00 0.00 H ATOM 2128 HB2 MET A 657 -2.324 -11.063 3.438 1.00 0.00 H ATOM 2129 HB3 MET A 657 -0.572 -11.027 3.132 1.00 0.00 H ATOM 2130 HG2 MET A 657 -1.448 -13.301 3.122 1.00 0.00 H ATOM 2131 HG3 MET A 657 -2.054 -13.084 4.780 1.00 0.00 H ATOM 2132 HE1 MET A 657 1.142 -13.386 2.483 1.00 0.00 H ATOM 2133 HE2 MET A 657 1.371 -11.791 3.241 1.00 0.00 H ATOM 2134 HE3 MET A 657 2.444 -13.145 3.673 1.00 0.00 H ATOM 2135 H MET A 657 -1.815 -11.183 7.021 1.00 0.00 H ATOM 2136 N THR A 658 -1.503 -8.057 5.538 1.00 28.74 N ATOM 2137 CA THR A 658 -1.232 -6.646 5.247 1.00 27.98 C ATOM 2138 C THR A 658 0.205 -6.357 5.749 1.00 26.62 C ATOM 2139 O THR A 658 0.661 -7.003 6.644 1.00 26.44 O ATOM 2140 CB THR A 658 -2.200 -5.638 5.896 1.00 27.31 C ATOM 2141 OG1 THR A 658 -2.222 -5.819 7.307 1.00 29.47 O ATOM 2142 CG2 THR A 658 -3.633 -5.750 5.338 1.00 28.26 C ATOM 2143 HA THR A 658 -1.362 -6.507 4.174 1.00 0.00 H ATOM 2144 HB THR A 658 -1.831 -4.642 5.653 1.00 0.00 H ATOM 2145 HG1 THR A 658 -2.847 -5.167 7.713 1.00 0.00 H ATOM 2146 HG23 THR A 658 -3.613 -5.611 4.257 1.00 0.00 H ATOM 2147 HG21 THR A 658 -4.036 -6.735 5.571 1.00 0.00 H ATOM 2148 HG22 THR A 658 -4.260 -4.983 5.793 1.00 0.00 H ATOM 2149 H THR A 658 -2.057 -8.327 6.376 1.00 0.00 H ATOM 2150 N VAL A 659 0.877 -5.377 5.156 1.00 26.12 N ATOM 2151 CA VAL A 659 2.240 -4.991 5.615 1.00 25.52 C ATOM 2152 C VAL A 659 2.175 -3.813 6.591 1.00 25.53 C ATOM 2153 O VAL A 659 1.388 -2.878 6.393 1.00 25.22 O ATOM 2154 CB VAL A 659 3.163 -4.607 4.422 1.00 26.30 C ATOM 2155 CG1 VAL A 659 4.620 -4.335 4.914 1.00 24.76 C ATOM 2156 CG2 VAL A 659 3.129 -5.666 3.326 1.00 26.08 C ATOM 2157 HA VAL A 659 2.660 -5.862 6.118 1.00 0.00 H ATOM 2158 HB VAL A 659 2.781 -3.684 3.986 1.00 0.00 H ATOM 2159 HG11 VAL A 659 4.613 -3.515 5.632 1.00 0.00 H ATOM 2160 HG12 VAL A 659 5.015 -5.233 5.390 1.00 0.00 H ATOM 2161 HG13 VAL A 659 5.246 -4.069 4.062 1.00 0.00 H ATOM 2162 HG21 VAL A 659 3.468 -6.619 3.733 1.00 0.00 H ATOM 2163 HG22 VAL A 659 2.110 -5.770 2.955 1.00 0.00 H ATOM 2164 HG23 VAL A 659 3.785 -5.364 2.510 1.00 0.00 H ATOM 2165 H VAL A 659 0.444 -4.871 4.358 1.00 0.00 H ATOM 2166 N CYS A 660 3.016 -3.864 7.630 1.00 26.01 N ATOM 2167 CA CYS A 660 3.108 -2.872 8.685 1.00 26.26 C ATOM 2168 C CYS A 660 4.575 -2.403 8.765 1.00 25.89 C ATOM 2169 O CYS A 660 5.473 -3.248 8.868 1.00 25.01 O ATOM 2170 CB CYS A 660 2.694 -3.510 10.012 1.00 27.60 C ATOM 2171 SG CYS A 660 0.955 -4.208 9.901 1.00 36.91 S ATOM 2172 HA CYS A 660 2.452 -2.026 8.481 1.00 0.00 H ATOM 2173 HB2 CYS A 660 2.727 -2.755 10.798 1.00 0.00 H ATOM 2174 HB3 CYS A 660 3.388 -4.315 10.254 1.00 0.00 H ATOM 2175 HG CYS A 660 0.071 -3.192 9.600 1.00 0.00 H ATOM 2176 H CYS A 660 3.656 -4.682 7.686 1.00 0.00 H ATOM 2177 N VAL A 661 4.815 -1.084 8.699 1.00 24.85 N ATOM 2178 CA VAL A 661 6.167 -0.534 8.932 1.00 24.09 C ATOM 2179 C VAL A 661 6.600 -0.776 10.385 1.00 24.23 C ATOM 2180 O VAL A 661 5.824 -0.573 11.319 1.00 23.78 O ATOM 2181 CB VAL A 661 6.228 0.983 8.571 1.00 23.70 C ATOM 2182 CG1 VAL A 661 7.657 1.558 8.795 1.00 23.98 C ATOM 2183 CG2 VAL A 661 5.797 1.150 7.114 1.00 24.23 C ATOM 2184 HA VAL A 661 6.865 -1.054 8.276 1.00 0.00 H ATOM 2185 HB VAL A 661 5.555 1.540 9.223 1.00 0.00 H ATOM 2186 HG11 VAL A 661 7.936 1.438 9.842 1.00 0.00 H ATOM 2187 HG12 VAL A 661 8.366 1.021 8.165 1.00 0.00 H ATOM 2188 HG13 VAL A 661 7.666 2.616 8.535 1.00 0.00 H ATOM 2189 HG21 VAL A 661 6.471 0.585 6.470 1.00 0.00 H ATOM 2190 HG22 VAL A 661 4.780 0.778 6.992 1.00 0.00 H ATOM 2191 HG23 VAL A 661 5.834 2.205 6.844 1.00 0.00 H ATOM 2192 H VAL A 661 4.033 -0.435 8.479 1.00 0.00 H ATOM 2193 N ALA A 662 7.836 -1.219 10.581 1.00 24.04 N ATOM 2194 CA ALA A 662 8.311 -1.576 11.923 1.00 26.01 C ATOM 2195 C ALA A 662 9.750 -1.095 12.122 1.00 27.54 C ATOM 2196 O ALA A 662 10.373 -0.555 11.182 1.00 26.57 O ATOM 2197 CB ALA A 662 8.243 -3.102 12.095 1.00 25.36 C ATOM 2198 HA ALA A 662 7.677 -1.094 12.667 1.00 0.00 H ATOM 2199 HB1 ALA A 662 7.212 -3.435 11.971 1.00 0.00 H ATOM 2200 HB2 ALA A 662 8.873 -3.579 11.345 1.00 0.00 H ATOM 2201 HB3 ALA A 662 8.595 -3.370 13.091 1.00 0.00 H ATOM 2202 H ALA A 662 8.479 -1.315 9.769 1.00 0.00 H ATOM 2203 N ASP A 663 10.278 -1.370 13.307 1.00 30.07 N ATOM 2204 CA ASP A 663 11.701 -1.210 13.626 1.00 34.36 C ATOM 2205 C ASP A 663 12.101 0.250 13.415 1.00 37.36 C ATOM 2206 O ASP A 663 12.815 0.597 12.474 1.00 39.21 O ATOM 2207 CB ASP A 663 12.571 -2.157 12.804 1.00 34.16 C ATOM 2208 CG ASP A 663 12.315 -3.639 13.123 1.00 36.12 C ATOM 2209 OD1 ASP A 663 12.595 -4.077 14.257 1.00 35.60 O ATOM 2210 OD2 ASP A 663 11.848 -4.367 12.230 1.00 38.21 O ATOM 2211 HA ASP A 663 11.863 -1.474 14.671 1.00 0.00 H ATOM 2212 HB2 ASP A 663 12.365 -1.989 11.747 1.00 0.00 H ATOM 2213 HB3 ASP A 663 13.618 -1.933 13.009 1.00 0.00 H ATOM 2214 H ASP A 663 9.646 -1.720 14.055 1.00 0.00 H ATOM 2215 N PHE A 664 11.635 1.088 14.317 1.00 40.97 N ATOM 2216 CA PHE A 664 11.745 2.529 14.160 1.00 44.13 C ATOM 2217 C PHE A 664 13.109 3.090 14.579 1.00 46.15 C ATOM 2218 O PHE A 664 13.464 4.207 14.196 1.00 46.63 O ATOM 2219 CB PHE A 664 10.614 3.162 14.937 1.00 44.36 C ATOM 2220 CG PHE A 664 9.295 2.497 14.693 1.00 45.97 C ATOM 2221 CD1 PHE A 664 8.643 1.825 15.723 1.00 46.93 C ATOM 2222 CD2 PHE A 664 8.717 2.511 13.414 1.00 45.93 C ATOM 2223 CE1 PHE A 664 7.414 1.204 15.502 1.00 46.99 C ATOM 2224 CE2 PHE A 664 7.483 1.887 13.182 1.00 45.20 C ATOM 2225 CZ PHE A 664 6.837 1.234 14.226 1.00 45.05 C ATOM 2226 HA PHE A 664 11.667 2.773 13.101 1.00 0.00 H ATOM 2227 HB2 PHE A 664 10.844 3.099 16.001 1.00 0.00 H ATOM 2228 HB3 PHE A 664 10.535 4.209 14.645 1.00 0.00 H ATOM 2229 HD2 PHE A 664 9.232 3.011 12.594 1.00 0.00 H ATOM 2230 HE2 PHE A 664 7.033 1.914 12.190 1.00 0.00 H ATOM 2231 HZ PHE A 664 5.879 0.744 14.051 1.00 0.00 H ATOM 2232 HE1 PHE A 664 6.904 0.696 16.320 1.00 0.00 H ATOM 2233 HD1 PHE A 664 9.098 1.784 16.713 1.00 0.00 H ATOM 2234 H PHE A 664 11.174 0.707 15.168 1.00 0.00 H ATOM 2235 N GLY A 665 13.869 2.307 15.352 1.00 48.04 N ATOM 2236 CA GLY A 665 15.299 2.570 15.572 1.00 49.63 C ATOM 2237 C GLY A 665 15.699 2.708 17.032 1.00 51.29 C ATOM 2238 O GLY A 665 16.676 3.399 17.351 1.00 51.80 O ATOM 2239 HA3 GLY A 665 15.558 3.496 15.059 1.00 0.00 H ATOM 2240 HA2 GLY A 665 15.867 1.746 15.140 1.00 0.00 H ATOM 2241 H GLY A 665 13.433 1.483 15.814 1.00 0.00 H ATOM 2242 N LEU A 666 14.956 2.057 17.921 1.00 51.94 N ATOM 2243 CA LEU A 666 15.297 2.056 19.343 1.00 53.12 C ATOM 2244 C LEU A 666 16.533 1.190 19.624 1.00 53.68 C ATOM 2245 O LEU A 666 17.437 1.064 18.783 1.00 54.79 O ATOM 2246 CB LEU A 666 14.107 1.578 20.187 1.00 53.21 C ATOM 2247 CG LEU A 666 12.905 2.522 20.309 1.00 53.64 C ATOM 2248 CD1 LEU A 666 11.690 1.797 20.877 1.00 54.22 C ATOM 2249 CD2 LEU A 666 13.229 3.758 21.150 1.00 55.04 C ATOM 2250 HA LEU A 666 15.535 3.082 19.624 1.00 0.00 H ATOM 2251 HB2 LEU A 666 13.748 0.646 19.749 1.00 0.00 H ATOM 2252 HB3 LEU A 666 14.476 1.386 21.194 1.00 0.00 H ATOM 2253 HG LEU A 666 12.667 2.861 19.301 1.00 0.00 H ATOM 2254 HD21 LEU A 666 13.521 3.447 22.153 1.00 0.00 H ATOM 2255 HD22 LEU A 666 14.048 4.307 20.686 1.00 0.00 H ATOM 2256 HD23 LEU A 666 12.348 4.397 21.209 1.00 0.00 H ATOM 2257 HD11 LEU A 666 11.420 0.972 20.218 1.00 0.00 H ATOM 2258 HD12 LEU A 666 11.930 1.409 21.867 1.00 0.00 H ATOM 2259 HD13 LEU A 666 10.855 2.493 20.951 1.00 0.00 H ATOM 2260 H LEU A 666 14.115 1.538 17.599 1.00 0.00 H TER 2261 LEU A 666 ATOM 2262 N LEU A 684 24.805 3.595 7.872 1.00 43.99 N ATOM 2263 CA LEU A 684 25.151 2.165 7.931 1.00 43.73 C ATOM 2264 C LEU A 684 24.335 1.241 6.994 1.00 42.71 C ATOM 2265 O LEU A 684 24.926 0.385 6.337 1.00 43.15 O ATOM 2266 CB LEU A 684 25.173 1.662 9.389 1.00 44.44 C ATOM 2267 CG LEU A 684 24.999 0.176 9.734 1.00 45.13 C ATOM 2268 CD1 LEU A 684 25.899 -0.234 10.891 1.00 46.06 C ATOM 2269 CD2 LEU A 684 23.538 -0.122 10.063 1.00 45.80 C ATOM 2270 HA LEU A 684 26.161 2.100 7.526 1.00 0.00 H ATOM 2271 HB2 LEU A 684 26.136 1.962 9.802 1.00 0.00 H ATOM 2272 HB3 LEU A 684 24.375 2.193 9.908 1.00 0.00 H ATOM 2273 HG LEU A 684 25.292 -0.409 8.862 1.00 0.00 H ATOM 2274 HD21 LEU A 684 23.229 0.481 10.916 1.00 0.00 H ATOM 2275 HD22 LEU A 684 22.916 0.120 9.201 1.00 0.00 H ATOM 2276 HD23 LEU A 684 23.430 -1.179 10.306 1.00 0.00 H ATOM 2277 HD11 LEU A 684 26.940 -0.061 10.619 1.00 0.00 H ATOM 2278 HD12 LEU A 684 25.649 0.358 11.771 1.00 0.00 H ATOM 2279 HD13 LEU A 684 25.750 -1.292 11.108 1.00 0.00 H ATOM 2280 HN3 LEU A 684 23.806 3.720 8.134 1.00 0.00 H ATOM 2281 HN2 LEU A 684 24.958 3.948 6.906 1.00 0.00 H ATOM 2282 HN1 LEU A 684 25.407 4.124 8.535 1.00 0.00 H ATOM 2283 N PRO A 685 22.983 1.401 6.913 1.00 41.46 N ATOM 2284 CA PRO A 685 22.319 0.620 5.863 1.00 39.70 C ATOM 2285 C PRO A 685 22.473 1.355 4.541 1.00 38.53 C ATOM 2286 O PRO A 685 21.500 1.915 3.974 1.00 37.80 O ATOM 2287 CB PRO A 685 20.864 0.543 6.337 1.00 39.96 C ATOM 2288 CG PRO A 685 20.645 1.813 7.110 1.00 41.37 C ATOM 2289 CD PRO A 685 22.021 2.212 7.690 1.00 41.49 C ATOM 2290 HA PRO A 685 22.728 -0.378 5.702 1.00 0.00 H ATOM 2291 HD3 PRO A 685 22.208 3.277 7.549 1.00 0.00 H ATOM 2292 HD2 PRO A 685 22.079 1.972 8.752 1.00 0.00 H ATOM 2293 HG3 PRO A 685 19.930 1.646 7.915 1.00 0.00 H ATOM 2294 HG2 PRO A 685 20.272 2.597 6.451 1.00 0.00 H ATOM 2295 HB2 PRO A 685 20.185 0.489 5.486 1.00 0.00 H ATOM 2296 HB3 PRO A 685 20.713 -0.327 6.976 1.00 0.00 H ATOM 2297 N VAL A 686 23.708 1.312 4.039 1.00 36.10 N ATOM 2298 CA VAL A 686 24.161 2.189 2.982 1.00 34.02 C ATOM 2299 C VAL A 686 23.309 2.096 1.716 1.00 32.32 C ATOM 2300 O VAL A 686 22.931 3.116 1.142 1.00 31.73 O ATOM 2301 CB VAL A 686 25.694 1.957 2.685 1.00 34.72 C ATOM 2302 CG1 VAL A 686 26.116 2.667 1.448 1.00 35.59 C ATOM 2303 CG2 VAL A 686 26.531 2.421 3.871 1.00 33.59 C ATOM 2304 HA VAL A 686 24.035 3.211 3.340 1.00 0.00 H ATOM 2305 HB VAL A 686 25.853 0.890 2.530 1.00 0.00 H ATOM 2306 HG11 VAL A 686 25.537 2.296 0.602 1.00 0.00 H ATOM 2307 HG12 VAL A 686 25.942 3.736 1.567 1.00 0.00 H ATOM 2308 HG13 VAL A 686 27.176 2.487 1.271 1.00 0.00 H ATOM 2309 HG21 VAL A 686 26.355 3.483 4.045 1.00 0.00 H ATOM 2310 HG22 VAL A 686 26.247 1.855 4.758 1.00 0.00 H ATOM 2311 HG23 VAL A 686 27.587 2.256 3.656 1.00 0.00 H ATOM 2312 H VAL A 686 24.376 0.615 4.426 1.00 0.00 H ATOM 2313 N LYS A 687 22.962 0.874 1.316 1.00 30.17 N ATOM 2314 CA LYS A 687 22.219 0.641 0.090 1.00 28.80 C ATOM 2315 C LYS A 687 20.775 1.235 0.074 1.00 26.83 C ATOM 2316 O LYS A 687 20.194 1.359 -0.985 1.00 25.03 O ATOM 2317 CB LYS A 687 22.224 -0.859 -0.255 1.00 29.67 C ATOM 2318 CG LYS A 687 23.624 -1.390 -0.541 1.00 31.93 C ATOM 2319 CD LYS A 687 23.620 -2.869 -0.907 1.00 37.75 C ATOM 2320 CE LYS A 687 25.015 -3.288 -1.428 1.00 38.90 C ATOM 2321 NZ LYS A 687 24.981 -4.549 -2.228 1.00 40.52 N ATOM 2322 HA LYS A 687 22.743 1.195 -0.689 1.00 0.00 H ATOM 2323 HB2 LYS A 687 21.805 -1.412 0.586 1.00 0.00 H ATOM 2324 HB3 LYS A 687 21.604 -1.017 -1.137 1.00 0.00 H ATOM 2325 HG2 LYS A 687 24.051 -0.825 -1.370 1.00 0.00 H ATOM 2326 HG3 LYS A 687 24.240 -1.250 0.347 1.00 0.00 H ATOM 2327 HD2 LYS A 687 23.371 -3.459 -0.025 1.00 0.00 H ATOM 2328 HD3 LYS A 687 22.876 -3.047 -1.683 1.00 0.00 H ATOM 2329 HE2 LYS A 687 25.676 -3.435 -0.574 1.00 0.00 H ATOM 2330 HE3 LYS A 687 25.407 -2.488 -2.056 1.00 0.00 H ATOM 2331 HZ1 LYS A 687 24.617 -5.323 -1.637 1.00 0.00 H ATOM 2332 HZ2 LYS A 687 24.360 -4.419 -3.052 1.00 0.00 H ATOM 2333 HZ3 LYS A 687 25.943 -4.780 -2.550 1.00 0.00 H ATOM 2334 H LYS A 687 23.232 0.058 1.902 1.00 0.00 H ATOM 2335 N TRP A 688 20.240 1.619 1.233 1.00 25.39 N ATOM 2336 CA TRP A 688 18.904 2.293 1.311 1.00 25.89 C ATOM 2337 C TRP A 688 18.986 3.821 1.571 1.00 26.65 C ATOM 2338 O TRP A 688 17.957 4.517 1.617 1.00 24.58 O ATOM 2339 CB TRP A 688 18.057 1.666 2.411 1.00 25.54 C ATOM 2340 CG TRP A 688 17.521 0.297 2.009 1.00 24.65 C ATOM 2341 CD1 TRP A 688 16.226 -0.017 1.584 1.00 23.35 C ATOM 2342 CD2 TRP A 688 18.263 -0.922 1.968 1.00 21.57 C ATOM 2343 NE1 TRP A 688 16.149 -1.368 1.262 1.00 23.09 N ATOM 2344 CE2 TRP A 688 17.373 -1.946 1.521 1.00 24.25 C ATOM 2345 CE3 TRP A 688 19.602 -1.259 2.265 1.00 27.05 C ATOM 2346 CZ2 TRP A 688 17.785 -3.299 1.367 1.00 25.13 C ATOM 2347 CZ3 TRP A 688 20.008 -2.616 2.114 1.00 24.19 C ATOM 2348 CH2 TRP A 688 19.100 -3.602 1.652 1.00 25.35 C ATOM 2349 HA TRP A 688 18.449 2.149 0.331 1.00 0.00 H ATOM 2350 HB2 TRP A 688 18.668 1.556 3.307 1.00 0.00 H ATOM 2351 HB3 TRP A 688 17.215 2.324 2.626 1.00 0.00 H ATOM 2352 HE1 TRP A 688 15.311 -1.858 0.889 1.00 0.00 H ATOM 2353 HD1 TRP A 688 15.400 0.691 1.515 1.00 0.00 H ATOM 2354 HZ2 TRP A 688 17.087 -4.068 1.036 1.00 0.00 H ATOM 2355 HH2 TRP A 688 19.450 -4.626 1.519 1.00 0.00 H ATOM 2356 HZ3 TRP A 688 21.032 -2.900 2.357 1.00 0.00 H ATOM 2357 HE3 TRP A 688 20.307 -0.499 2.602 1.00 0.00 H ATOM 2358 H TRP A 688 20.767 1.445 2.112 1.00 0.00 H ATOM 2359 N LEU A 689 20.214 4.337 1.691 1.00 26.37 N ATOM 2360 CA LEU A 689 20.422 5.726 2.114 1.00 26.44 C ATOM 2361 C LEU A 689 20.541 6.741 0.978 1.00 26.69 C ATOM 2362 O LEU A 689 21.265 6.535 -0.020 1.00 25.65 O ATOM 2363 CB LEU A 689 21.653 5.824 3.041 1.00 27.40 C ATOM 2364 CG LEU A 689 21.586 5.210 4.418 1.00 27.10 C ATOM 2365 CD1 LEU A 689 22.947 5.318 5.165 1.00 28.02 C ATOM 2366 CD2 LEU A 689 20.431 5.795 5.271 1.00 27.93 C ATOM 2367 HA LEU A 689 19.512 5.998 2.649 1.00 0.00 H ATOM 2368 HB2 LEU A 689 22.484 5.349 2.520 1.00 0.00 H ATOM 2369 HB3 LEU A 689 21.868 6.884 3.174 1.00 0.00 H ATOM 2370 HG LEU A 689 21.370 4.152 4.272 1.00 0.00 H ATOM 2371 HD21 LEU A 689 20.575 6.869 5.388 1.00 0.00 H ATOM 2372 HD22 LEU A 689 19.481 5.607 4.771 1.00 0.00 H ATOM 2373 HD23 LEU A 689 20.428 5.319 6.252 1.00 0.00 H ATOM 2374 HD11 LEU A 689 23.716 4.797 4.594 1.00 0.00 H ATOM 2375 HD12 LEU A 689 23.220 6.368 5.270 1.00 0.00 H ATOM 2376 HD13 LEU A 689 22.855 4.864 6.152 1.00 0.00 H ATOM 2377 H LEU A 689 21.039 3.740 1.480 1.00 0.00 H ATOM 2378 N ALA A 690 19.827 7.859 1.131 1.00 25.87 N ATOM 2379 CA ALA A 690 19.830 8.888 0.095 1.00 26.05 C ATOM 2380 C ALA A 690 21.234 9.532 -0.020 1.00 26.44 C ATOM 2381 O ALA A 690 21.995 9.454 0.893 1.00 25.75 O ATOM 2382 CB ALA A 690 18.811 9.945 0.432 1.00 25.92 C ATOM 2383 HA ALA A 690 19.576 8.429 -0.861 1.00 0.00 H ATOM 2384 HB1 ALA A 690 17.822 9.490 0.489 1.00 0.00 H ATOM 2385 HB2 ALA A 690 19.061 10.396 1.393 1.00 0.00 H ATOM 2386 HB3 ALA A 690 18.815 10.712 -0.343 1.00 0.00 H ATOM 2387 H ALA A 690 19.264 7.998 1.995 1.00 0.00 H ATOM 2388 N LEU A 691 21.550 10.147 -1.147 1.00 27.60 N ATOM 2389 CA LEU A 691 22.821 10.913 -1.288 1.00 28.51 C ATOM 2390 C LEU A 691 23.146 11.816 -0.109 1.00 28.55 C ATOM 2391 O LEU A 691 24.256 11.766 0.446 1.00 28.84 O ATOM 2392 CB LEU A 691 22.822 11.730 -2.580 1.00 29.47 C ATOM 2393 CG LEU A 691 23.050 11.009 -3.901 1.00 31.78 C ATOM 2394 CD1 LEU A 691 22.586 11.883 -5.053 1.00 35.76 C ATOM 2395 CD2 LEU A 691 24.493 10.527 -4.127 1.00 33.81 C ATOM 2396 HA LEU A 691 23.606 10.157 -1.319 1.00 0.00 H ATOM 2397 HB2 LEU A 691 21.853 12.225 -2.648 1.00 0.00 H ATOM 2398 HB3 LEU A 691 23.606 12.481 -2.484 1.00 0.00 H ATOM 2399 HG LEU A 691 22.453 10.099 -3.854 1.00 0.00 H ATOM 2400 HD21 LEU A 691 25.167 11.383 -4.113 1.00 0.00 H ATOM 2401 HD22 LEU A 691 24.771 9.832 -3.335 1.00 0.00 H ATOM 2402 HD23 LEU A 691 24.560 10.025 -5.092 1.00 0.00 H ATOM 2403 HD11 LEU A 691 21.524 12.099 -4.939 1.00 0.00 H ATOM 2404 HD12 LEU A 691 23.150 12.816 -5.050 1.00 0.00 H ATOM 2405 HD13 LEU A 691 22.753 11.360 -5.994 1.00 0.00 H ATOM 2406 H LEU A 691 20.896 10.095 -1.954 1.00 0.00 H ATOM 2407 N GLU A 692 22.166 12.605 0.335 1.00 28.29 N ATOM 2408 CA GLU A 692 22.414 13.578 1.381 1.00 27.49 C ATOM 2409 C GLU A 692 22.522 12.976 2.778 1.00 27.94 C ATOM 2410 O GLU A 692 23.161 13.545 3.652 1.00 27.78 O ATOM 2411 CB GLU A 692 21.381 14.733 1.340 1.00 28.02 C ATOM 2412 CG GLU A 692 19.927 14.369 1.805 1.00 25.69 C ATOM 2413 CD GLU A 692 19.083 13.637 0.782 1.00 26.14 C ATOM 2414 OE1 GLU A 692 19.576 13.334 -0.321 1.00 25.95 O ATOM 2415 OE2 GLU A 692 17.879 13.362 1.074 1.00 25.85 O ATOM 2416 HA GLU A 692 23.400 13.990 1.165 1.00 0.00 H ATOM 2417 HB2 GLU A 692 21.748 15.532 1.984 1.00 0.00 H ATOM 2418 HB3 GLU A 692 21.323 15.093 0.313 1.00 0.00 H ATOM 2419 HG2 GLU A 692 20.005 13.739 2.691 1.00 0.00 H ATOM 2420 HG3 GLU A 692 19.414 15.295 2.064 1.00 0.00 H ATOM 2421 H GLU A 692 21.213 12.521 -0.074 1.00 0.00 H ATOM 2422 N SER A 693 21.918 11.805 2.990 1.00 26.93 N ATOM 2423 CA SER A 693 22.188 11.043 4.180 1.00 26.37 C ATOM 2424 C SER A 693 23.621 10.501 4.207 1.00 26.74 C ATOM 2425 O SER A 693 24.229 10.471 5.260 1.00 27.67 O ATOM 2426 CB SER A 693 21.204 9.853 4.288 1.00 26.69 C ATOM 2427 OG SER A 693 19.852 10.301 4.166 1.00 22.73 O ATOM 2428 HA SER A 693 22.060 11.720 5.025 1.00 0.00 H ATOM 2429 HB2 SER A 693 21.334 9.368 5.255 1.00 0.00 H ATOM 2430 HB3 SER A 693 21.417 9.139 3.493 1.00 0.00 H ATOM 2431 HG SER A 693 19.653 10.947 4.889 1.00 0.00 H ATOM 2432 H SER A 693 21.245 11.439 2.287 1.00 0.00 H ATOM 2433 N LEU A 694 24.102 10.000 3.081 1.00 27.42 N ATOM 2434 CA LEU A 694 25.448 9.448 3.006 1.00 29.88 C ATOM 2435 C LEU A 694 26.480 10.573 3.163 1.00 31.52 C ATOM 2436 O LEU A 694 27.430 10.422 3.911 1.00 32.49 O ATOM 2437 CB LEU A 694 25.671 8.750 1.680 1.00 29.95 C ATOM 2438 CG LEU A 694 24.923 7.424 1.490 1.00 30.12 C ATOM 2439 CD1 LEU A 694 24.827 7.074 0.036 1.00 31.68 C ATOM 2440 CD2 LEU A 694 25.559 6.291 2.275 1.00 32.61 C ATOM 2441 HA LEU A 694 25.564 8.722 3.810 1.00 0.00 H ATOM 2442 HB2 LEU A 694 25.356 9.429 0.887 1.00 0.00 H ATOM 2443 HB3 LEU A 694 26.738 8.550 1.582 1.00 0.00 H ATOM 2444 HG LEU A 694 23.916 7.562 1.884 1.00 0.00 H ATOM 2445 HD21 LEU A 694 26.587 6.152 1.941 1.00 0.00 H ATOM 2446 HD22 LEU A 694 25.550 6.537 3.337 1.00 0.00 H ATOM 2447 HD23 LEU A 694 24.994 5.374 2.109 1.00 0.00 H ATOM 2448 HD11 LEU A 694 24.289 7.862 -0.491 1.00 0.00 H ATOM 2449 HD12 LEU A 694 25.830 6.976 -0.380 1.00 0.00 H ATOM 2450 HD13 LEU A 694 24.293 6.130 -0.075 1.00 0.00 H ATOM 2451 H LEU A 694 23.505 10.000 2.229 1.00 0.00 H ATOM 2452 N ALA A 695 26.251 11.707 2.494 1.00 33.08 N ATOM 2453 CA ALA A 695 27.247 12.808 2.443 1.00 33.67 C ATOM 2454 C ALA A 695 27.154 13.789 3.617 1.00 34.45 C ATOM 2455 O ALA A 695 28.170 14.293 4.114 1.00 34.50 O ATOM 2456 CB ALA A 695 27.146 13.542 1.105 1.00 33.69 C ATOM 2457 HA ALA A 695 28.228 12.342 2.535 1.00 0.00 H ATOM 2458 HB1 ALA A 695 27.342 12.842 0.292 1.00 0.00 H ATOM 2459 HB2 ALA A 695 26.144 13.958 0.995 1.00 0.00 H ATOM 2460 HB3 ALA A 695 27.880 14.347 1.077 1.00 0.00 H ATOM 2461 H ALA A 695 25.347 11.822 1.993 1.00 0.00 H ATOM 2462 N ASP A 696 25.942 14.058 4.077 1.00 34.28 N ATOM 2463 CA ASP A 696 25.759 15.069 5.097 1.00 34.29 C ATOM 2464 C ASP A 696 25.066 14.583 6.346 1.00 34.44 C ATOM 2465 O ASP A 696 24.760 15.381 7.211 1.00 34.55 O ATOM 2466 CB ASP A 696 25.025 16.288 4.519 1.00 34.82 C ATOM 2467 CG ASP A 696 25.971 17.230 3.767 1.00 33.30 C ATOM 2468 OD1 ASP A 696 26.698 18.004 4.418 1.00 36.14 O ATOM 2469 OD2 ASP A 696 25.965 17.213 2.544 1.00 35.51 O ATOM 2470 HA ASP A 696 26.764 15.350 5.411 1.00 0.00 H ATOM 2471 HB2 ASP A 696 24.255 15.940 3.831 1.00 0.00 H ATOM 2472 HB3 ASP A 696 24.559 16.838 5.337 1.00 0.00 H ATOM 2473 H ASP A 696 25.119 13.542 3.705 1.00 0.00 H ATOM 2474 N ASN A 697 24.833 13.272 6.450 1.00 34.57 N ATOM 2475 CA ASN A 697 24.084 12.734 7.585 1.00 34.66 C ATOM 2476 C ASN A 697 22.723 13.380 7.831 1.00 33.18 C ATOM 2477 O ASN A 697 22.309 13.553 8.969 1.00 33.38 O ATOM 2478 CB ASN A 697 24.917 12.772 8.867 1.00 36.50 C ATOM 2479 CG ASN A 697 25.533 11.443 9.177 1.00 41.14 C ATOM 2480 OD1 ASN A 697 24.972 10.660 9.957 1.00 47.37 O ATOM 2481 ND2 ASN A 697 26.663 11.136 8.525 1.00 43.86 N ATOM 2482 HA ASN A 697 23.875 11.702 7.303 1.00 0.00 H ATOM 2483 HB2 ASN A 697 25.711 13.509 8.749 1.00 0.00 H ATOM 2484 HB3 ASN A 697 24.273 13.064 9.697 1.00 0.00 H ATOM 2485 HD22 ASN A 697 27.096 11.828 7.880 1.00 0.00 H ATOM 2486 HD21 ASN A 697 27.107 10.206 8.664 1.00 0.00 H ATOM 2487 H ASN A 697 25.188 12.627 5.716 1.00 0.00 H ATOM 2488 N LEU A 698 22.040 13.740 6.757 1.00 31.98 N ATOM 2489 CA LEU A 698 20.751 14.411 6.818 1.00 31.59 C ATOM 2490 C LEU A 698 19.619 13.384 6.631 1.00 30.63 C ATOM 2491 O LEU A 698 19.565 12.739 5.608 1.00 31.07 O ATOM 2492 CB LEU A 698 20.666 15.434 5.677 1.00 31.40 C ATOM 2493 CG LEU A 698 19.529 16.446 5.644 1.00 33.82 C ATOM 2494 CD1 LEU A 698 19.270 17.071 7.021 1.00 36.82 C ATOM 2495 CD2 LEU A 698 19.824 17.543 4.590 1.00 37.31 C ATOM 2496 HA LEU A 698 20.649 14.903 7.785 1.00 0.00 H ATOM 2497 HB2 LEU A 698 21.595 16.004 5.696 1.00 0.00 H ATOM 2498 HB3 LEU A 698 20.609 14.866 4.749 1.00 0.00 H ATOM 2499 HG LEU A 698 18.621 15.913 5.361 1.00 0.00 H ATOM 2500 HD21 LEU A 698 20.751 18.054 4.849 1.00 0.00 H ATOM 2501 HD22 LEU A 698 19.923 17.083 3.607 1.00 0.00 H ATOM 2502 HD23 LEU A 698 19.004 18.261 4.575 1.00 0.00 H ATOM 2503 HD11 LEU A 698 19.006 16.287 7.731 1.00 0.00 H ATOM 2504 HD12 LEU A 698 20.170 17.583 7.361 1.00 0.00 H ATOM 2505 HD13 LEU A 698 18.451 17.786 6.946 1.00 0.00 H ATOM 2506 H LEU A 698 22.445 13.533 5.822 1.00 0.00 H ATOM 2507 N TYR A 699 18.721 13.281 7.601 1.00 29.96 N ATOM 2508 CA TYR A 699 17.587 12.342 7.537 1.00 29.09 C ATOM 2509 C TYR A 699 16.303 13.131 7.618 1.00 28.59 C ATOM 2510 O TYR A 699 16.044 13.806 8.620 1.00 28.85 O ATOM 2511 CB TYR A 699 17.668 11.325 8.682 1.00 28.65 C ATOM 2512 CG TYR A 699 18.841 10.390 8.539 1.00 30.47 C ATOM 2513 CD1 TYR A 699 18.683 9.119 7.966 1.00 30.92 C ATOM 2514 CD2 TYR A 699 20.122 10.775 8.955 1.00 30.67 C ATOM 2515 CE1 TYR A 699 19.747 8.267 7.825 1.00 33.21 C ATOM 2516 CE2 TYR A 699 21.201 9.918 8.813 1.00 33.32 C ATOM 2517 CZ TYR A 699 21.014 8.670 8.240 1.00 34.64 C ATOM 2518 OH TYR A 699 22.080 7.809 8.082 1.00 33.64 O ATOM 2519 HA TYR A 699 17.619 11.789 6.598 1.00 0.00 H ATOM 2520 HB3 TYR A 699 16.751 10.737 8.693 1.00 0.00 H ATOM 2521 HB2 TYR A 699 17.763 11.865 9.624 1.00 0.00 H ATOM 2522 HD2 TYR A 699 20.272 11.761 9.396 1.00 0.00 H ATOM 2523 HE2 TYR A 699 22.192 10.223 9.150 1.00 0.00 H ATOM 2524 HE1 TYR A 699 19.602 7.278 7.390 1.00 0.00 H ATOM 2525 HD1 TYR A 699 17.696 8.804 7.627 1.00 0.00 H ATOM 2526 HH TYR A 699 21.766 6.971 7.660 1.00 0.00 H ATOM 2527 H TYR A 699 18.821 13.887 8.440 1.00 0.00 H ATOM 2528 N THR A 700 15.488 13.029 6.577 1.00 27.32 N ATOM 2529 CA THR A 700 14.234 13.768 6.500 1.00 26.80 C ATOM 2530 C THR A 700 13.154 12.835 5.955 1.00 26.70 C ATOM 2531 O THR A 700 13.429 11.668 5.663 1.00 25.59 O ATOM 2532 CB THR A 700 14.363 14.915 5.490 1.00 27.07 C ATOM 2533 OG1 THR A 700 14.759 14.376 4.231 1.00 25.83 O ATOM 2534 CG2 THR A 700 15.407 16.009 5.968 1.00 28.14 C ATOM 2535 HA THR A 700 13.989 14.149 7.491 1.00 0.00 H ATOM 2536 HB THR A 700 13.396 15.410 5.403 1.00 0.00 H ATOM 2537 HG1 THR A 700 15.630 13.916 4.330 1.00 0.00 H ATOM 2538 HG23 THR A 700 15.093 16.413 6.931 1.00 0.00 H ATOM 2539 HG21 THR A 700 16.391 15.551 6.068 1.00 0.00 H ATOM 2540 HG22 THR A 700 15.452 16.812 5.233 1.00 0.00 H ATOM 2541 H THR A 700 15.752 12.402 5.791 1.00 0.00 H ATOM 2542 N VAL A 701 11.941 13.355 5.767 1.00 25.89 N ATOM 2543 CA VAL A 701 10.941 12.612 5.028 1.00 25.26 C ATOM 2544 C VAL A 701 11.432 12.245 3.605 1.00 25.15 C ATOM 2545 O VAL A 701 11.077 11.181 3.081 1.00 23.68 O ATOM 2546 CB VAL A 701 9.557 13.341 4.997 1.00 26.77 C ATOM 2547 CG1 VAL A 701 9.666 14.646 4.272 1.00 26.85 C ATOM 2548 CG2 VAL A 701 8.508 12.455 4.310 1.00 26.08 C ATOM 2549 HA VAL A 701 10.786 11.677 5.567 1.00 0.00 H ATOM 2550 HB VAL A 701 9.248 13.534 6.024 1.00 0.00 H ATOM 2551 HG11 VAL A 701 10.390 15.283 4.780 1.00 0.00 H ATOM 2552 HG12 VAL A 701 9.994 14.465 3.248 1.00 0.00 H ATOM 2553 HG13 VAL A 701 8.693 15.137 4.262 1.00 0.00 H ATOM 2554 HG21 VAL A 701 8.825 12.245 3.288 1.00 0.00 H ATOM 2555 HG22 VAL A 701 8.408 11.520 4.860 1.00 0.00 H ATOM 2556 HG23 VAL A 701 7.550 12.974 4.295 1.00 0.00 H ATOM 2557 H VAL A 701 11.713 14.294 6.151 1.00 0.00 H ATOM 2558 N HIS A 702 12.269 13.099 3.003 1.00 23.53 N ATOM 2559 CA HIS A 702 12.721 12.875 1.635 1.00 22.62 C ATOM 2560 C HIS A 702 13.731 11.729 1.519 1.00 21.27 C ATOM 2561 O HIS A 702 13.835 11.076 0.463 1.00 21.49 O ATOM 2562 CB HIS A 702 13.379 14.133 1.044 1.00 23.42 C ATOM 2563 CG HIS A 702 12.564 15.381 1.214 1.00 26.68 C ATOM 2564 ND1 HIS A 702 11.298 15.519 0.691 1.00 27.98 N ATOM 2565 CD2 HIS A 702 12.846 16.557 1.832 1.00 30.09 C ATOM 2566 CE1 HIS A 702 10.830 16.720 0.974 1.00 27.62 C ATOM 2567 NE2 HIS A 702 11.740 17.367 1.681 1.00 30.43 N ATOM 2568 HA HIS A 702 11.819 12.616 1.080 1.00 0.00 H ATOM 2569 HB2 HIS A 702 14.341 14.281 1.535 1.00 0.00 H ATOM 2570 HB3 HIS A 702 13.538 13.969 -0.022 1.00 0.00 H ATOM 2571 HD2 HIS A 702 13.771 16.812 2.349 1.00 0.00 H ATOM 2572 HE1 HIS A 702 9.858 17.112 0.675 1.00 0.00 H ATOM 2573 H HIS A 702 12.603 13.937 3.520 1.00 0.00 H ATOM 2574 N SER A 703 14.506 11.540 2.565 1.00 20.40 N ATOM 2575 CA SER A 703 15.390 10.386 2.605 1.00 20.63 C ATOM 2576 C SER A 703 14.598 9.104 2.956 1.00 20.00 C ATOM 2577 O SER A 703 14.964 7.997 2.502 1.00 18.39 O ATOM 2578 CB SER A 703 16.577 10.614 3.559 1.00 19.31 C ATOM 2579 OG SER A 703 16.185 10.779 4.928 1.00 22.73 O ATOM 2580 HA SER A 703 15.814 10.249 1.610 1.00 0.00 H ATOM 2581 HB2 SER A 703 17.108 11.511 3.241 1.00 0.00 H ATOM 2582 HB3 SER A 703 17.244 9.755 3.492 1.00 0.00 H ATOM 2583 HG SER A 703 15.709 9.967 5.234 1.00 0.00 H ATOM 2584 H SER A 703 14.487 12.212 3.359 1.00 0.00 H ATOM 2585 N ASP A 704 13.552 9.239 3.772 1.00 20.17 N ATOM 2586 CA ASP A 704 12.586 8.105 3.947 1.00 20.33 C ATOM 2587 C ASP A 704 11.975 7.688 2.631 1.00 19.82 C ATOM 2588 O ASP A 704 11.797 6.465 2.395 1.00 18.98 O ATOM 2589 CB ASP A 704 11.473 8.352 5.002 1.00 19.84 C ATOM 2590 CG ASP A 704 11.907 8.087 6.418 1.00 19.40 C ATOM 2591 OD1 ASP A 704 13.036 7.620 6.659 1.00 20.76 O ATOM 2592 OD2 ASP A 704 11.111 8.384 7.337 1.00 21.27 O ATOM 2593 HA ASP A 704 13.194 7.291 4.341 1.00 0.00 H ATOM 2594 HB2 ASP A 704 11.155 9.392 4.929 1.00 0.00 H ATOM 2595 HB3 ASP A 704 10.631 7.699 4.773 1.00 0.00 H ATOM 2596 H ASP A 704 13.406 10.131 4.287 1.00 0.00 H ATOM 2597 N VAL A 705 11.704 8.668 1.748 1.00 20.90 N ATOM 2598 CA VAL A 705 11.094 8.411 0.451 1.00 20.38 C ATOM 2599 C VAL A 705 12.094 7.692 -0.472 1.00 21.00 C ATOM 2600 O VAL A 705 11.730 6.776 -1.194 1.00 19.00 O ATOM 2601 CB VAL A 705 10.558 9.719 -0.235 1.00 20.95 C ATOM 2602 CG1 VAL A 705 10.317 9.489 -1.709 1.00 21.85 C ATOM 2603 CG2 VAL A 705 9.239 10.142 0.393 1.00 20.52 C ATOM 2604 HA VAL A 705 10.231 7.768 0.624 1.00 0.00 H ATOM 2605 HB VAL A 705 11.311 10.495 -0.097 1.00 0.00 H ATOM 2606 HG11 VAL A 705 11.252 9.197 -2.188 1.00 0.00 H ATOM 2607 HG12 VAL A 705 9.580 8.696 -1.836 1.00 0.00 H ATOM 2608 HG13 VAL A 705 9.946 10.408 -2.163 1.00 0.00 H ATOM 2609 HG21 VAL A 705 8.505 9.346 0.265 1.00 0.00 H ATOM 2610 HG22 VAL A 705 9.389 10.333 1.456 1.00 0.00 H ATOM 2611 HG23 VAL A 705 8.881 11.049 -0.093 1.00 0.00 H ATOM 2612 H VAL A 705 11.940 9.648 2.003 1.00 0.00 H ATOM 2613 N TRP A 706 13.361 8.132 -0.456 1.00 20.30 N ATOM 2614 CA TRP A 706 14.417 7.407 -1.216 1.00 20.60 C ATOM 2615 C TRP A 706 14.434 5.905 -0.805 1.00 18.69 C ATOM 2616 O TRP A 706 14.442 5.040 -1.654 1.00 20.51 O ATOM 2617 CB TRP A 706 15.784 8.061 -0.941 1.00 20.02 C ATOM 2618 CG TRP A 706 16.936 7.407 -1.623 1.00 23.80 C ATOM 2619 CD1 TRP A 706 17.395 6.138 -1.434 1.00 24.82 C ATOM 2620 CD2 TRP A 706 17.788 8.002 -2.608 1.00 26.07 C ATOM 2621 NE1 TRP A 706 18.493 5.894 -2.257 1.00 24.58 N ATOM 2622 CE2 TRP A 706 18.746 7.020 -2.989 1.00 24.36 C ATOM 2623 CE3 TRP A 706 17.854 9.285 -3.190 1.00 26.47 C ATOM 2624 CZ2 TRP A 706 19.753 7.273 -3.929 1.00 27.68 C ATOM 2625 CZ3 TRP A 706 18.851 9.534 -4.130 1.00 27.66 C ATOM 2626 CH2 TRP A 706 19.777 8.530 -4.503 1.00 26.12 C ATOM 2627 HA TRP A 706 14.205 7.466 -2.283 1.00 0.00 H ATOM 2628 HB2 TRP A 706 15.737 9.098 -1.273 1.00 0.00 H ATOM 2629 HB3 TRP A 706 15.964 8.032 0.134 1.00 0.00 H ATOM 2630 HE1 TRP A 706 19.030 5.004 -2.306 1.00 0.00 H ATOM 2631 HD1 TRP A 706 16.965 5.417 -0.739 1.00 0.00 H ATOM 2632 HZ2 TRP A 706 20.486 6.512 -4.196 1.00 0.00 H ATOM 2633 HH2 TRP A 706 20.527 8.754 -5.261 1.00 0.00 H ATOM 2634 HZ3 TRP A 706 18.920 10.521 -4.587 1.00 0.00 H ATOM 2635 HE3 TRP A 706 17.143 10.062 -2.911 1.00 0.00 H ATOM 2636 H TRP A 706 13.607 8.983 0.089 1.00 0.00 H ATOM 2637 N ALA A 707 14.435 5.624 0.490 1.00 18.97 N ATOM 2638 CA ALA A 707 14.484 4.233 0.997 1.00 19.21 C ATOM 2639 C ALA A 707 13.201 3.506 0.650 1.00 19.63 C ATOM 2640 O ALA A 707 13.213 2.306 0.445 1.00 19.72 O ATOM 2641 CB ALA A 707 14.638 4.218 2.483 1.00 19.08 C ATOM 2642 HA ALA A 707 15.337 3.740 0.532 1.00 0.00 H ATOM 2643 HB1 ALA A 707 15.563 4.726 2.756 1.00 0.00 H ATOM 2644 HB2 ALA A 707 13.792 4.731 2.940 1.00 0.00 H ATOM 2645 HB3 ALA A 707 14.672 3.186 2.833 1.00 0.00 H ATOM 2646 H ALA A 707 14.400 6.407 1.174 1.00 0.00 H ATOM 2647 N PHE A 708 12.087 4.244 0.573 1.00 17.27 N ATOM 2648 CA PHE A 708 10.844 3.638 0.074 1.00 17.88 C ATOM 2649 C PHE A 708 11.036 3.191 -1.347 1.00 18.99 C ATOM 2650 O PHE A 708 10.629 2.077 -1.722 1.00 18.95 O ATOM 2651 CB PHE A 708 9.648 4.623 0.200 1.00 18.41 C ATOM 2652 CG PHE A 708 8.335 4.023 -0.279 1.00 20.39 C ATOM 2653 CD1 PHE A 708 7.638 3.117 0.496 1.00 22.47 C ATOM 2654 CD2 PHE A 708 7.837 4.343 -1.532 1.00 22.09 C ATOM 2655 CE1 PHE A 708 6.413 2.563 0.015 1.00 23.73 C ATOM 2656 CE2 PHE A 708 6.661 3.809 -2.012 1.00 22.06 C ATOM 2657 CZ PHE A 708 5.953 2.895 -1.242 1.00 23.13 C ATOM 2658 HA PHE A 708 10.607 2.767 0.686 1.00 0.00 H ATOM 2659 HB2 PHE A 708 9.540 4.907 1.247 1.00 0.00 H ATOM 2660 HB3 PHE A 708 9.863 5.510 -0.396 1.00 0.00 H ATOM 2661 HD2 PHE A 708 8.394 5.040 -2.158 1.00 0.00 H ATOM 2662 HE2 PHE A 708 6.287 4.103 -2.993 1.00 0.00 H ATOM 2663 HZ PHE A 708 5.040 2.443 -1.629 1.00 0.00 H ATOM 2664 HE1 PHE A 708 5.842 1.878 0.641 1.00 0.00 H ATOM 2665 HD1 PHE A 708 8.022 2.825 1.473 1.00 0.00 H ATOM 2666 H PHE A 708 12.101 5.242 0.865 1.00 0.00 H ATOM 2667 N GLY A 709 11.700 4.025 -2.144 1.00 20.01 N ATOM 2668 CA GLY A 709 11.976 3.649 -3.538 1.00 21.08 C ATOM 2669 C GLY A 709 12.827 2.383 -3.659 1.00 21.21 C ATOM 2670 O GLY A 709 12.563 1.485 -4.497 1.00 21.83 O ATOM 2671 HA3 GLY A 709 12.505 4.471 -4.021 1.00 0.00 H ATOM 2672 HA2 GLY A 709 11.027 3.480 -4.047 1.00 0.00 H ATOM 2673 H GLY A 709 12.024 4.944 -1.780 1.00 0.00 H ATOM 2674 N VAL A 710 13.864 2.308 -2.846 1.00 21.93 N ATOM 2675 CA VAL A 710 14.653 1.066 -2.780 1.00 21.98 C ATOM 2676 C VAL A 710 13.771 -0.135 -2.370 1.00 21.48 C ATOM 2677 O VAL A 710 13.854 -1.242 -2.943 1.00 21.90 O ATOM 2678 CB VAL A 710 15.864 1.203 -1.859 1.00 22.44 C ATOM 2679 CG1 VAL A 710 16.808 -0.031 -2.058 1.00 20.86 C ATOM 2680 CG2 VAL A 710 16.648 2.544 -2.129 1.00 22.24 C ATOM 2681 HA VAL A 710 15.035 0.876 -3.783 1.00 0.00 H ATOM 2682 HB VAL A 710 15.512 1.234 -0.828 1.00 0.00 H ATOM 2683 HG11 VAL A 710 16.266 -0.945 -1.815 1.00 0.00 H ATOM 2684 HG12 VAL A 710 17.140 -0.069 -3.095 1.00 0.00 H ATOM 2685 HG13 VAL A 710 17.673 0.065 -1.401 1.00 0.00 H ATOM 2686 HG21 VAL A 710 16.996 2.558 -3.162 1.00 0.00 H ATOM 2687 HG22 VAL A 710 15.985 3.392 -1.956 1.00 0.00 H ATOM 2688 HG23 VAL A 710 17.502 2.606 -1.455 1.00 0.00 H ATOM 2689 H VAL A 710 14.123 3.123 -2.254 1.00 0.00 H ATOM 2690 N THR A 711 12.901 0.083 -1.390 1.00 22.28 N ATOM 2691 CA THR A 711 11.962 -0.940 -0.977 1.00 21.89 C ATOM 2692 C THR A 711 11.018 -1.414 -2.096 1.00 22.86 C ATOM 2693 O THR A 711 10.785 -2.645 -2.246 1.00 22.04 O ATOM 2694 CB THR A 711 11.155 -0.509 0.249 1.00 22.03 C ATOM 2695 OG1 THR A 711 12.060 -0.102 1.290 1.00 20.76 O ATOM 2696 CG2 THR A 711 10.319 -1.681 0.767 1.00 21.50 C ATOM 2697 HA THR A 711 12.582 -1.796 -0.712 1.00 0.00 H ATOM 2698 HB THR A 711 10.498 0.314 -0.032 1.00 0.00 H ATOM 2699 HG1 THR A 711 12.610 0.656 0.970 1.00 0.00 H ATOM 2700 HG23 THR A 711 9.626 -2.003 -0.010 1.00 0.00 H ATOM 2701 HG21 THR A 711 10.979 -2.507 1.032 1.00 0.00 H ATOM 2702 HG22 THR A 711 9.758 -1.365 1.647 1.00 0.00 H ATOM 2703 H THR A 711 12.894 1.006 -0.910 1.00 0.00 H ATOM 2704 N MET A 712 10.492 -0.472 -2.883 1.00 23.50 N ATOM 2705 CA MET A 712 9.721 -0.825 -4.099 1.00 24.62 C ATOM 2706 C MET A 712 10.548 -1.733 -5.034 1.00 25.70 C ATOM 2707 O MET A 712 10.030 -2.719 -5.594 1.00 26.21 O ATOM 2708 CB MET A 712 9.316 0.426 -4.866 1.00 24.01 C ATOM 2709 CG MET A 712 8.259 1.338 -4.160 1.00 26.43 C ATOM 2710 SD MET A 712 8.026 2.780 -5.222 1.00 28.12 S ATOM 2711 CE MET A 712 9.213 3.941 -4.632 1.00 39.49 C ATOM 2712 HA MET A 712 8.828 -1.358 -3.772 1.00 0.00 H ATOM 2713 HB2 MET A 712 10.213 1.021 -5.036 1.00 0.00 H ATOM 2714 HB3 MET A 712 8.903 0.113 -5.825 1.00 0.00 H ATOM 2715 HG2 MET A 712 8.624 1.647 -3.181 1.00 0.00 H ATOM 2716 HG3 MET A 712 7.318 0.801 -4.043 1.00 0.00 H ATOM 2717 HE1 MET A 712 9.011 4.165 -3.585 1.00 0.00 H ATOM 2718 HE2 MET A 712 10.213 3.517 -4.728 1.00 0.00 H ATOM 2719 HE3 MET A 712 9.147 4.857 -5.220 1.00 0.00 H ATOM 2720 H MET A 712 10.626 0.530 -2.638 1.00 0.00 H ATOM 2721 N TRP A 713 11.825 -1.390 -5.222 1.00 25.37 N ATOM 2722 CA TRP A 713 12.726 -2.214 -6.075 1.00 25.09 C ATOM 2723 C TRP A 713 12.933 -3.622 -5.524 1.00 24.92 C ATOM 2724 O TRP A 713 12.853 -4.586 -6.284 1.00 26.00 O ATOM 2725 CB TRP A 713 14.069 -1.501 -6.298 1.00 25.41 C ATOM 2726 CG TRP A 713 14.995 -2.197 -7.268 1.00 25.92 C ATOM 2727 CD1 TRP A 713 15.091 -1.975 -8.612 1.00 28.34 C ATOM 2728 CD2 TRP A 713 15.966 -3.186 -6.950 1.00 27.44 C ATOM 2729 NE1 TRP A 713 16.069 -2.775 -9.153 1.00 30.30 N ATOM 2730 CE2 TRP A 713 16.619 -3.533 -8.154 1.00 29.15 C ATOM 2731 CE3 TRP A 713 16.343 -3.829 -5.761 1.00 30.39 C ATOM 2732 CZ2 TRP A 713 17.641 -4.502 -8.206 1.00 31.94 C ATOM 2733 CZ3 TRP A 713 17.351 -4.793 -5.811 1.00 32.39 C ATOM 2734 CH2 TRP A 713 17.987 -5.113 -7.025 1.00 32.99 C ATOM 2735 HA TRP A 713 12.231 -2.330 -7.039 1.00 0.00 H ATOM 2736 HB2 TRP A 713 13.864 -0.501 -6.680 1.00 0.00 H ATOM 2737 HB3 TRP A 713 14.578 -1.424 -5.337 1.00 0.00 H ATOM 2738 HE1 TRP A 713 16.346 -2.800 -10.155 1.00 0.00 H ATOM 2739 HD1 TRP A 713 14.481 -1.267 -9.173 1.00 0.00 H ATOM 2740 HZ2 TRP A 713 18.136 -4.756 -9.143 1.00 0.00 H ATOM 2741 HH2 TRP A 713 18.775 -5.866 -7.028 1.00 0.00 H ATOM 2742 HZ3 TRP A 713 17.650 -5.305 -4.897 1.00 0.00 H ATOM 2743 HE3 TRP A 713 15.858 -3.580 -4.817 1.00 0.00 H ATOM 2744 H TRP A 713 12.197 -0.533 -4.765 1.00 0.00 H ATOM 2745 N GLU A 714 13.123 -3.750 -4.211 1.00 25.58 N ATOM 2746 CA GLU A 714 13.198 -5.046 -3.529 1.00 25.83 C ATOM 2747 C GLU A 714 11.920 -5.877 -3.753 1.00 26.50 C ATOM 2748 O GLU A 714 11.970 -7.092 -4.012 1.00 26.46 O ATOM 2749 CB GLU A 714 13.360 -4.903 -2.010 1.00 24.74 C ATOM 2750 CG GLU A 714 14.641 -4.176 -1.451 1.00 24.35 C ATOM 2751 CD GLU A 714 14.626 -4.221 0.005 1.00 24.06 C ATOM 2752 OE1 GLU A 714 14.126 -3.270 0.655 1.00 24.06 O ATOM 2753 OE2 GLU A 714 15.029 -5.271 0.560 1.00 23.59 O ATOM 2754 HA GLU A 714 14.071 -5.539 -3.957 1.00 0.00 H ATOM 2755 HB2 GLU A 714 12.493 -4.352 -1.645 1.00 0.00 H ATOM 2756 HB3 GLU A 714 13.353 -5.909 -1.590 1.00 0.00 H ATOM 2757 HG2 GLU A 714 15.535 -4.678 -1.822 1.00 0.00 H ATOM 2758 HG3 GLU A 714 14.644 -3.138 -1.783 1.00 0.00 H ATOM 2759 H GLU A 714 13.223 -2.886 -3.641 1.00 0.00 H ATOM 2760 N ILE A 715 10.769 -5.235 -3.589 1.00 27.26 N ATOM 2761 CA ILE A 715 9.475 -5.891 -3.872 1.00 27.48 C ATOM 2762 C ILE A 715 9.430 -6.396 -5.313 1.00 28.16 C ATOM 2763 O ILE A 715 9.090 -7.553 -5.541 1.00 28.92 O ATOM 2764 CB ILE A 715 8.259 -4.965 -3.523 1.00 27.05 C ATOM 2765 CG1 ILE A 715 8.144 -4.825 -2.010 1.00 24.91 C ATOM 2766 CG2 ILE A 715 6.929 -5.533 -4.067 1.00 27.70 C ATOM 2767 CD1 ILE A 715 7.250 -3.691 -1.549 1.00 24.50 C ATOM 2768 HA ILE A 715 9.388 -6.759 -3.219 1.00 0.00 H ATOM 2769 HB ILE A 715 8.438 -3.997 -3.990 1.00 0.00 H ATOM 2770 HG12 ILE A 715 7.745 -5.757 -1.611 1.00 0.00 H ATOM 2771 HG13 ILE A 715 9.143 -4.657 -1.607 1.00 0.00 H ATOM 2772 HD11 ILE A 715 7.640 -2.746 -1.926 1.00 0.00 H ATOM 2773 HD12 ILE A 715 6.241 -3.847 -1.931 1.00 0.00 H ATOM 2774 HD13 ILE A 715 7.228 -3.667 -0.459 1.00 0.00 H ATOM 2775 HG21 ILE A 715 6.990 -5.623 -5.152 1.00 0.00 H ATOM 2776 HG22 ILE A 715 6.749 -6.515 -3.629 1.00 0.00 H ATOM 2777 HG23 ILE A 715 6.113 -4.860 -3.803 1.00 0.00 H ATOM 2778 H ILE A 715 10.778 -4.250 -3.255 1.00 0.00 H ATOM 2779 N MET A 716 9.814 -5.562 -6.277 1.00 30.11 N ATOM 2780 CA MET A 716 9.754 -5.964 -7.682 1.00 31.33 C ATOM 2781 C MET A 716 10.776 -7.017 -8.101 1.00 32.51 C ATOM 2782 O MET A 716 10.570 -7.729 -9.087 1.00 34.18 O ATOM 2783 CB MET A 716 9.793 -4.768 -8.619 1.00 31.98 C ATOM 2784 CG MET A 716 8.608 -3.821 -8.421 1.00 34.32 C ATOM 2785 SD MET A 716 6.934 -4.491 -8.680 1.00 36.73 S ATOM 2786 CE MET A 716 6.576 -5.385 -7.206 1.00 40.28 C ATOM 2787 HA MET A 716 8.784 -6.454 -7.774 1.00 0.00 H ATOM 2788 HB2 MET A 716 10.715 -4.215 -8.440 1.00 0.00 H ATOM 2789 HB3 MET A 716 9.782 -5.130 -9.647 1.00 0.00 H ATOM 2790 HG2 MET A 716 8.737 -2.989 -9.114 1.00 0.00 H ATOM 2791 HG3 MET A 716 8.655 -3.450 -7.397 1.00 0.00 H ATOM 2792 HE1 MET A 716 7.313 -6.177 -7.075 1.00 0.00 H ATOM 2793 HE2 MET A 716 6.613 -4.707 -6.353 1.00 0.00 H ATOM 2794 HE3 MET A 716 5.580 -5.822 -7.281 1.00 0.00 H ATOM 2795 H MET A 716 10.161 -4.614 -6.028 1.00 0.00 H ATOM 2796 N THR A 717 11.860 -7.129 -7.355 1.00 32.47 N ATOM 2797 CA THR A 717 12.895 -8.106 -7.656 1.00 32.14 C ATOM 2798 C THR A 717 12.715 -9.308 -6.750 1.00 32.59 C ATOM 2799 O THR A 717 13.522 -10.219 -6.771 1.00 33.29 O ATOM 2800 CB THR A 717 14.314 -7.498 -7.432 1.00 32.21 C ATOM 2801 OG1 THR A 717 14.475 -7.125 -6.053 1.00 30.83 O ATOM 2802 CG2 THR A 717 14.526 -6.285 -8.317 1.00 30.18 C ATOM 2803 HA THR A 717 12.807 -8.402 -8.701 1.00 0.00 H ATOM 2804 HB THR A 717 15.056 -8.253 -7.694 1.00 0.00 H ATOM 2805 HG1 THR A 717 13.789 -6.453 -5.812 1.00 0.00 H ATOM 2806 HG23 THR A 717 14.403 -6.573 -9.361 1.00 0.00 H ATOM 2807 HG21 THR A 717 13.795 -5.518 -8.061 1.00 0.00 H ATOM 2808 HG22 THR A 717 15.532 -5.895 -8.162 1.00 0.00 H ATOM 2809 H THR A 717 11.977 -6.504 -6.532 1.00 0.00 H ATOM 2810 N ARG A 718 11.658 -9.306 -5.937 1.00 32.41 N ATOM 2811 CA ARG A 718 11.429 -10.362 -4.960 1.00 32.55 C ATOM 2812 C ARG A 718 12.622 -10.607 -4.024 1.00 31.86 C ATOM 2813 O ARG A 718 13.066 -11.742 -3.836 1.00 31.32 O ATOM 2814 CB ARG A 718 10.967 -11.676 -5.647 1.00 33.29 C ATOM 2815 CG ARG A 718 9.469 -11.731 -5.915 1.00 36.22 C ATOM 2816 CD ARG A 718 9.133 -11.718 -7.412 1.00 43.18 C ATOM 2817 NE ARG A 718 7.727 -12.077 -7.676 1.00 46.28 N ATOM 2818 CZ ARG A 718 7.015 -11.631 -8.715 1.00 49.13 C ATOM 2819 NH1 ARG A 718 7.571 -10.801 -9.590 1.00 49.90 N ATOM 2820 NH2 ARG A 718 5.742 -12.004 -8.881 1.00 48.46 N ATOM 2821 HA ARG A 718 10.621 -10.006 -4.321 1.00 0.00 H ATOM 2822 HB2 ARG A 718 11.491 -11.770 -6.598 1.00 0.00 H ATOM 2823 HB3 ARG A 718 11.233 -12.514 -5.002 1.00 0.00 H ATOM 2824 HG2 ARG A 718 9.069 -12.645 -5.476 1.00 0.00 H ATOM 2825 HG3 ARG A 718 8.999 -10.868 -5.444 1.00 0.00 H ATOM 2826 HD2 ARG A 718 9.779 -12.433 -7.922 1.00 0.00 H ATOM 2827 HD3 ARG A 718 9.319 -10.718 -7.804 1.00 0.00 H ATOM 2828 HE ARG A 718 7.258 -12.721 -7.008 1.00 0.00 H ATOM 2829 HH12 ARG A 718 7.019 -10.452 -10.399 1.00 0.00 H ATOM 2830 HH11 ARG A 718 8.559 -10.500 -9.466 1.00 0.00 H ATOM 2831 HH22 ARG A 718 5.198 -11.650 -9.694 1.00 0.00 H ATOM 2832 HH21 ARG A 718 5.295 -12.648 -8.197 1.00 0.00 H ATOM 2833 H ARG A 718 10.975 -8.525 -6.003 1.00 0.00 H ATOM 2834 N GLY A 719 13.146 -9.530 -3.445 1.00 30.22 N ATOM 2835 CA GLY A 719 14.076 -9.652 -2.338 1.00 30.23 C ATOM 2836 C GLY A 719 15.552 -9.722 -2.709 1.00 31.22 C ATOM 2837 O GLY A 719 16.390 -10.061 -1.862 1.00 30.60 O ATOM 2838 HA3 GLY A 719 13.826 -10.561 -1.791 1.00 0.00 H ATOM 2839 HA2 GLY A 719 13.936 -8.788 -1.688 1.00 0.00 H ATOM 2840 H GLY A 719 12.885 -8.585 -3.792 1.00 0.00 H ATOM 2841 N GLN A 720 15.864 -9.382 -3.950 1.00 31.73 N ATOM 2842 CA GLN A 720 17.257 -9.304 -4.411 1.00 34.61 C ATOM 2843 C GLN A 720 17.991 -8.174 -3.678 1.00 34.77 C ATOM 2844 O GLN A 720 17.381 -7.143 -3.350 1.00 34.18 O ATOM 2845 CB GLN A 720 17.291 -9.130 -5.936 1.00 35.07 C ATOM 2846 CG GLN A 720 16.347 -10.168 -6.630 1.00 39.33 C ATOM 2847 CD GLN A 720 16.653 -10.442 -8.103 1.00 45.41 C ATOM 2848 OE1 GLN A 720 17.795 -10.726 -8.469 1.00 50.44 O ATOM 2849 NE2 GLN A 720 15.614 -10.392 -8.957 1.00 47.70 N ATOM 2850 HA GLN A 720 17.778 -10.232 -4.176 1.00 0.00 H ATOM 2851 HB2 GLN A 720 16.963 -8.122 -6.189 1.00 0.00 H ATOM 2852 HB3 GLN A 720 18.311 -9.279 -6.291 1.00 0.00 H ATOM 2853 HG2 GLN A 720 16.425 -11.110 -6.088 1.00 0.00 H ATOM 2854 HG3 GLN A 720 15.325 -9.794 -6.561 1.00 0.00 H ATOM 2855 HE22 GLN A 720 14.665 -10.148 -8.608 1.00 0.00 H ATOM 2856 HE21 GLN A 720 15.760 -10.597 -9.966 1.00 0.00 H ATOM 2857 H GLN A 720 15.099 -9.163 -4.620 1.00 0.00 H ATOM 2858 N THR A 721 19.269 -8.401 -3.360 1.00 34.76 N ATOM 2859 CA THR A 721 20.113 -7.383 -2.729 1.00 34.23 C ATOM 2860 C THR A 721 20.298 -6.234 -3.720 1.00 33.85 C ATOM 2861 O THR A 721 20.665 -6.453 -4.864 1.00 34.16 O ATOM 2862 CB THR A 721 21.492 -7.975 -2.247 1.00 34.62 C ATOM 2863 OG1 THR A 721 21.263 -9.089 -1.378 1.00 36.37 O ATOM 2864 CG2 THR A 721 22.327 -6.936 -1.475 1.00 32.63 C ATOM 2865 HA THR A 721 19.624 -7.012 -1.828 1.00 0.00 H ATOM 2866 HB THR A 721 22.040 -8.277 -3.139 1.00 0.00 H ATOM 2867 HG1 THR A 721 20.741 -8.791 -0.592 1.00 0.00 H ATOM 2868 HG23 THR A 721 22.516 -6.075 -2.116 1.00 0.00 H ATOM 2869 HG21 THR A 721 21.779 -6.617 -0.589 1.00 0.00 H ATOM 2870 HG22 THR A 721 23.275 -7.383 -1.176 1.00 0.00 H ATOM 2871 H THR A 721 19.679 -9.334 -3.568 1.00 0.00 H ATOM 2872 N PRO A 722 19.980 -4.989 -3.308 1.00 33.34 N ATOM 2873 CA PRO A 722 20.219 -3.865 -4.226 1.00 32.74 C ATOM 2874 C PRO A 722 21.722 -3.673 -4.566 1.00 32.98 C ATOM 2875 O PRO A 722 22.551 -3.817 -3.703 1.00 31.86 O ATOM 2876 CB PRO A 722 19.730 -2.643 -3.436 1.00 33.25 C ATOM 2877 CG PRO A 722 18.945 -3.171 -2.296 1.00 32.13 C ATOM 2878 CD PRO A 722 19.469 -4.557 -2.000 1.00 33.08 C ATOM 2879 HA PRO A 722 19.715 -4.026 -5.179 1.00 0.00 H ATOM 2880 HD3 PRO A 722 20.265 -4.527 -1.256 1.00 0.00 H ATOM 2881 HD2 PRO A 722 18.672 -5.214 -1.651 1.00 0.00 H ATOM 2882 HG3 PRO A 722 17.888 -3.219 -2.559 1.00 0.00 H ATOM 2883 HG2 PRO A 722 19.072 -2.529 -1.425 1.00 0.00 H ATOM 2884 HB2 PRO A 722 20.579 -2.063 -3.074 1.00 0.00 H ATOM 2885 HB3 PRO A 722 19.103 -2.012 -4.066 1.00 0.00 H ATOM 2886 N TYR A 723 22.025 -3.303 -5.801 1.00 34.26 N ATOM 2887 CA TYR A 723 23.394 -2.990 -6.232 1.00 36.73 C ATOM 2888 C TYR A 723 24.247 -4.246 -6.069 1.00 38.88 C ATOM 2889 O TYR A 723 25.389 -4.165 -5.595 1.00 40.12 O ATOM 2890 CB TYR A 723 24.010 -1.836 -5.404 1.00 35.94 C ATOM 2891 CG TYR A 723 23.157 -0.594 -5.310 1.00 33.11 C ATOM 2892 CD1 TYR A 723 23.048 0.294 -6.385 1.00 33.77 C ATOM 2893 CD2 TYR A 723 22.431 -0.332 -4.166 1.00 35.14 C ATOM 2894 CE1 TYR A 723 22.230 1.444 -6.321 1.00 31.01 C ATOM 2895 CE2 TYR A 723 21.612 0.805 -4.069 1.00 32.29 C ATOM 2896 CZ TYR A 723 21.527 1.691 -5.143 1.00 31.94 C ATOM 2897 OH TYR A 723 20.721 2.806 -5.036 1.00 32.95 O ATOM 2898 HA TYR A 723 23.367 -2.667 -7.273 1.00 0.00 H ATOM 2899 HB3 TYR A 723 24.960 -1.560 -5.862 1.00 0.00 H ATOM 2900 HB2 TYR A 723 24.188 -2.202 -4.393 1.00 0.00 H ATOM 2901 HD2 TYR A 723 22.494 -1.020 -3.323 1.00 0.00 H ATOM 2902 HE2 TYR A 723 21.045 0.994 -3.158 1.00 0.00 H ATOM 2903 HE1 TYR A 723 22.151 2.121 -7.171 1.00 0.00 H ATOM 2904 HD1 TYR A 723 23.610 0.093 -7.297 1.00 0.00 H ATOM 2905 HH TYR A 723 21.031 3.365 -4.280 1.00 0.00 H ATOM 2906 H TYR A 723 21.257 -3.231 -6.499 1.00 0.00 H ATOM 2907 N ALA A 724 23.688 -5.407 -6.410 1.00 41.43 N ATOM 2908 CA ALA A 724 24.405 -6.664 -6.168 1.00 43.56 C ATOM 2909 C ALA A 724 25.713 -6.602 -6.949 1.00 44.66 C ATOM 2910 O ALA A 724 25.759 -6.090 -8.079 1.00 45.13 O ATOM 2911 CB ALA A 724 23.561 -7.876 -6.560 1.00 43.83 C ATOM 2912 HA ALA A 724 24.614 -6.783 -5.105 1.00 0.00 H ATOM 2913 HB1 ALA A 724 22.643 -7.883 -5.972 1.00 0.00 H ATOM 2914 HB2 ALA A 724 23.314 -7.818 -7.620 1.00 0.00 H ATOM 2915 HB3 ALA A 724 24.125 -8.788 -6.366 1.00 0.00 H ATOM 2916 H ALA A 724 22.744 -5.422 -6.847 1.00 0.00 H ATOM 2917 N GLY A 725 26.787 -7.058 -6.317 1.00 46.22 N ATOM 2918 CA GLY A 725 28.116 -6.975 -6.926 1.00 47.53 C ATOM 2919 C GLY A 725 28.727 -5.578 -6.902 1.00 48.41 C ATOM 2920 O GLY A 725 29.701 -5.319 -7.609 1.00 48.34 O ATOM 2921 HA3 GLY A 725 28.037 -7.297 -7.965 1.00 0.00 H ATOM 2922 HA2 GLY A 725 28.782 -7.649 -6.388 1.00 0.00 H ATOM 2923 H GLY A 725 26.683 -7.482 -5.373 1.00 0.00 H ATOM 2924 N ILE A 726 28.141 -4.670 -6.115 1.00 48.74 N ATOM 2925 CA ILE A 726 28.731 -3.348 -5.855 1.00 49.14 C ATOM 2926 C ILE A 726 28.857 -3.200 -4.352 1.00 49.46 C ATOM 2927 O ILE A 726 27.904 -3.452 -3.631 1.00 49.65 O ATOM 2928 CB ILE A 726 27.893 -2.186 -6.446 1.00 49.23 C ATOM 2929 CG1 ILE A 726 27.718 -2.362 -7.962 1.00 49.46 C ATOM 2930 CG2 ILE A 726 28.520 -0.843 -6.098 1.00 48.53 C ATOM 2931 CD1 ILE A 726 26.644 -1.451 -8.599 1.00 50.16 C ATOM 2932 HA ILE A 726 29.703 -3.290 -6.346 1.00 0.00 H ATOM 2933 HB ILE A 726 26.899 -2.207 -5.999 1.00 0.00 H ATOM 2934 HG12 ILE A 726 28.673 -2.147 -8.441 1.00 0.00 H ATOM 2935 HG13 ILE A 726 27.441 -3.399 -8.154 1.00 0.00 H ATOM 2936 HD11 ILE A 726 25.676 -1.659 -8.143 1.00 0.00 H ATOM 2937 HD12 ILE A 726 26.909 -0.407 -8.431 1.00 0.00 H ATOM 2938 HD13 ILE A 726 26.592 -1.646 -9.670 1.00 0.00 H ATOM 2939 HG21 ILE A 726 28.563 -0.733 -5.014 1.00 0.00 H ATOM 2940 HG22 ILE A 726 29.528 -0.797 -6.509 1.00 0.00 H ATOM 2941 HG23 ILE A 726 27.916 -0.041 -6.522 1.00 0.00 H ATOM 2942 H ILE A 726 27.232 -4.908 -5.669 1.00 0.00 H ATOM 2943 N GLU A 727 30.039 -2.815 -3.872 1.00 50.07 N ATOM 2944 CA GLU A 727 30.283 -2.750 -2.426 1.00 50.31 C ATOM 2945 C GLU A 727 29.744 -1.464 -1.816 1.00 50.02 C ATOM 2946 O GLU A 727 29.627 -0.456 -2.511 1.00 49.79 O ATOM 2947 CB GLU A 727 31.775 -2.885 -2.109 1.00 50.39 C ATOM 2948 CG GLU A 727 32.377 -4.252 -2.454 1.00 53.40 C ATOM 2949 CD GLU A 727 33.871 -4.342 -2.155 1.00 54.73 C ATOM 2950 OE1 GLU A 727 34.354 -3.686 -1.197 1.00 57.18 O ATOM 2951 OE2 GLU A 727 34.561 -5.085 -2.880 1.00 56.54 O ATOM 2952 HA GLU A 727 29.748 -3.589 -1.982 1.00 0.00 H ATOM 2953 HB2 GLU A 727 32.313 -2.123 -2.673 1.00 0.00 H ATOM 2954 HB3 GLU A 727 31.914 -2.711 -1.042 1.00 0.00 H ATOM 2955 HG2 GLU A 727 31.860 -5.016 -1.873 1.00 0.00 H ATOM 2956 HG3 GLU A 727 32.224 -4.440 -3.517 1.00 0.00 H ATOM 2957 H GLU A 727 30.800 -2.557 -4.532 1.00 0.00 H ATOM 2958 N ASN A 728 29.442 -1.517 -0.515 1.00 50.06 N ATOM 2959 CA ASN A 728 28.971 -0.361 0.251 1.00 50.29 C ATOM 2960 C ASN A 728 29.862 0.857 0.091 1.00 50.14 C ATOM 2961 O ASN A 728 29.371 1.970 -0.064 1.00 49.99 O ATOM 2962 CB ASN A 728 28.880 -0.692 1.741 1.00 50.53 C ATOM 2963 CG ASN A 728 27.751 -1.632 2.066 1.00 51.11 C ATOM 2964 OD1 ASN A 728 27.025 -2.093 1.187 1.00 53.91 O ATOM 2965 ND2 ASN A 728 27.594 -1.929 3.346 1.00 52.13 N ATOM 2966 HA ASN A 728 27.985 -0.125 -0.151 1.00 0.00 H ATOM 2967 HB2 ASN A 728 29.817 -1.153 2.053 1.00 0.00 H ATOM 2968 HB3 ASN A 728 28.731 0.235 2.295 1.00 0.00 H ATOM 2969 HD22 ASN A 728 28.231 -1.517 4.057 1.00 0.00 H ATOM 2970 HD21 ASN A 728 26.834 -2.575 3.641 1.00 0.00 H ATOM 2971 H ASN A 728 29.547 -2.426 -0.021 1.00 0.00 H ATOM 2972 N ALA A 729 31.173 0.621 0.111 1.00 49.86 N ATOM 2973 CA ALA A 729 32.179 1.678 0.038 1.00 49.31 C ATOM 2974 C ALA A 729 32.190 2.397 -1.305 1.00 48.67 C ATOM 2975 O ALA A 729 32.779 3.472 -1.437 1.00 49.31 O ATOM 2976 CB ALA A 729 33.574 1.103 0.360 1.00 49.58 C ATOM 2977 HA ALA A 729 31.912 2.426 0.784 1.00 0.00 H ATOM 2978 HB1 ALA A 729 33.569 0.681 1.365 1.00 0.00 H ATOM 2979 HB2 ALA A 729 33.820 0.323 -0.361 1.00 0.00 H ATOM 2980 HB3 ALA A 729 34.316 1.899 0.303 1.00 0.00 H ATOM 2981 H ALA A 729 31.496 -0.365 0.182 1.00 0.00 H ATOM 2982 N GLU A 730 31.530 1.818 -2.300 1.00 47.54 N ATOM 2983 CA GLU A 730 31.492 2.418 -3.626 1.00 46.38 C ATOM 2984 C GLU A 730 30.105 2.943 -3.998 1.00 44.55 C ATOM 2985 O GLU A 730 29.907 3.476 -5.092 1.00 44.21 O ATOM 2986 CB GLU A 730 31.961 1.405 -4.671 1.00 47.62 C ATOM 2987 CG GLU A 730 33.373 0.839 -4.409 1.00 49.81 C ATOM 2988 CD GLU A 730 34.486 1.845 -4.685 1.00 53.67 C ATOM 2989 OE1 GLU A 730 35.540 1.776 -4.000 1.00 56.51 O ATOM 2990 OE2 GLU A 730 34.318 2.706 -5.582 1.00 55.29 O ATOM 2991 HA GLU A 730 32.165 3.275 -3.607 1.00 0.00 H ATOM 2992 HB2 GLU A 730 31.256 0.574 -4.684 1.00 0.00 H ATOM 2993 HB3 GLU A 730 31.963 1.894 -5.645 1.00 0.00 H ATOM 2994 HG2 GLU A 730 33.435 0.532 -3.365 1.00 0.00 H ATOM 2995 HG3 GLU A 730 33.523 -0.029 -5.051 1.00 0.00 H ATOM 2996 H GLU A 730 31.032 0.921 -2.130 1.00 0.00 H ATOM 2997 N ILE A 731 29.147 2.779 -3.094 1.00 42.87 N ATOM 2998 CA ILE A 731 27.754 3.174 -3.374 1.00 41.39 C ATOM 2999 C ILE A 731 27.626 4.661 -3.702 1.00 40.58 C ATOM 3000 O ILE A 731 27.063 5.018 -4.733 1.00 40.02 O ATOM 3001 CB ILE A 731 26.781 2.722 -2.243 1.00 40.95 C ATOM 3002 CG1 ILE A 731 26.607 1.182 -2.252 1.00 40.63 C ATOM 3003 CG2 ILE A 731 25.425 3.418 -2.353 1.00 40.23 C ATOM 3004 CD1 ILE A 731 25.999 0.609 -3.539 1.00 37.77 C ATOM 3005 HA ILE A 731 27.450 2.640 -4.274 1.00 0.00 H ATOM 3006 HB ILE A 731 27.225 3.016 -1.292 1.00 0.00 H ATOM 3007 HG12 ILE A 731 27.588 0.729 -2.110 1.00 0.00 H ATOM 3008 HG13 ILE A 731 25.958 0.909 -1.420 1.00 0.00 H ATOM 3009 HD11 ILE A 731 25.009 1.038 -3.694 1.00 0.00 H ATOM 3010 HD12 ILE A 731 26.641 0.858 -4.384 1.00 0.00 H ATOM 3011 HD13 ILE A 731 25.917 -0.474 -3.450 1.00 0.00 H ATOM 3012 HG21 ILE A 731 25.564 4.496 -2.276 1.00 0.00 H ATOM 3013 HG22 ILE A 731 24.971 3.177 -3.314 1.00 0.00 H ATOM 3014 HG23 ILE A 731 24.776 3.076 -1.547 1.00 0.00 H ATOM 3015 H ILE A 731 29.383 2.364 -2.170 1.00 0.00 H ATOM 3016 N TYR A 732 28.167 5.520 -2.841 1.00 41.47 N ATOM 3017 CA TYR A 732 28.143 6.973 -3.086 1.00 41.86 C ATOM 3018 C TYR A 732 28.687 7.337 -4.458 1.00 42.10 C ATOM 3019 O TYR A 732 28.014 8.015 -5.241 1.00 41.06 O ATOM 3020 CB TYR A 732 28.890 7.765 -2.001 1.00 42.15 C ATOM 3021 CG TYR A 732 28.741 9.270 -2.193 1.00 44.72 C ATOM 3022 CD1 TYR A 732 27.559 9.922 -1.829 1.00 45.73 C ATOM 3023 CD2 TYR A 732 29.761 10.037 -2.775 1.00 45.98 C ATOM 3024 CE1 TYR A 732 27.399 11.298 -2.019 1.00 46.68 C ATOM 3025 CE2 TYR A 732 29.606 11.433 -2.971 1.00 47.81 C ATOM 3026 CZ TYR A 732 28.422 12.045 -2.588 1.00 49.03 C ATOM 3027 OH TYR A 732 28.239 13.402 -2.754 1.00 51.15 O ATOM 3028 HA TYR A 732 27.091 7.256 -3.049 1.00 0.00 H ATOM 3029 HB3 TYR A 732 29.948 7.507 -2.042 1.00 0.00 H ATOM 3030 HB2 TYR A 732 28.488 7.492 -1.025 1.00 0.00 H ATOM 3031 HD2 TYR A 732 30.688 9.552 -3.082 1.00 0.00 H ATOM 3032 HE2 TYR A 732 30.409 12.019 -3.418 1.00 0.00 H ATOM 3033 HE1 TYR A 732 26.471 11.785 -1.720 1.00 0.00 H ATOM 3034 HD1 TYR A 732 26.746 9.346 -1.388 1.00 0.00 H ATOM 3035 HH TYR A 732 27.340 13.655 -2.425 1.00 0.00 H ATOM 3036 H TYR A 732 28.617 5.158 -1.976 1.00 0.00 H ATOM 3037 N ASN A 733 29.908 6.878 -4.747 1.00 43.25 N ATOM 3038 CA ASN A 733 30.522 7.098 -6.057 1.00 44.11 C ATOM 3039 C ASN A 733 29.602 6.646 -7.188 1.00 43.79 C ATOM 3040 O ASN A 733 29.441 7.360 -8.176 1.00 43.97 O ATOM 3041 CB ASN A 733 31.916 6.429 -6.144 1.00 45.07 C ATOM 3042 CG ASN A 733 32.890 6.960 -5.085 1.00 47.50 C ATOM 3043 OD1 ASN A 733 32.832 8.138 -4.707 1.00 50.09 O ATOM 3044 ND2 ASN A 733 33.783 6.092 -4.597 1.00 49.95 N ATOM 3045 HA ASN A 733 30.671 8.171 -6.177 1.00 0.00 H ATOM 3046 HB2 ASN A 733 31.798 5.355 -6.003 1.00 0.00 H ATOM 3047 HB3 ASN A 733 32.335 6.621 -7.132 1.00 0.00 H ATOM 3048 HD22 ASN A 733 33.797 5.111 -4.942 1.00 0.00 H ATOM 3049 HD21 ASN A 733 34.463 6.398 -3.872 1.00 0.00 H ATOM 3050 H ASN A 733 30.436 6.351 -4.022 1.00 0.00 H ATOM 3051 N TYR A 734 28.964 5.482 -7.021 1.00 44.01 N ATOM 3052 CA TYR A 734 27.990 4.978 -8.011 1.00 44.15 C ATOM 3053 C TYR A 734 26.861 5.989 -8.245 1.00 43.31 C ATOM 3054 O TYR A 734 26.530 6.320 -9.382 1.00 42.74 O ATOM 3055 CB TYR A 734 27.409 3.641 -7.533 1.00 44.72 C ATOM 3056 CG TYR A 734 26.616 2.884 -8.579 1.00 47.61 C ATOM 3057 CD1 TYR A 734 27.258 2.283 -9.670 1.00 49.58 C ATOM 3058 CD2 TYR A 734 25.226 2.750 -8.472 1.00 49.50 C ATOM 3059 CE1 TYR A 734 26.545 1.590 -10.626 1.00 50.15 C ATOM 3060 CE2 TYR A 734 24.502 2.043 -9.423 1.00 49.48 C ATOM 3061 CZ TYR A 734 25.172 1.467 -10.493 1.00 50.73 C ATOM 3062 OH TYR A 734 24.480 0.772 -11.447 1.00 52.57 O ATOM 3063 HA TYR A 734 28.510 4.831 -8.957 1.00 0.00 H ATOM 3064 HB3 TYR A 734 26.752 3.840 -6.686 1.00 0.00 H ATOM 3065 HB2 TYR A 734 28.235 3.008 -7.209 1.00 0.00 H ATOM 3066 HD2 TYR A 734 24.705 3.207 -7.631 1.00 0.00 H ATOM 3067 HE2 TYR A 734 23.421 1.942 -9.330 1.00 0.00 H ATOM 3068 HE1 TYR A 734 27.057 1.143 -11.478 1.00 0.00 H ATOM 3069 HD1 TYR A 734 28.341 2.365 -9.765 1.00 0.00 H ATOM 3070 HH TYR A 734 25.112 0.433 -12.130 1.00 0.00 H ATOM 3071 H TYR A 734 29.159 4.916 -6.171 1.00 0.00 H ATOM 3072 N LEU A 735 26.308 6.503 -7.147 1.00 42.69 N ATOM 3073 CA LEU A 735 25.145 7.409 -7.181 1.00 41.78 C ATOM 3074 C LEU A 735 25.427 8.829 -7.704 1.00 42.66 C ATOM 3075 O LEU A 735 24.697 9.312 -8.567 1.00 43.16 O ATOM 3076 CB LEU A 735 24.501 7.487 -5.788 1.00 40.56 C ATOM 3077 CG LEU A 735 23.837 6.216 -5.232 1.00 37.80 C ATOM 3078 CD1 LEU A 735 23.389 6.432 -3.796 1.00 36.70 C ATOM 3079 CD2 LEU A 735 22.674 5.762 -6.092 1.00 35.23 C ATOM 3080 HA LEU A 735 24.464 6.967 -7.908 1.00 0.00 H ATOM 3081 HB2 LEU A 735 25.281 7.781 -5.085 1.00 0.00 H ATOM 3082 HB3 LEU A 735 23.737 8.263 -5.826 1.00 0.00 H ATOM 3083 HG LEU A 735 24.584 5.423 -5.251 1.00 0.00 H ATOM 3084 HD21 LEU A 735 21.923 6.551 -6.131 1.00 0.00 H ATOM 3085 HD22 LEU A 735 23.031 5.548 -7.100 1.00 0.00 H ATOM 3086 HD23 LEU A 735 22.235 4.862 -5.662 1.00 0.00 H ATOM 3087 HD11 LEU A 735 24.254 6.678 -3.180 1.00 0.00 H ATOM 3088 HD12 LEU A 735 22.671 7.251 -3.760 1.00 0.00 H ATOM 3089 HD13 LEU A 735 22.922 5.521 -3.422 1.00 0.00 H ATOM 3090 H LEU A 735 26.716 6.254 -6.223 1.00 0.00 H ATOM 3091 N ILE A 736 26.449 9.515 -7.173 1.00 43.86 N ATOM 3092 CA ILE A 736 26.796 10.843 -7.730 1.00 44.71 C ATOM 3093 C ILE A 736 27.215 10.725 -9.181 1.00 44.75 C ATOM 3094 O ILE A 736 27.274 11.730 -9.883 1.00 45.24 O ATOM 3095 CB ILE A 736 27.875 11.671 -6.949 1.00 45.30 C ATOM 3096 CG1 ILE A 736 28.965 10.783 -6.342 1.00 45.85 C ATOM 3097 CG2 ILE A 736 27.214 12.637 -5.932 1.00 45.04 C ATOM 3098 CD1 ILE A 736 30.114 10.459 -7.284 1.00 46.88 C ATOM 3099 HA ILE A 736 25.870 11.409 -7.624 1.00 0.00 H ATOM 3100 HB ILE A 736 28.398 12.301 -7.669 1.00 0.00 H ATOM 3101 HG12 ILE A 736 29.373 11.293 -5.470 1.00 0.00 H ATOM 3102 HG13 ILE A 736 28.506 9.845 -6.030 1.00 0.00 H ATOM 3103 HD11 ILE A 736 29.728 9.935 -8.158 1.00 0.00 H ATOM 3104 HD12 ILE A 736 30.597 11.384 -7.597 1.00 0.00 H ATOM 3105 HD13 ILE A 736 30.837 9.826 -6.769 1.00 0.00 H ATOM 3106 HG21 ILE A 736 26.561 13.330 -6.463 1.00 0.00 H ATOM 3107 HG22 ILE A 736 26.629 12.062 -5.214 1.00 0.00 H ATOM 3108 HG23 ILE A 736 27.989 13.196 -5.407 1.00 0.00 H ATOM 3109 H ILE A 736 26.992 9.119 -6.379 1.00 0.00 H ATOM 3110 N GLY A 737 27.494 9.496 -9.622 1.00 44.79 N ATOM 3111 CA GLY A 737 27.705 9.203 -11.049 1.00 44.63 C ATOM 3112 C GLY A 737 26.446 9.380 -11.884 1.00 44.54 C ATOM 3113 O GLY A 737 26.510 9.542 -13.110 1.00 44.79 O ATOM 3114 HA3 GLY A 737 28.044 8.172 -11.146 1.00 0.00 H ATOM 3115 HA2 GLY A 737 28.474 9.874 -11.432 1.00 0.00 H ATOM 3116 H GLY A 737 27.565 8.719 -8.934 1.00 0.00 H ATOM 3117 N GLY A 738 25.292 9.357 -11.224 1.00 44.01 N ATOM 3118 CA GLY A 738 24.012 9.461 -11.917 1.00 43.40 C ATOM 3119 C GLY A 738 23.439 8.084 -12.177 1.00 42.99 C ATOM 3120 O GLY A 738 22.444 7.943 -12.884 1.00 43.28 O ATOM 3121 HA3 GLY A 738 24.158 9.975 -12.867 1.00 0.00 H ATOM 3122 HA2 GLY A 738 23.315 10.030 -11.301 1.00 0.00 H ATOM 3123 H GLY A 738 25.302 9.263 -10.188 1.00 0.00 H ATOM 3124 N ASN A 739 24.081 7.068 -11.611 1.00 42.35 N ATOM 3125 CA ASN A 739 23.630 5.691 -11.764 1.00 41.97 C ATOM 3126 C ASN A 739 22.580 5.369 -10.711 1.00 40.72 C ATOM 3127 O ASN A 739 22.664 5.848 -9.600 1.00 39.67 O ATOM 3128 CB ASN A 739 24.795 4.717 -11.586 1.00 42.33 C ATOM 3129 CG ASN A 739 25.930 4.974 -12.555 1.00 44.55 C ATOM 3130 OD1 ASN A 739 26.764 5.863 -12.343 1.00 47.91 O ATOM 3131 ND2 ASN A 739 25.980 4.189 -13.609 1.00 44.60 N ATOM 3132 HA ASN A 739 23.212 5.585 -12.765 1.00 0.00 H ATOM 3133 HB2 ASN A 739 25.177 4.812 -10.569 1.00 0.00 H ATOM 3134 HB3 ASN A 739 24.428 3.703 -11.741 1.00 0.00 H ATOM 3135 HD22 ASN A 739 25.256 3.455 -13.745 1.00 0.00 H ATOM 3136 HD21 ASN A 739 26.743 4.302 -14.306 1.00 0.00 H ATOM 3137 H ASN A 739 24.930 7.261 -11.042 1.00 0.00 H ATOM 3138 N ARG A 740 21.612 4.540 -11.062 1.00 40.33 N ATOM 3139 CA ARG A 740 20.584 4.113 -10.110 1.00 40.22 C ATOM 3140 C ARG A 740 20.364 2.600 -10.220 1.00 40.73 C ATOM 3141 O ARG A 740 20.980 1.941 -11.068 1.00 41.19 O ATOM 3142 CB ARG A 740 19.276 4.877 -10.349 1.00 40.10 C ATOM 3143 CG ARG A 740 19.337 6.402 -10.109 1.00 39.23 C ATOM 3144 CD ARG A 740 19.552 6.746 -8.636 1.00 37.22 C ATOM 3145 NE ARG A 740 19.580 8.190 -8.381 1.00 36.85 N ATOM 3146 CZ ARG A 740 20.678 8.946 -8.449 1.00 38.30 C ATOM 3147 NH1 ARG A 740 21.858 8.400 -8.772 1.00 36.30 N ATOM 3148 NH2 ARG A 740 20.599 10.243 -8.189 1.00 34.33 N ATOM 3149 HA ARG A 740 20.923 4.340 -9.099 1.00 0.00 H ATOM 3150 HB2 ARG A 740 18.976 4.712 -11.384 1.00 0.00 H ATOM 3151 HB3 ARG A 740 18.519 4.463 -9.683 1.00 0.00 H ATOM 3152 HG2 ARG A 740 20.160 6.817 -10.690 1.00 0.00 H ATOM 3153 HG3 ARG A 740 18.399 6.848 -10.441 1.00 0.00 H ATOM 3154 HD2 ARG A 740 20.502 6.318 -8.314 1.00 0.00 H ATOM 3155 HD3 ARG A 740 18.741 6.306 -8.055 1.00 0.00 H ATOM 3156 HE ARG A 740 18.685 8.656 -8.130 1.00 0.00 H ATOM 3157 HH12 ARG A 740 22.710 8.995 -8.823 1.00 0.00 H ATOM 3158 HH11 ARG A 740 21.922 7.381 -8.972 1.00 0.00 H ATOM 3159 HH22 ARG A 740 21.451 10.837 -8.241 1.00 0.00 H ATOM 3160 HH21 ARG A 740 19.685 10.667 -7.933 1.00 0.00 H ATOM 3161 H ARG A 740 21.580 4.182 -12.038 1.00 0.00 H ATOM 3162 N LEU A 741 19.512 2.042 -9.356 1.00 40.18 N ATOM 3163 CA LEU A 741 19.080 0.650 -9.505 1.00 40.35 C ATOM 3164 C LEU A 741 18.358 0.465 -10.834 1.00 41.14 C ATOM 3165 O LEU A 741 17.540 1.310 -11.222 1.00 41.62 O ATOM 3166 CB LEU A 741 18.167 0.235 -8.335 1.00 39.44 C ATOM 3167 CG LEU A 741 18.822 0.128 -6.948 1.00 38.84 C ATOM 3168 CD1 LEU A 741 17.770 0.124 -5.846 1.00 36.14 C ATOM 3169 CD2 LEU A 741 19.723 -1.108 -6.830 1.00 34.34 C ATOM 3170 HA LEU A 741 19.962 0.010 -9.492 1.00 0.00 H ATOM 3171 HB2 LEU A 741 17.365 0.970 -8.265 1.00 0.00 H ATOM 3172 HB3 LEU A 741 17.744 -0.740 -8.576 1.00 0.00 H ATOM 3173 HG LEU A 741 19.453 1.009 -6.827 1.00 0.00 H ATOM 3174 HD21 LEU A 741 19.129 -2.006 -6.996 1.00 0.00 H ATOM 3175 HD22 LEU A 741 20.515 -1.051 -7.577 1.00 0.00 H ATOM 3176 HD23 LEU A 741 20.163 -1.141 -5.834 1.00 0.00 H ATOM 3177 HD11 LEU A 741 17.195 1.049 -5.891 1.00 0.00 H ATOM 3178 HD12 LEU A 741 17.103 -0.727 -5.985 1.00 0.00 H ATOM 3179 HD13 LEU A 741 18.262 0.047 -4.876 1.00 0.00 H ATOM 3180 H LEU A 741 19.148 2.607 -8.562 1.00 0.00 H ATOM 3181 N LYS A 742 18.640 -0.642 -11.524 1.00 42.03 N ATOM 3182 CA LYS A 742 18.118 -0.852 -12.880 1.00 43.65 C ATOM 3183 C LYS A 742 16.666 -1.346 -12.876 1.00 44.29 C ATOM 3184 O LYS A 742 16.215 -1.976 -11.921 1.00 44.36 O ATOM 3185 CB LYS A 742 19.026 -1.812 -13.679 1.00 43.97 C ATOM 3186 CG LYS A 742 20.546 -1.549 -13.516 1.00 45.61 C ATOM 3187 CD LYS A 742 21.348 -1.992 -14.739 1.00 50.66 C ATOM 3188 CE LYS A 742 21.742 -0.790 -15.617 1.00 52.88 C ATOM 3189 NZ LYS A 742 22.111 -1.174 -17.022 1.00 53.70 N ATOM 3190 HA LYS A 742 18.122 0.119 -13.376 1.00 0.00 H ATOM 3191 HB2 LYS A 742 18.819 -2.830 -13.348 1.00 0.00 H ATOM 3192 HB3 LYS A 742 18.776 -1.717 -14.736 1.00 0.00 H ATOM 3193 HG2 LYS A 742 20.702 -0.481 -13.362 1.00 0.00 H ATOM 3194 HG3 LYS A 742 20.905 -2.097 -12.645 1.00 0.00 H ATOM 3195 HD2 LYS A 742 22.253 -2.500 -14.405 1.00 0.00 H ATOM 3196 HD3 LYS A 742 20.744 -2.680 -15.330 1.00 0.00 H ATOM 3197 HE2 LYS A 742 22.596 -0.292 -15.159 1.00 0.00 H ATOM 3198 HE3 LYS A 742 20.899 -0.100 -15.657 1.00 0.00 H ATOM 3199 HZ1 LYS A 742 22.921 -1.825 -17.001 1.00 0.00 H ATOM 3200 HZ2 LYS A 742 21.301 -1.642 -17.476 1.00 0.00 H ATOM 3201 HZ3 LYS A 742 22.365 -0.320 -17.558 1.00 0.00 H ATOM 3202 H LYS A 742 19.242 -1.371 -11.092 1.00 0.00 H ATOM 3203 N GLN A 743 15.933 -1.035 -13.937 1.00 45.46 N ATOM 3204 CA GLN A 743 14.583 -1.535 -14.082 1.00 46.97 C ATOM 3205 C GLN A 743 14.630 -3.060 -14.128 1.00 47.83 C ATOM 3206 O GLN A 743 15.303 -3.631 -14.989 1.00 48.20 O ATOM 3207 CB GLN A 743 13.912 -0.963 -15.337 1.00 46.93 C ATOM 3208 CG GLN A 743 12.545 -1.578 -15.637 1.00 47.60 C ATOM 3209 CD GLN A 743 11.732 -0.786 -16.645 1.00 47.72 C ATOM 3210 OE1 GLN A 743 12.219 0.164 -17.263 1.00 49.35 O ATOM 3211 NE2 GLN A 743 10.480 -1.172 -16.811 1.00 49.21 N ATOM 3212 HA GLN A 743 13.983 -1.215 -13.230 1.00 0.00 H ATOM 3213 HB2 GLN A 743 13.784 0.111 -15.200 1.00 0.00 H ATOM 3214 HB3 GLN A 743 14.566 -1.144 -16.190 1.00 0.00 H ATOM 3215 HG2 GLN A 743 12.697 -2.583 -16.030 1.00 0.00 H ATOM 3216 HG3 GLN A 743 11.980 -1.635 -14.706 1.00 0.00 H ATOM 3217 HE22 GLN A 743 10.108 -1.979 -16.270 1.00 0.00 H ATOM 3218 HE21 GLN A 743 9.866 -0.669 -17.483 1.00 0.00 H ATOM 3219 H GLN A 743 16.335 -0.423 -14.676 1.00 0.00 H ATOM 3220 N PRO A 744 13.936 -3.722 -13.185 1.00 48.80 N ATOM 3221 CA PRO A 744 13.914 -5.184 -13.195 1.00 49.74 C ATOM 3222 C PRO A 744 13.295 -5.672 -14.503 1.00 50.82 C ATOM 3223 O PRO A 744 12.433 -4.973 -15.066 1.00 50.83 O ATOM 3224 CB PRO A 744 13.021 -5.537 -12.003 1.00 49.44 C ATOM 3225 CG PRO A 744 12.997 -4.296 -11.142 1.00 49.42 C ATOM 3226 CD PRO A 744 13.107 -3.161 -12.101 1.00 48.51 C ATOM 3227 HA PRO A 744 14.901 -5.640 -13.123 1.00 0.00 H ATOM 3228 HD3 PRO A 744 12.126 -2.864 -12.471 1.00 0.00 H ATOM 3229 HD2 PRO A 744 13.594 -2.303 -11.639 1.00 0.00 H ATOM 3230 HG3 PRO A 744 13.837 -4.294 -10.448 1.00 0.00 H ATOM 3231 HG2 PRO A 744 12.064 -4.236 -10.582 1.00 0.00 H ATOM 3232 HB2 PRO A 744 12.015 -5.788 -12.340 1.00 0.00 H ATOM 3233 HB3 PRO A 744 13.438 -6.378 -11.449 1.00 0.00 H ATOM 3234 N PRO A 745 13.723 -6.856 -14.993 1.00 51.60 N ATOM 3235 CA PRO A 745 13.281 -7.328 -16.310 1.00 52.18 C ATOM 3236 C PRO A 745 11.770 -7.233 -16.566 1.00 52.53 C ATOM 3237 O PRO A 745 11.350 -6.678 -17.588 1.00 53.00 O ATOM 3238 CB PRO A 745 13.751 -8.790 -16.335 1.00 52.45 C ATOM 3239 CG PRO A 745 14.969 -8.786 -15.455 1.00 52.50 C ATOM 3240 CD PRO A 745 14.614 -7.830 -14.332 1.00 51.80 C ATOM 3241 HA PRO A 745 13.697 -6.701 -17.099 1.00 0.00 H ATOM 3242 HD3 PRO A 745 14.097 -8.349 -13.524 1.00 0.00 H ATOM 3243 HD2 PRO A 745 15.505 -7.341 -13.937 1.00 0.00 H ATOM 3244 HG3 PRO A 745 15.842 -8.431 -16.004 1.00 0.00 H ATOM 3245 HG2 PRO A 745 15.168 -9.784 -15.065 1.00 0.00 H ATOM 3246 HB2 PRO A 745 12.984 -9.453 -15.935 1.00 0.00 H ATOM 3247 HB3 PRO A 745 14.004 -9.100 -17.349 1.00 0.00 H ATOM 3248 N GLU A 746 10.963 -7.748 -15.645 1.00 52.76 N ATOM 3249 CA GLU A 746 9.524 -7.870 -15.882 1.00 52.92 C ATOM 3250 C GLU A 746 8.731 -6.633 -15.436 1.00 52.10 C ATOM 3251 O GLU A 746 7.532 -6.513 -15.722 1.00 52.10 O ATOM 3252 CB GLU A 746 8.997 -9.137 -15.190 1.00 53.44 C ATOM 3253 CG GLU A 746 7.611 -9.617 -15.656 1.00 56.30 C ATOM 3254 CD GLU A 746 7.600 -10.141 -17.094 1.00 59.56 C ATOM 3255 OE1 GLU A 746 8.287 -11.151 -17.375 1.00 60.51 O ATOM 3256 OE2 GLU A 746 6.889 -9.551 -17.940 1.00 60.81 O ATOM 3257 HA GLU A 746 9.376 -7.947 -16.959 1.00 0.00 H ATOM 3258 HB2 GLU A 746 9.710 -9.941 -15.372 1.00 0.00 H ATOM 3259 HB3 GLU A 746 8.942 -8.937 -14.120 1.00 0.00 H ATOM 3260 HG2 GLU A 746 7.282 -10.418 -14.994 1.00 0.00 H ATOM 3261 HG3 GLU A 746 6.915 -8.781 -15.587 1.00 0.00 H ATOM 3262 H GLU A 746 11.361 -8.070 -14.740 1.00 0.00 H ATOM 3263 N CYS A 747 9.415 -5.711 -14.760 1.00 51.13 N ATOM 3264 CA CYS A 747 8.771 -4.595 -14.059 1.00 49.96 C ATOM 3265 C CYS A 747 8.016 -3.630 -14.963 1.00 49.55 C ATOM 3266 O CYS A 747 8.580 -3.047 -15.881 1.00 49.34 O ATOM 3267 CB CYS A 747 9.807 -3.829 -13.217 1.00 50.05 C ATOM 3268 SG CYS A 747 9.138 -2.490 -12.186 1.00 48.56 S ATOM 3269 HA CYS A 747 8.016 -5.049 -13.417 1.00 0.00 H ATOM 3270 HB2 CYS A 747 10.540 -3.396 -13.898 1.00 0.00 H ATOM 3271 HB3 CYS A 747 10.302 -4.544 -12.560 1.00 0.00 H ATOM 3272 HG CYS A 747 8.521 -1.555 -12.992 1.00 0.00 H ATOM 3273 H CYS A 747 10.452 -5.786 -14.728 1.00 0.00 H ATOM 3274 N MET A 748 6.734 -3.463 -14.665 1.00 49.67 N ATOM 3275 CA MET A 748 5.874 -2.468 -15.296 1.00 50.03 C ATOM 3276 C MET A 748 6.548 -1.098 -15.288 1.00 49.86 C ATOM 3277 O MET A 748 7.027 -0.639 -14.241 1.00 49.87 O ATOM 3278 CB MET A 748 4.550 -2.416 -14.537 1.00 50.57 C ATOM 3279 CG MET A 748 3.594 -1.331 -14.956 1.00 51.59 C ATOM 3280 SD MET A 748 2.057 -1.536 -14.048 1.00 56.03 S ATOM 3281 CE MET A 748 1.209 -2.696 -15.143 1.00 55.71 C ATOM 3282 HA MET A 748 5.692 -2.745 -16.334 1.00 0.00 H ATOM 3283 HB2 MET A 748 4.049 -3.374 -14.673 1.00 0.00 H ATOM 3284 HB3 MET A 748 4.776 -2.273 -13.480 1.00 0.00 H ATOM 3285 HG2 MET A 748 3.401 -1.405 -16.026 1.00 0.00 H ATOM 3286 HG3 MET A 748 4.025 -0.355 -14.732 1.00 0.00 H ATOM 3287 HE1 MET A 748 1.088 -2.243 -16.127 1.00 0.00 H ATOM 3288 HE2 MET A 748 1.799 -3.608 -15.232 1.00 0.00 H ATOM 3289 HE3 MET A 748 0.229 -2.935 -14.729 1.00 0.00 H ATOM 3290 H MET A 748 6.317 -4.079 -13.938 1.00 0.00 H ATOM 3291 N GLU A 749 6.589 -0.457 -16.455 1.00 49.29 N ATOM 3292 CA GLU A 749 7.331 0.783 -16.633 1.00 48.87 C ATOM 3293 C GLU A 749 6.896 1.860 -15.647 1.00 47.51 C ATOM 3294 O GLU A 749 7.716 2.580 -15.109 1.00 47.18 O ATOM 3295 CB GLU A 749 7.198 1.290 -18.072 1.00 49.87 C ATOM 3296 CG GLU A 749 7.950 0.439 -19.089 1.00 52.65 C ATOM 3297 CD GLU A 749 7.436 0.632 -20.505 1.00 57.46 C ATOM 3298 OE1 GLU A 749 7.094 1.790 -20.850 1.00 58.47 O ATOM 3299 OE2 GLU A 749 7.380 -0.374 -21.268 1.00 58.78 O ATOM 3300 HA GLU A 749 8.379 0.562 -16.431 1.00 0.00 H ATOM 3301 HB2 GLU A 749 6.141 1.295 -18.340 1.00 0.00 H ATOM 3302 HB3 GLU A 749 7.588 2.307 -18.117 1.00 0.00 H ATOM 3303 HG2 GLU A 749 9.005 0.711 -19.060 1.00 0.00 H ATOM 3304 HG3 GLU A 749 7.839 -0.611 -18.817 1.00 0.00 H ATOM 3305 H GLU A 749 6.074 -0.855 -17.266 1.00 0.00 H ATOM 3306 N GLU A 750 5.598 1.942 -15.408 1.00 46.12 N ATOM 3307 CA GLU A 750 5.017 2.985 -14.580 1.00 44.61 C ATOM 3308 C GLU A 750 5.425 2.806 -13.102 1.00 43.18 C ATOM 3309 O GLU A 750 5.563 3.789 -12.369 1.00 42.57 O ATOM 3310 CB GLU A 750 3.509 2.935 -14.735 1.00 45.29 C ATOM 3311 CG GLU A 750 3.081 2.469 -16.129 1.00 48.56 C ATOM 3312 CD GLU A 750 1.741 3.003 -16.539 1.00 52.77 C ATOM 3313 OE1 GLU A 750 0.819 3.044 -15.692 1.00 55.29 O ATOM 3314 OE2 GLU A 750 1.603 3.373 -17.724 1.00 55.12 O ATOM 3315 HA GLU A 750 5.388 3.959 -14.901 1.00 0.00 H ATOM 3316 HB2 GLU A 750 3.103 2.245 -13.995 1.00 0.00 H ATOM 3317 HB3 GLU A 750 3.105 3.932 -14.560 1.00 0.00 H ATOM 3318 HG2 GLU A 750 3.825 2.805 -16.851 1.00 0.00 H ATOM 3319 HG3 GLU A 750 3.038 1.380 -16.133 1.00 0.00 H ATOM 3320 H GLU A 750 4.967 1.231 -15.830 1.00 0.00 H ATOM 3321 N VAL A 751 5.623 1.554 -12.689 1.00 40.89 N ATOM 3322 CA VAL A 751 6.127 1.250 -11.347 1.00 39.61 C ATOM 3323 C VAL A 751 7.593 1.647 -11.238 1.00 38.73 C ATOM 3324 O VAL A 751 7.988 2.262 -10.232 1.00 37.90 O ATOM 3325 CB VAL A 751 5.894 -0.214 -10.933 1.00 39.86 C ATOM 3326 CG1 VAL A 751 6.554 -0.522 -9.555 1.00 39.56 C ATOM 3327 CG2 VAL A 751 4.396 -0.504 -10.868 1.00 38.93 C ATOM 3328 HA VAL A 751 5.551 1.845 -10.638 1.00 0.00 H ATOM 3329 HB VAL A 751 6.357 -0.856 -11.682 1.00 0.00 H ATOM 3330 HG11 VAL A 751 7.628 -0.345 -9.620 1.00 0.00 H ATOM 3331 HG12 VAL A 751 6.123 0.128 -8.794 1.00 0.00 H ATOM 3332 HG13 VAL A 751 6.371 -1.564 -9.291 1.00 0.00 H ATOM 3333 HG21 VAL A 751 3.931 0.156 -10.135 1.00 0.00 H ATOM 3334 HG22 VAL A 751 3.951 -0.332 -11.848 1.00 0.00 H ATOM 3335 HG23 VAL A 751 4.241 -1.542 -10.574 1.00 0.00 H ATOM 3336 H VAL A 751 5.413 0.769 -13.339 1.00 0.00 H ATOM 3337 N TYR A 752 8.376 1.356 -12.281 1.00 37.61 N ATOM 3338 CA TYR A 752 9.778 1.745 -12.287 1.00 37.81 C ATOM 3339 C TYR A 752 9.924 3.264 -12.317 1.00 37.01 C ATOM 3340 O TYR A 752 10.782 3.809 -11.637 1.00 36.29 O ATOM 3341 CB TYR A 752 10.588 1.117 -13.434 1.00 37.91 C ATOM 3342 CG TYR A 752 12.062 1.507 -13.338 1.00 38.26 C ATOM 3343 CD1 TYR A 752 12.847 1.038 -12.289 1.00 37.17 C ATOM 3344 CD2 TYR A 752 12.649 2.376 -14.260 1.00 39.59 C ATOM 3345 CE1 TYR A 752 14.179 1.393 -12.165 1.00 37.75 C ATOM 3346 CE2 TYR A 752 14.011 2.745 -14.149 1.00 38.74 C ATOM 3347 CZ TYR A 752 14.755 2.246 -13.084 1.00 38.99 C ATOM 3348 OH TYR A 752 16.074 2.580 -12.920 1.00 39.68 O ATOM 3349 HA TYR A 752 10.194 1.355 -11.358 1.00 0.00 H ATOM 3350 HB3 TYR A 752 10.188 1.465 -14.386 1.00 0.00 H ATOM 3351 HB2 TYR A 752 10.501 0.032 -13.380 1.00 0.00 H ATOM 3352 HD2 TYR A 752 12.049 2.776 -15.078 1.00 0.00 H ATOM 3353 HE2 TYR A 752 14.468 3.407 -14.884 1.00 0.00 H ATOM 3354 HE1 TYR A 752 14.773 0.999 -11.341 1.00 0.00 H ATOM 3355 HD1 TYR A 752 12.402 0.375 -11.547 1.00 0.00 H ATOM 3356 HH TYR A 752 16.429 2.130 -12.113 1.00 0.00 H ATOM 3357 H TYR A 752 7.979 0.847 -13.096 1.00 0.00 H ATOM 3358 N ASP A 753 9.087 3.938 -13.107 1.00 36.82 N ATOM 3359 CA ASP A 753 9.106 5.406 -13.161 1.00 36.89 C ATOM 3360 C ASP A 753 8.886 6.026 -11.772 1.00 35.68 C ATOM 3361 O ASP A 753 9.560 6.982 -11.406 1.00 35.14 O ATOM 3362 CB ASP A 753 8.080 5.943 -14.161 1.00 37.89 C ATOM 3363 CG ASP A 753 8.478 5.686 -15.617 1.00 40.48 C ATOM 3364 OD1 ASP A 753 9.686 5.587 -15.925 1.00 42.36 O ATOM 3365 OD2 ASP A 753 7.564 5.575 -16.460 1.00 43.76 O ATOM 3366 HA ASP A 753 10.098 5.700 -13.505 1.00 0.00 H ATOM 3367 HB2 ASP A 753 7.122 5.459 -13.971 1.00 0.00 H ATOM 3368 HB3 ASP A 753 7.978 7.018 -14.012 1.00 0.00 H ATOM 3369 H ASP A 753 8.408 3.415 -13.696 1.00 0.00 H ATOM 3370 N LEU A 754 7.979 5.445 -10.990 1.00 34.05 N ATOM 3371 CA LEU A 754 7.706 5.949 -9.643 1.00 33.16 C ATOM 3372 C LEU A 754 8.874 5.754 -8.680 1.00 31.76 C ATOM 3373 O LEU A 754 9.234 6.686 -7.951 1.00 31.49 O ATOM 3374 CB LEU A 754 6.443 5.293 -9.057 1.00 32.66 C ATOM 3375 CG LEU A 754 5.705 6.022 -7.940 1.00 34.96 C ATOM 3376 CD1 LEU A 754 5.231 7.419 -8.395 1.00 36.51 C ATOM 3377 CD2 LEU A 754 4.518 5.182 -7.513 1.00 35.03 C ATOM 3378 HA LEU A 754 7.549 7.022 -9.752 1.00 0.00 H ATOM 3379 HB2 LEU A 754 5.738 5.159 -9.877 1.00 0.00 H ATOM 3380 HB3 LEU A 754 6.736 4.318 -8.668 1.00 0.00 H ATOM 3381 HG LEU A 754 6.387 6.165 -7.102 1.00 0.00 H ATOM 3382 HD21 LEU A 754 3.853 5.037 -8.364 1.00 0.00 H ATOM 3383 HD22 LEU A 754 4.869 4.214 -7.155 1.00 0.00 H ATOM 3384 HD23 LEU A 754 3.981 5.693 -6.714 1.00 0.00 H ATOM 3385 HD11 LEU A 754 6.094 8.017 -8.687 1.00 0.00 H ATOM 3386 HD12 LEU A 754 4.556 7.313 -9.244 1.00 0.00 H ATOM 3387 HD13 LEU A 754 4.709 7.910 -7.573 1.00 0.00 H ATOM 3388 H LEU A 754 7.455 4.618 -11.342 1.00 0.00 H ATOM 3389 N MET A 755 9.461 4.554 -8.665 1.00 30.07 N ATOM 3390 CA MET A 755 10.565 4.319 -7.756 1.00 29.50 C ATOM 3391 C MET A 755 11.763 5.158 -8.153 1.00 29.79 C ATOM 3392 O MET A 755 12.501 5.601 -7.281 1.00 28.08 O ATOM 3393 CB MET A 755 10.941 2.830 -7.637 1.00 28.62 C ATOM 3394 CG MET A 755 11.533 2.206 -8.878 1.00 28.52 C ATOM 3395 SD MET A 755 11.937 0.499 -8.524 1.00 30.17 S ATOM 3396 CE MET A 755 10.329 -0.267 -8.686 1.00 28.68 C ATOM 3397 HA MET A 755 10.232 4.625 -6.764 1.00 0.00 H ATOM 3398 HB2 MET A 755 11.669 2.731 -6.831 1.00 0.00 H ATOM 3399 HB3 MET A 755 10.039 2.275 -7.380 1.00 0.00 H ATOM 3400 HG2 MET A 755 12.436 2.745 -9.165 1.00 0.00 H ATOM 3401 HG3 MET A 755 10.810 2.251 -9.692 1.00 0.00 H ATOM 3402 HE1 MET A 755 9.642 0.178 -7.966 1.00 0.00 H ATOM 3403 HE2 MET A 755 9.952 -0.108 -9.696 1.00 0.00 H ATOM 3404 HE3 MET A 755 10.416 -1.336 -8.494 1.00 0.00 H ATOM 3405 H MET A 755 9.130 3.798 -9.298 1.00 0.00 H ATOM 3406 N TYR A 756 11.923 5.391 -9.461 1.00 30.25 N ATOM 3407 CA TYR A 756 13.045 6.175 -9.983 1.00 31.19 C ATOM 3408 C TYR A 756 12.926 7.607 -9.465 1.00 30.34 C ATOM 3409 O TYR A 756 13.897 8.170 -8.964 1.00 29.86 O ATOM 3410 CB TYR A 756 13.123 6.095 -11.521 1.00 32.02 C ATOM 3411 CG TYR A 756 14.409 6.652 -12.106 1.00 36.14 C ATOM 3412 CD1 TYR A 756 15.534 5.840 -12.294 1.00 37.78 C ATOM 3413 CD2 TYR A 756 14.496 7.995 -12.469 1.00 38.73 C ATOM 3414 CE1 TYR A 756 16.724 6.372 -12.824 1.00 41.79 C ATOM 3415 CE2 TYR A 756 15.664 8.534 -12.988 1.00 40.87 C ATOM 3416 CZ TYR A 756 16.769 7.720 -13.175 1.00 43.05 C ATOM 3417 OH TYR A 756 17.914 8.279 -13.704 1.00 46.00 O ATOM 3418 HA TYR A 756 13.987 5.759 -9.625 1.00 0.00 H ATOM 3419 HB3 TYR A 756 12.286 6.657 -11.936 1.00 0.00 H ATOM 3420 HB2 TYR A 756 13.038 5.049 -11.814 1.00 0.00 H ATOM 3421 HD2 TYR A 756 13.625 8.637 -12.342 1.00 0.00 H ATOM 3422 HE2 TYR A 756 15.712 9.592 -13.247 1.00 0.00 H ATOM 3423 HE1 TYR A 756 17.600 5.737 -12.958 1.00 0.00 H ATOM 3424 HD1 TYR A 756 15.488 4.784 -12.027 1.00 0.00 H ATOM 3425 HH TYR A 756 18.615 7.584 -13.780 1.00 0.00 H ATOM 3426 H TYR A 756 11.227 5.002 -10.129 1.00 0.00 H ATOM 3427 N GLN A 757 11.713 8.156 -9.490 1.00 30.16 N ATOM 3428 CA GLN A 757 11.471 9.488 -8.934 1.00 30.51 C ATOM 3429 C GLN A 757 11.960 9.617 -7.493 1.00 29.17 C ATOM 3430 O GLN A 757 12.378 10.698 -7.085 1.00 28.91 O ATOM 3431 CB GLN A 757 9.971 9.833 -8.954 1.00 31.00 C ATOM 3432 CG GLN A 757 9.359 10.196 -10.309 1.00 36.44 C ATOM 3433 CD GLN A 757 7.854 10.473 -10.177 1.00 40.32 C ATOM 3434 OE1 GLN A 757 7.038 9.805 -10.806 1.00 44.69 O ATOM 3435 NE2 GLN A 757 7.492 11.423 -9.320 1.00 42.79 N ATOM 3436 HA GLN A 757 12.031 10.178 -9.565 1.00 0.00 H ATOM 3437 HB2 GLN A 757 9.429 8.969 -8.569 1.00 0.00 H ATOM 3438 HB3 GLN A 757 9.820 10.681 -8.287 1.00 0.00 H ATOM 3439 HG2 GLN A 757 9.853 11.087 -10.696 1.00 0.00 H ATOM 3440 HG3 GLN A 757 9.510 9.368 -11.002 1.00 0.00 H ATOM 3441 HE22 GLN A 757 8.217 11.965 -8.808 1.00 0.00 H ATOM 3442 HE21 GLN A 757 6.484 11.624 -9.162 1.00 0.00 H ATOM 3443 H GLN A 757 10.923 7.628 -9.913 1.00 0.00 H ATOM 3444 N CYS A 758 11.876 8.526 -6.723 1.00 28.12 N ATOM 3445 CA CYS A 758 12.210 8.536 -5.282 1.00 26.85 C ATOM 3446 C CYS A 758 13.709 8.749 -5.063 1.00 27.05 C ATOM 3447 O CYS A 758 14.157 9.057 -3.945 1.00 26.42 O ATOM 3448 CB CYS A 758 11.818 7.205 -4.635 1.00 26.05 C ATOM 3449 SG CYS A 758 9.997 6.974 -4.537 1.00 26.27 S ATOM 3450 HA CYS A 758 11.655 9.357 -4.827 1.00 0.00 H ATOM 3451 HB2 CYS A 758 12.229 7.173 -3.626 1.00 0.00 H ATOM 3452 HB3 CYS A 758 12.242 6.392 -5.224 1.00 0.00 H ATOM 3453 HG CYS A 758 9.462 7.001 -5.809 1.00 0.00 H ATOM 3454 H CYS A 758 11.563 7.634 -7.156 1.00 0.00 H ATOM 3455 N TRP A 759 14.484 8.519 -6.125 1.00 27.65 N ATOM 3456 CA TRP A 759 15.945 8.619 -6.067 1.00 28.52 C ATOM 3457 C TRP A 759 16.492 9.854 -6.757 1.00 29.90 C ATOM 3458 O TRP A 759 17.660 9.859 -7.184 1.00 29.84 O ATOM 3459 CB TRP A 759 16.642 7.368 -6.661 1.00 28.07 C ATOM 3460 CG TRP A 759 16.062 6.061 -6.195 1.00 27.77 C ATOM 3461 CD1 TRP A 759 15.702 5.723 -4.911 1.00 26.17 C ATOM 3462 CD2 TRP A 759 15.779 4.924 -7.004 1.00 25.66 C ATOM 3463 NE1 TRP A 759 15.201 4.430 -4.888 1.00 23.92 N ATOM 3464 CE2 TRP A 759 15.249 3.924 -6.160 1.00 27.01 C ATOM 3465 CE3 TRP A 759 15.932 4.643 -8.375 1.00 29.02 C ATOM 3466 CZ2 TRP A 759 14.868 2.667 -6.637 1.00 29.65 C ATOM 3467 CZ3 TRP A 759 15.525 3.387 -8.857 1.00 29.83 C ATOM 3468 CH2 TRP A 759 15.029 2.409 -7.981 1.00 29.97 C ATOM 3469 HA TRP A 759 16.171 8.693 -5.003 1.00 0.00 H ATOM 3470 HB2 TRP A 759 16.558 7.412 -7.747 1.00 0.00 H ATOM 3471 HB3 TRP A 759 17.694 7.396 -6.378 1.00 0.00 H ATOM 3472 HE1 TRP A 759 14.849 3.929 -4.047 1.00 0.00 H ATOM 3473 HD1 TRP A 759 15.796 6.374 -4.042 1.00 0.00 H ATOM 3474 HZ2 TRP A 759 14.456 1.913 -5.966 1.00 0.00 H ATOM 3475 HH2 TRP A 759 14.766 1.426 -8.372 1.00 0.00 H ATOM 3476 HZ3 TRP A 759 15.595 3.170 -9.923 1.00 0.00 H ATOM 3477 HE3 TRP A 759 16.358 5.385 -9.050 1.00 0.00 H ATOM 3478 H TRP A 759 14.035 8.259 -7.026 1.00 0.00 H ATOM 3479 N SER A 760 15.663 10.892 -6.878 1.00 31.31 N ATOM 3480 CA SER A 760 16.144 12.180 -7.406 1.00 32.27 C ATOM 3481 C SER A 760 17.256 12.720 -6.501 1.00 32.52 C ATOM 3482 O SER A 760 17.159 12.658 -5.283 1.00 31.73 O ATOM 3483 CB SER A 760 14.989 13.197 -7.471 1.00 32.98 C ATOM 3484 OG SER A 760 13.918 12.717 -8.282 1.00 35.82 O ATOM 3485 HA SER A 760 16.533 12.027 -8.413 1.00 0.00 H ATOM 3486 HB2 SER A 760 15.362 14.131 -7.892 1.00 0.00 H ATOM 3487 HB3 SER A 760 14.617 13.377 -6.462 1.00 0.00 H ATOM 3488 HG SER A 760 13.571 11.871 -7.902 1.00 0.00 H ATOM 3489 H SER A 760 14.667 10.791 -6.597 1.00 0.00 H ATOM 3490 N ALA A 761 18.322 13.247 -7.098 1.00 32.95 N ATOM 3491 CA ALA A 761 19.384 13.921 -6.339 1.00 33.66 C ATOM 3492 C ALA A 761 18.831 15.057 -5.476 1.00 33.28 C ATOM 3493 O ALA A 761 19.167 15.185 -4.299 1.00 33.12 O ATOM 3494 CB ALA A 761 20.481 14.452 -7.317 1.00 34.52 C ATOM 3495 HA ALA A 761 19.831 13.192 -5.663 1.00 0.00 H ATOM 3496 HB1 ALA A 761 20.909 13.616 -7.870 1.00 0.00 H ATOM 3497 HB2 ALA A 761 20.032 15.159 -8.015 1.00 0.00 H ATOM 3498 HB3 ALA A 761 21.265 14.950 -6.746 1.00 0.00 H ATOM 3499 H ALA A 761 18.406 13.180 -8.132 1.00 0.00 H ATOM 3500 N ASP A 762 17.943 15.859 -6.055 1.00 34.78 N ATOM 3501 CA ASP A 762 17.246 16.923 -5.322 1.00 35.52 C ATOM 3502 C ASP A 762 16.155 16.312 -4.440 1.00 35.15 C ATOM 3503 O ASP A 762 15.172 15.796 -4.971 1.00 35.94 O ATOM 3504 CB ASP A 762 16.615 17.906 -6.325 1.00 36.66 C ATOM 3505 CG ASP A 762 15.939 19.095 -5.653 1.00 38.20 C ATOM 3506 OD1 ASP A 762 15.729 19.086 -4.426 1.00 39.22 O ATOM 3507 OD2 ASP A 762 15.609 20.054 -6.377 1.00 42.78 O ATOM 3508 HA ASP A 762 17.957 17.456 -4.691 1.00 0.00 H ATOM 3509 HB2 ASP A 762 17.398 18.279 -6.985 1.00 0.00 H ATOM 3510 HB3 ASP A 762 15.870 17.371 -6.914 1.00 0.00 H ATOM 3511 H ASP A 762 17.734 15.728 -7.065 1.00 0.00 H ATOM 3512 N PRO A 763 16.310 16.383 -3.101 1.00 34.97 N ATOM 3513 CA PRO A 763 15.314 15.814 -2.165 1.00 34.48 C ATOM 3514 C PRO A 763 13.899 16.399 -2.374 1.00 34.43 C ATOM 3515 O PRO A 763 12.911 15.692 -2.211 1.00 31.78 O ATOM 3516 CB PRO A 763 15.838 16.218 -0.790 1.00 34.22 C ATOM 3517 CG PRO A 763 17.317 16.534 -0.995 1.00 35.54 C ATOM 3518 CD PRO A 763 17.392 17.089 -2.391 1.00 35.20 C ATOM 3519 HA PRO A 763 15.209 14.738 -2.305 1.00 0.00 H ATOM 3520 HD3 PRO A 763 17.222 18.166 -2.392 1.00 0.00 H ATOM 3521 HD2 PRO A 763 18.360 16.875 -2.844 1.00 0.00 H ATOM 3522 HG3 PRO A 763 17.921 15.631 -0.906 1.00 0.00 H ATOM 3523 HG2 PRO A 763 17.659 17.271 -0.268 1.00 0.00 H ATOM 3524 HB2 PRO A 763 15.308 17.097 -0.423 1.00 0.00 H ATOM 3525 HB3 PRO A 763 15.718 15.399 -0.080 1.00 0.00 H ATOM 3526 N LYS A 764 13.821 17.676 -2.746 1.00 35.14 N ATOM 3527 CA LYS A 764 12.524 18.342 -2.970 1.00 35.84 C ATOM 3528 C LYS A 764 11.800 17.848 -4.232 1.00 35.12 C ATOM 3529 O LYS A 764 10.597 18.027 -4.373 1.00 35.45 O ATOM 3530 CB LYS A 764 12.688 19.883 -2.938 1.00 36.31 C ATOM 3531 CG LYS A 764 12.745 20.421 -1.478 1.00 39.19 C ATOM 3532 CD LYS A 764 12.988 21.935 -1.381 1.00 43.69 C ATOM 3533 CE LYS A 764 14.493 22.282 -1.464 1.00 46.36 C ATOM 3534 NZ LYS A 764 14.811 23.666 -0.946 1.00 50.38 N ATOM 3535 HA LYS A 764 11.870 18.061 -2.144 1.00 0.00 H ATOM 3536 HB2 LYS A 764 13.611 20.152 -3.451 1.00 0.00 H ATOM 3537 HB3 LYS A 764 11.842 20.340 -3.451 1.00 0.00 H ATOM 3538 HG2 LYS A 764 11.797 20.193 -0.991 1.00 0.00 H ATOM 3539 HG3 LYS A 764 13.553 19.909 -0.955 1.00 0.00 H ATOM 3540 HD2 LYS A 764 12.466 22.430 -2.200 1.00 0.00 H ATOM 3541 HD3 LYS A 764 12.594 22.296 -0.431 1.00 0.00 H ATOM 3542 HE2 LYS A 764 14.807 22.221 -2.506 1.00 0.00 H ATOM 3543 HE3 LYS A 764 15.050 21.554 -0.875 1.00 0.00 H ATOM 3544 HZ1 LYS A 764 14.293 24.372 -1.506 1.00 0.00 H ATOM 3545 HZ2 LYS A 764 14.525 23.736 0.052 1.00 0.00 H ATOM 3546 HZ3 LYS A 764 15.833 23.839 -1.028 1.00 0.00 H ATOM 3547 H LYS A 764 14.698 18.218 -2.882 1.00 0.00 H ATOM 3548 N GLN A 765 12.518 17.162 -5.105 1.00 34.87 N ATOM 3549 CA GLN A 765 11.960 16.622 -6.345 1.00 35.20 C ATOM 3550 C GLN A 765 11.359 15.199 -6.159 1.00 34.51 C ATOM 3551 O GLN A 765 10.745 14.633 -7.067 1.00 34.81 O ATOM 3552 CB GLN A 765 13.070 16.612 -7.412 1.00 36.01 C ATOM 3553 CG GLN A 765 12.607 16.409 -8.848 1.00 40.85 C ATOM 3554 CD GLN A 765 11.906 17.646 -9.434 1.00 46.75 C ATOM 3555 OE1 GLN A 765 11.032 17.527 -10.298 1.00 49.23 O ATOM 3556 NE2 GLN A 765 12.290 18.829 -8.963 1.00 46.88 N ATOM 3557 HA GLN A 765 11.134 17.259 -6.661 1.00 0.00 H ATOM 3558 HB2 GLN A 765 13.592 17.567 -7.361 1.00 0.00 H ATOM 3559 HB3 GLN A 765 13.763 15.807 -7.167 1.00 0.00 H ATOM 3560 HG2 GLN A 765 13.476 16.177 -9.464 1.00 0.00 H ATOM 3561 HG3 GLN A 765 11.911 15.570 -8.874 1.00 0.00 H ATOM 3562 HE22 GLN A 765 13.030 18.883 -8.235 1.00 0.00 H ATOM 3563 HE21 GLN A 765 11.850 19.700 -9.323 1.00 0.00 H ATOM 3564 H GLN A 765 13.525 16.999 -4.901 1.00 0.00 H ATOM 3565 N ARG A 766 11.538 14.620 -4.981 1.00 33.04 N ATOM 3566 CA ARG A 766 11.054 13.261 -4.741 1.00 32.02 C ATOM 3567 C ARG A 766 9.589 13.366 -4.338 1.00 31.35 C ATOM 3568 O ARG A 766 9.218 14.306 -3.658 1.00 31.35 O ATOM 3569 CB ARG A 766 11.919 12.590 -3.668 1.00 31.99 C ATOM 3570 CG ARG A 766 13.363 13.023 -3.825 1.00 33.52 C ATOM 3571 CD ARG A 766 14.412 12.007 -3.500 1.00 37.21 C ATOM 3572 NE ARG A 766 14.803 12.040 -2.108 1.00 36.64 N ATOM 3573 CZ ARG A 766 16.041 12.251 -1.640 1.00 30.39 C ATOM 3574 NH1 ARG A 766 17.090 12.510 -2.419 1.00 32.58 N ATOM 3575 NH2 ARG A 766 16.207 12.250 -0.338 1.00 29.24 N ATOM 3576 HA ARG A 766 11.128 12.637 -5.632 1.00 0.00 H ATOM 3577 HB2 ARG A 766 11.560 12.880 -2.680 1.00 0.00 H ATOM 3578 HB3 ARG A 766 11.852 11.507 -3.774 1.00 0.00 H ATOM 3579 HG2 ARG A 766 13.506 13.324 -4.863 1.00 0.00 H ATOM 3580 HG3 ARG A 766 13.523 13.882 -3.173 1.00 0.00 H ATOM 3581 HD2 ARG A 766 15.291 12.202 -4.115 1.00 0.00 H ATOM 3582 HD3 ARG A 766 14.022 11.016 -3.730 1.00 0.00 H ATOM 3583 HE ARG A 766 14.053 11.885 -1.404 1.00 0.00 H ATOM 3584 HH12 ARG A 766 18.027 12.665 -1.995 1.00 0.00 H ATOM 3585 HH11 ARG A 766 16.972 12.557 -3.451 1.00 0.00 H ATOM 3586 HH22 ARG A 766 17.152 12.410 0.066 1.00 0.00 H ATOM 3587 HH21 ARG A 766 15.394 12.089 0.290 1.00 0.00 H ATOM 3588 H ARG A 766 12.026 15.136 -4.221 1.00 0.00 H ATOM 3589 N PRO A 767 8.753 12.401 -4.733 1.00 30.94 N ATOM 3590 CA PRO A 767 7.327 12.561 -4.363 1.00 30.46 C ATOM 3591 C PRO A 767 7.092 12.423 -2.858 1.00 30.13 C ATOM 3592 O PRO A 767 7.951 11.873 -2.130 1.00 30.01 O ATOM 3593 CB PRO A 767 6.622 11.433 -5.135 1.00 30.84 C ATOM 3594 CG PRO A 767 7.690 10.472 -5.537 1.00 29.88 C ATOM 3595 CD PRO A 767 9.006 11.193 -5.536 1.00 31.52 C ATOM 3596 HA PRO A 767 6.953 13.555 -4.611 1.00 0.00 H ATOM 3597 HD3 PRO A 767 9.783 10.580 -5.079 1.00 0.00 H ATOM 3598 HD2 PRO A 767 9.303 11.458 -6.551 1.00 0.00 H ATOM 3599 HG3 PRO A 767 7.482 10.088 -6.536 1.00 0.00 H ATOM 3600 HG2 PRO A 767 7.724 9.643 -4.830 1.00 0.00 H ATOM 3601 HB2 PRO A 767 5.889 10.939 -4.497 1.00 0.00 H ATOM 3602 HB3 PRO A 767 6.122 11.834 -6.017 1.00 0.00 H ATOM 3603 N SER A 768 5.939 12.900 -2.382 1.00 28.32 N ATOM 3604 CA SER A 768 5.619 12.750 -0.974 1.00 26.82 C ATOM 3605 C SER A 768 5.032 11.352 -0.833 1.00 26.59 C ATOM 3606 O SER A 768 4.697 10.737 -1.849 1.00 26.31 O ATOM 3607 CB SER A 768 4.609 13.834 -0.530 1.00 27.97 C ATOM 3608 OG SER A 768 3.309 13.567 -1.063 1.00 25.32 O ATOM 3609 HA SER A 768 6.497 12.872 -0.340 1.00 0.00 H ATOM 3610 HB2 SER A 768 4.949 14.807 -0.886 1.00 0.00 H ATOM 3611 HB3 SER A 768 4.553 13.846 0.559 1.00 0.00 H ATOM 3612 HG SER A 768 2.681 14.272 -0.766 1.00 0.00 H ATOM 3613 H SER A 768 5.271 13.378 -3.019 1.00 0.00 H ATOM 3614 N PHE A 769 4.860 10.869 0.407 1.00 26.97 N ATOM 3615 CA PHE A 769 4.222 9.556 0.638 1.00 25.86 C ATOM 3616 C PHE A 769 2.748 9.584 0.246 1.00 27.32 C ATOM 3617 O PHE A 769 2.193 8.582 -0.211 1.00 24.83 O ATOM 3618 CB PHE A 769 4.370 9.119 2.090 1.00 25.57 C ATOM 3619 CG PHE A 769 5.733 8.558 2.380 1.00 23.91 C ATOM 3620 CD1 PHE A 769 6.144 7.370 1.749 1.00 23.38 C ATOM 3621 CD2 PHE A 769 6.604 9.215 3.231 1.00 22.48 C ATOM 3622 CE1 PHE A 769 7.462 6.843 1.956 1.00 22.42 C ATOM 3623 CE2 PHE A 769 7.898 8.711 3.451 1.00 25.24 C ATOM 3624 CZ PHE A 769 8.317 7.509 2.813 1.00 19.42 C ATOM 3625 HA PHE A 769 4.734 8.830 0.006 1.00 0.00 H ATOM 3626 HB2 PHE A 769 4.201 9.981 2.735 1.00 0.00 H ATOM 3627 HB3 PHE A 769 3.623 8.355 2.304 1.00 0.00 H ATOM 3628 HD2 PHE A 769 6.285 10.128 3.734 1.00 0.00 H ATOM 3629 HE2 PHE A 769 8.583 9.242 4.112 1.00 0.00 H ATOM 3630 HZ PHE A 769 9.315 7.113 3.001 1.00 0.00 H ATOM 3631 HE1 PHE A 769 7.783 5.934 1.447 1.00 0.00 H ATOM 3632 HD1 PHE A 769 5.451 6.842 1.093 1.00 0.00 H ATOM 3633 H PHE A 769 5.182 11.430 1.222 1.00 0.00 H ATOM 3634 N THR A 770 2.146 10.763 0.407 1.00 26.79 N ATOM 3635 CA THR A 770 0.765 10.952 -0.039 1.00 28.10 C ATOM 3636 C THR A 770 0.678 10.765 -1.540 1.00 27.53 C ATOM 3637 O THR A 770 -0.167 10.016 -2.015 1.00 28.91 O ATOM 3638 CB THR A 770 0.219 12.350 0.373 1.00 27.87 C ATOM 3639 OG1 THR A 770 0.199 12.421 1.797 1.00 29.21 O ATOM 3640 CG2 THR A 770 -1.216 12.542 -0.159 1.00 30.07 C ATOM 3641 HA THR A 770 0.143 10.202 0.450 1.00 0.00 H ATOM 3642 HB THR A 770 0.857 13.128 -0.045 1.00 0.00 H ATOM 3643 HG1 THR A 770 -0.388 11.708 2.154 1.00 0.00 H ATOM 3644 HG23 THR A 770 -1.209 12.489 -1.248 1.00 0.00 H ATOM 3645 HG21 THR A 770 -1.858 11.757 0.240 1.00 0.00 H ATOM 3646 HG22 THR A 770 -1.592 13.515 0.156 1.00 0.00 H ATOM 3647 H THR A 770 2.660 11.551 0.851 1.00 0.00 H ATOM 3648 N CYS A 771 1.573 11.423 -2.278 1.00 27.97 N ATOM 3649 CA CYS A 771 1.634 11.294 -3.731 1.00 29.72 C ATOM 3650 C CYS A 771 1.990 9.866 -4.192 1.00 29.36 C ATOM 3651 O CYS A 771 1.438 9.358 -5.190 1.00 28.06 O ATOM 3652 CB CYS A 771 2.600 12.324 -4.327 1.00 30.49 C ATOM 3653 SG CYS A 771 2.909 12.178 -6.086 1.00 36.27 S ATOM 3654 HA CYS A 771 0.631 11.497 -4.107 1.00 0.00 H ATOM 3655 HB2 CYS A 771 3.555 12.226 -3.810 1.00 0.00 H ATOM 3656 HB3 CYS A 771 2.188 13.316 -4.141 1.00 0.00 H ATOM 3657 HG CYS A 771 3.791 13.164 -6.480 1.00 0.00 H ATOM 3658 H CYS A 771 2.252 12.050 -1.801 1.00 0.00 H ATOM 3659 N LEU A 772 2.905 9.223 -3.470 1.00 27.72 N ATOM 3660 CA LEU A 772 3.211 7.798 -3.754 1.00 27.69 C ATOM 3661 C LEU A 772 1.983 6.880 -3.639 1.00 28.38 C ATOM 3662 O LEU A 772 1.718 6.043 -4.535 1.00 28.34 O ATOM 3663 CB LEU A 772 4.351 7.302 -2.852 1.00 26.74 C ATOM 3664 CG LEU A 772 5.709 7.849 -3.309 1.00 27.23 C ATOM 3665 CD1 LEU A 772 6.670 7.913 -2.114 1.00 24.33 C ATOM 3666 CD2 LEU A 772 6.291 7.048 -4.477 1.00 27.74 C ATOM 3667 HA LEU A 772 3.531 7.750 -4.795 1.00 0.00 H ATOM 3668 HB2 LEU A 772 4.163 7.630 -1.830 1.00 0.00 H ATOM 3669 HB3 LEU A 772 4.379 6.213 -2.883 1.00 0.00 H ATOM 3670 HG LEU A 772 5.563 8.861 -3.688 1.00 0.00 H ATOM 3671 HD21 LEU A 772 6.428 6.011 -4.172 1.00 0.00 H ATOM 3672 HD22 LEU A 772 5.605 7.092 -5.323 1.00 0.00 H ATOM 3673 HD23 LEU A 772 7.252 7.474 -4.764 1.00 0.00 H ATOM 3674 HD11 LEU A 772 6.254 8.570 -1.350 1.00 0.00 H ATOM 3675 HD12 LEU A 772 6.803 6.913 -1.702 1.00 0.00 H ATOM 3676 HD13 LEU A 772 7.633 8.302 -2.444 1.00 0.00 H ATOM 3677 H LEU A 772 3.406 9.719 -2.706 1.00 0.00 H ATOM 3678 N ARG A 773 1.250 7.055 -2.541 1.00 28.64 N ATOM 3679 CA ARG A 773 0.066 6.267 -2.235 1.00 31.23 C ATOM 3680 C ARG A 773 -1.021 6.491 -3.304 1.00 31.70 C ATOM 3681 O ARG A 773 -1.609 5.536 -3.791 1.00 32.07 O ATOM 3682 CB ARG A 773 -0.478 6.639 -0.841 1.00 31.06 C ATOM 3683 CG ARG A 773 -1.780 5.960 -0.525 1.00 35.20 C ATOM 3684 CD ARG A 773 -2.460 6.496 0.679 1.00 37.98 C ATOM 3685 NE ARG A 773 -3.729 5.807 0.796 1.00 45.65 N ATOM 3686 CZ ARG A 773 -4.467 5.753 1.899 1.00 47.62 C ATOM 3687 NH1 ARG A 773 -5.611 5.071 1.886 1.00 49.00 N ATOM 3688 NH2 ARG A 773 -4.057 6.364 3.012 1.00 49.37 N ATOM 3689 HA ARG A 773 0.343 5.213 -2.235 1.00 0.00 H ATOM 3690 HB2 ARG A 773 0.258 6.349 -0.091 1.00 0.00 H ATOM 3691 HB3 ARG A 773 -0.629 7.718 -0.802 1.00 0.00 H ATOM 3692 HG2 ARG A 773 -2.447 6.081 -1.379 1.00 0.00 H ATOM 3693 HG3 ARG A 773 -1.585 4.900 -0.366 1.00 0.00 H ATOM 3694 HD2 ARG A 773 -2.625 7.568 0.569 1.00 0.00 H ATOM 3695 HD3 ARG A 773 -1.852 6.312 1.565 1.00 0.00 H ATOM 3696 HE ARG A 773 -4.090 5.317 -0.048 1.00 0.00 H ATOM 3697 HH12 ARG A 773 -6.197 5.022 2.744 1.00 0.00 H ATOM 3698 HH11 ARG A 773 -5.918 4.588 1.018 1.00 0.00 H ATOM 3699 HH22 ARG A 773 -4.638 6.319 3.874 1.00 0.00 H ATOM 3700 HH21 ARG A 773 -3.157 6.885 3.018 1.00 0.00 H ATOM 3701 H ARG A 773 1.539 7.793 -1.868 1.00 0.00 H ATOM 3702 N MET A 774 -1.279 7.748 -3.658 1.00 32.71 N ATOM 3703 CA MET A 774 -2.227 8.045 -4.741 1.00 34.73 C ATOM 3704 C MET A 774 -1.822 7.375 -6.050 1.00 34.69 C ATOM 3705 O MET A 774 -2.642 6.700 -6.671 1.00 34.80 O ATOM 3706 CB MET A 774 -2.377 9.555 -4.983 1.00 34.81 C ATOM 3707 CG MET A 774 -2.957 10.359 -3.844 1.00 37.03 C ATOM 3708 SD MET A 774 -2.642 12.117 -4.192 1.00 44.18 S ATOM 3709 CE MET A 774 -3.831 12.387 -5.492 1.00 39.31 C ATOM 3710 HA MET A 774 -3.185 7.643 -4.412 1.00 0.00 H ATOM 3711 HB2 MET A 774 -1.388 9.956 -5.204 1.00 0.00 H ATOM 3712 HB3 MET A 774 -3.024 9.690 -5.849 1.00 0.00 H ATOM 3713 HG2 MET A 774 -2.479 10.074 -2.907 1.00 0.00 H ATOM 3714 HG3 MET A 774 -4.030 10.181 -3.772 1.00 0.00 H ATOM 3715 HE1 MET A 774 -3.612 11.722 -6.327 1.00 0.00 H ATOM 3716 HE2 MET A 774 -4.833 12.181 -5.115 1.00 0.00 H ATOM 3717 HE3 MET A 774 -3.773 13.423 -5.826 1.00 0.00 H ATOM 3718 H MET A 774 -0.804 8.529 -3.162 1.00 0.00 H ATOM 3719 N GLU A 775 -0.570 7.546 -6.472 1.00 34.80 N ATOM 3720 CA GLU A 775 -0.126 6.940 -7.720 1.00 35.63 C ATOM 3721 C GLU A 775 -0.145 5.416 -7.701 1.00 35.50 C ATOM 3722 O GLU A 775 -0.557 4.795 -8.692 1.00 34.97 O ATOM 3723 CB GLU A 775 1.250 7.445 -8.142 1.00 36.61 C ATOM 3724 CG GLU A 775 1.314 8.946 -8.283 1.00 41.36 C ATOM 3725 CD GLU A 775 2.049 9.347 -9.518 1.00 47.91 C ATOM 3726 OE1 GLU A 775 1.525 9.088 -10.622 1.00 50.59 O ATOM 3727 OE2 GLU A 775 3.144 9.922 -9.392 1.00 52.21 O ATOM 3728 HA GLU A 775 -0.859 7.257 -8.462 1.00 0.00 H ATOM 3729 HB2 GLU A 775 1.978 7.136 -7.392 1.00 0.00 H ATOM 3730 HB3 GLU A 775 1.505 6.995 -9.102 1.00 0.00 H ATOM 3731 HG2 GLU A 775 0.299 9.341 -8.330 1.00 0.00 H ATOM 3732 HG3 GLU A 775 1.825 9.362 -7.415 1.00 0.00 H ATOM 3733 H GLU A 775 0.093 8.115 -5.908 1.00 0.00 H ATOM 3734 N LEU A 776 0.298 4.816 -6.585 1.00 35.40 N ATOM 3735 CA LEU A 776 0.191 3.363 -6.362 1.00 35.25 C ATOM 3736 C LEU A 776 -1.265 2.852 -6.312 1.00 36.62 C ATOM 3737 O LEU A 776 -1.554 1.756 -6.803 1.00 36.68 O ATOM 3738 CB LEU A 776 0.950 2.939 -5.092 1.00 34.44 C ATOM 3739 CG LEU A 776 2.481 3.062 -5.215 1.00 31.67 C ATOM 3740 CD1 LEU A 776 3.180 3.073 -3.825 1.00 27.51 C ATOM 3741 CD2 LEU A 776 3.079 1.999 -6.173 1.00 29.58 C ATOM 3742 HA LEU A 776 0.655 2.896 -7.231 1.00 0.00 H ATOM 3743 HB2 LEU A 776 0.619 3.569 -4.267 1.00 0.00 H ATOM 3744 HB3 LEU A 776 0.704 1.899 -4.875 1.00 0.00 H ATOM 3745 HG LEU A 776 2.684 4.032 -5.670 1.00 0.00 H ATOM 3746 HD21 LEU A 776 2.848 1.002 -5.797 1.00 0.00 H ATOM 3747 HD22 LEU A 776 2.648 2.123 -7.166 1.00 0.00 H ATOM 3748 HD23 LEU A 776 4.160 2.127 -6.226 1.00 0.00 H ATOM 3749 HD11 LEU A 776 2.816 3.920 -3.243 1.00 0.00 H ATOM 3750 HD12 LEU A 776 2.954 2.146 -3.299 1.00 0.00 H ATOM 3751 HD13 LEU A 776 4.258 3.161 -3.962 1.00 0.00 H ATOM 3752 H LEU A 776 0.736 5.402 -5.846 1.00 0.00 H ATOM 3753 N GLU A 777 -2.172 3.628 -5.725 1.00 37.94 N ATOM 3754 CA GLU A 777 -3.582 3.200 -5.651 1.00 40.03 C ATOM 3755 C GLU A 777 -4.200 3.234 -7.040 1.00 41.25 C ATOM 3756 O GLU A 777 -4.841 2.274 -7.468 1.00 41.66 O ATOM 3757 CB GLU A 777 -4.386 4.014 -4.633 1.00 40.08 C ATOM 3758 CG GLU A 777 -4.161 3.527 -3.202 1.00 40.34 C ATOM 3759 CD GLU A 777 -4.834 4.376 -2.122 1.00 42.28 C ATOM 3760 OE1 GLU A 777 -5.340 5.465 -2.415 1.00 45.82 O ATOM 3761 OE2 GLU A 777 -4.829 3.958 -0.953 1.00 44.76 O ATOM 3762 HA GLU A 777 -3.612 2.173 -5.287 1.00 0.00 H ATOM 3763 HB2 GLU A 777 -4.084 5.059 -4.701 1.00 0.00 H ATOM 3764 HB3 GLU A 777 -5.446 3.927 -4.872 1.00 0.00 H ATOM 3765 HG2 GLU A 777 -4.548 2.511 -3.125 1.00 0.00 H ATOM 3766 HG3 GLU A 777 -3.088 3.522 -3.010 1.00 0.00 H ATOM 3767 H GLU A 777 -1.886 4.541 -5.316 1.00 0.00 H ATOM 3768 N ASN A 778 -3.947 4.310 -7.767 1.00 42.70 N ATOM 3769 CA ASN A 778 -4.383 4.377 -9.162 1.00 44.54 C ATOM 3770 C ASN A 778 -3.913 3.200 -10.011 1.00 44.51 C ATOM 3771 O ASN A 778 -4.730 2.581 -10.688 1.00 44.62 O ATOM 3772 CB ASN A 778 -4.046 5.720 -9.797 1.00 44.97 C ATOM 3773 CG ASN A 778 -5.141 6.769 -9.550 1.00 48.48 C ATOM 3774 OD1 ASN A 778 -6.319 6.431 -9.405 1.00 51.27 O ATOM 3775 ND2 ASN A 778 -4.749 8.045 -9.503 1.00 51.07 N ATOM 3776 HA ASN A 778 -5.469 4.293 -9.136 1.00 0.00 H ATOM 3777 HB2 ASN A 778 -3.109 6.083 -9.374 1.00 0.00 H ATOM 3778 HB3 ASN A 778 -3.928 5.581 -10.872 1.00 0.00 H ATOM 3779 HD22 ASN A 778 -3.745 8.286 -9.630 1.00 0.00 H ATOM 3780 HD21 ASN A 778 -5.447 8.798 -9.339 1.00 0.00 H ATOM 3781 H ASN A 778 -3.436 5.112 -7.345 1.00 0.00 H ATOM 3782 N ILE A 779 -2.616 2.880 -9.937 1.00 44.37 N ATOM 3783 CA ILE A 779 -2.023 1.726 -10.633 1.00 43.97 C ATOM 3784 C ILE A 779 -2.737 0.443 -10.243 1.00 43.85 C ATOM 3785 O ILE A 779 -3.071 -0.375 -11.103 1.00 43.87 O ATOM 3786 CB ILE A 779 -0.474 1.611 -10.366 1.00 44.17 C ATOM 3787 CG1 ILE A 779 0.258 2.810 -10.986 1.00 44.72 C ATOM 3788 CG2 ILE A 779 0.108 0.271 -10.884 1.00 43.82 C ATOM 3789 CD1 ILE A 779 1.765 2.918 -10.642 1.00 46.78 C ATOM 3790 HA ILE A 779 -2.154 1.885 -11.703 1.00 0.00 H ATOM 3791 HB ILE A 779 -0.319 1.624 -9.287 1.00 0.00 H ATOM 3792 HG12 ILE A 779 0.164 2.738 -12.070 1.00 0.00 H ATOM 3793 HG13 ILE A 779 -0.232 3.720 -10.640 1.00 0.00 H ATOM 3794 HD11 ILE A 779 1.884 3.007 -9.562 1.00 0.00 H ATOM 3795 HD12 ILE A 779 2.281 2.025 -10.993 1.00 0.00 H ATOM 3796 HD13 ILE A 779 2.185 3.798 -11.129 1.00 0.00 H ATOM 3797 HG21 ILE A 779 -0.387 -0.558 -10.379 1.00 0.00 H ATOM 3798 HG22 ILE A 779 -0.059 0.195 -11.958 1.00 0.00 H ATOM 3799 HG23 ILE A 779 1.178 0.237 -10.678 1.00 0.00 H ATOM 3800 H ILE A 779 -1.994 3.478 -9.357 1.00 0.00 H ATOM 3801 N LEU A 780 -2.997 0.292 -8.947 1.00 44.29 N ATOM 3802 CA LEU A 780 -3.677 -0.880 -8.415 1.00 45.01 C ATOM 3803 C LEU A 780 -5.114 -0.971 -8.952 1.00 46.40 C ATOM 3804 O LEU A 780 -5.612 -2.063 -9.236 1.00 45.78 O ATOM 3805 CB LEU A 780 -3.652 -0.874 -6.878 1.00 44.72 C ATOM 3806 CG LEU A 780 -4.129 -2.110 -6.105 1.00 44.76 C ATOM 3807 CD1 LEU A 780 -3.351 -3.356 -6.529 1.00 43.96 C ATOM 3808 CD2 LEU A 780 -4.043 -1.895 -4.582 1.00 44.67 C ATOM 3809 HA LEU A 780 -3.142 -1.768 -8.752 1.00 0.00 H ATOM 3810 HB2 LEU A 780 -2.619 -0.693 -6.579 1.00 0.00 H ATOM 3811 HB3 LEU A 780 -4.274 -0.039 -6.555 1.00 0.00 H ATOM 3812 HG LEU A 780 -5.179 -2.266 -6.354 1.00 0.00 H ATOM 3813 HD21 LEU A 780 -3.009 -1.692 -4.303 1.00 0.00 H ATOM 3814 HD22 LEU A 780 -4.670 -1.049 -4.300 1.00 0.00 H ATOM 3815 HD23 LEU A 780 -4.389 -2.792 -4.070 1.00 0.00 H ATOM 3816 HD11 LEU A 780 -3.500 -3.531 -7.595 1.00 0.00 H ATOM 3817 HD12 LEU A 780 -2.290 -3.206 -6.329 1.00 0.00 H ATOM 3818 HD13 LEU A 780 -3.710 -4.217 -5.965 1.00 0.00 H ATOM 3819 H LEU A 780 -2.703 1.041 -8.288 1.00 0.00 H ATOM 3820 N GLY A 781 -5.760 0.186 -9.112 1.00 47.78 N ATOM 3821 CA GLY A 781 -7.123 0.256 -9.650 1.00 49.32 C ATOM 3822 C GLY A 781 -7.215 -0.023 -11.142 1.00 50.31 C ATOM 3823 O GLY A 781 -8.310 -0.267 -11.665 1.00 51.00 O ATOM 3824 HA3 GLY A 781 -7.514 1.256 -9.463 1.00 0.00 H ATOM 3825 HA2 GLY A 781 -7.737 -0.477 -9.126 1.00 0.00 H ATOM 3826 H GLY A 781 -5.280 1.069 -8.846 1.00 0.00 H ATOM 3827 N HIS A 782 -6.067 0.010 -11.818 1.00 51.15 N ATOM 3828 CA HIS A 782 -5.963 -0.192 -13.263 1.00 51.76 C ATOM 3829 C HIS A 782 -5.349 -1.544 -13.614 1.00 51.65 C ATOM 3830 O HIS A 782 -4.871 -2.271 -12.741 1.00 51.08 O ATOM 3831 CB HIS A 782 -5.116 0.915 -13.883 1.00 52.43 C ATOM 3832 CG HIS A 782 -5.831 2.227 -14.016 1.00 55.29 C ATOM 3833 ND1 HIS A 782 -6.199 2.994 -12.927 1.00 57.42 N ATOM 3834 CD2 HIS A 782 -6.234 2.915 -15.112 1.00 57.19 C ATOM 3835 CE1 HIS A 782 -6.801 4.092 -13.348 1.00 58.61 C ATOM 3836 NE2 HIS A 782 -6.837 4.068 -14.669 1.00 59.09 N ATOM 3837 HA HIS A 782 -6.976 -0.166 -13.665 1.00 0.00 H ATOM 3838 HB2 HIS A 782 -4.236 1.065 -13.257 1.00 0.00 H ATOM 3839 HB3 HIS A 782 -4.803 0.592 -14.876 1.00 0.00 H ATOM 3840 HD2 HIS A 782 -6.104 2.611 -16.151 1.00 0.00 H ATOM 3841 HE1 HIS A 782 -7.200 4.883 -12.714 1.00 0.00 H ATOM 3842 H HIS A 782 -5.192 0.190 -11.286 1.00 0.00 H TER 3843 HIS A 782 HETATM 3844 O HOH 1 11.078 -12.870 9.930 1.00 41.92 O HETATM 3845 O HOH 2 5.311 12.580 2.978 1.00 43.62 O HETATM 3846 O HOH 3 1.719 15.697 -0.562 1.00 44.51 O HETATM 3847 O HOH 4 -0.821 -6.546 1.651 1.00 37.26 O HETATM 3848 O HOH 5 29.108 4.673 0.975 1.00 49.76 O HETATM 3849 O HOH 6 14.227 5.188 5.813 1.00 21.64 O HETATM 3850 O HOH 7 15.437 -5.454 3.165 1.00 24.76 O HETATM 3851 O HOH 8 12.921 -1.227 17.464 1.00 47.37 O HETATM 3852 O HOH 9 15.723 8.481 6.252 1.00 23.85 O HETATM 3853 O HOH 10 17.076 14.466 3.301 1.00 42.23 O HETATM 3854 O HOH 11 23.544 -1.764 3.139 1.00 37.68 O HETATM 3855 O HOH 12 16.832 -6.947 -0.453 1.00 30.26 O HETATM 3856 O HOH 13 20.842 14.923 -2.223 1.00 39.57 O HETATM 3857 O HOH 14 17.346 6.907 2.543 1.00 22.12 O HETATM 3858 O HOH 15 8.194 -13.680 6.294 1.00 26.06 O HETATM 3859 O HOH 16 4.723 14.936 -4.046 1.00 36.57 O HETATM 3860 O HOH 17 8.582 -16.090 4.766 1.00 41.90 O HETATM 3861 O HOH 18 18.384 -2.550 9.282 1.00 38.68 O HETATM 3862 O HOH 19 17.134 0.951 5.523 1.00 28.76 O HETATM 3863 O HOH 20 5.091 -5.735 -14.043 1.00 53.04 O HETATM 3864 O HOH 21 13.649 6.678 14.004 1.00 37.40 O HETATM 3865 O HOH 22 1.871 -12.385 10.934 1.00 32.22 O HETATM 3866 O HOH 23 19.283 14.608 10.180 1.00 41.12 O HETATM 3867 O HOH 24 12.865 -16.519 3.186 1.00 37.31 O HETATM 3868 O HOH 25 16.846 6.333 5.149 1.00 29.28 O HETATM 3869 O HOH 26 -5.367 -0.832 5.328 1.00 42.86 O HETATM 3870 O HOH 27 18.927 3.766 -6.934 1.00 30.44 O HETATM 3871 O HOH 28 7.264 14.476 1.462 1.00 38.40 O HETATM 3872 O HOH 29 22.855 11.610 -9.187 1.00 40.42 O HETATM 3873 O HOH 30 15.846 -3.591 12.283 1.00 47.75 O HETATM 3874 O HOH 31 -5.583 7.291 -6.105 1.00 41.15 O HETATM 3875 O HOH 32 15.377 -0.350 12.391 1.00 43.24 O HETATM 3876 O HOH 33 -2.040 -3.640 -11.917 1.00 54.63 O HETATM 3877 O HOH 34 0.247 -11.217 13.197 1.00 49.28 O HETATM 3878 O HOH 35 2.092 2.110 18.750 1.00 51.45 O HETATM 3879 O HOH 36 -0.455 15.234 12.269 1.00 54.17 O HETATM 3880 O HOH 37 9.878 13.563 -0.493 1.00 30.08 O HETATM 3881 O HOH 38 18.465 -11.828 -1.676 1.00 35.71 O HETATM 3882 O HOH 39 0.094 1.284 14.912 1.00 37.27 O HETATM 3883 O HOH 40 17.805 -6.723 3.570 1.00 30.29 O HETATM 3884 O HOH 41 11.816 11.339 13.880 1.00 42.24 O HETATM 3885 O HOH 42 -0.907 -2.053 13.529 1.00 45.39 O HETATM 3886 O HOH 43 20.279 6.511 -13.442 1.00 53.19 O HETATM 3887 O HOH 44 6.951 11.794 16.017 1.00 53.49 O HETATM 3888 O HOH 45 24.153 16.424 0.844 1.00 47.68 O HETATM 3889 O HOH 46 11.576 15.861 6.995 1.00 34.31 O HETATM 3890 O HOH 47 1.015 -13.719 14.539 1.00 43.25 O HETATM 3891 O HOH 48 18.053 4.031 5.731 1.00 34.51 O HETATM 3892 O HOH 49 0.742 -3.776 15.062 1.00 46.18 O HETATM 3893 O HOH 50 12.962 -22.927 -5.773 1.00 46.23 O HETATM 3894 O HOH 51 18.936 -7.064 1.159 1.00 36.39 O HETATM 3895 O HOH 52 18.728 13.112 -9.957 1.00 41.99 O HETATM 3896 O HOH 53 -2.459 0.344 16.332 1.00 54.22 O HETATM 3897 O HOH 54 -4.038 5.492 5.908 1.00 30.96 O HETATM 3898 O HOH 55 -3.063 -3.793 8.624 1.00 38.63 O HETATM 3899 O HOH 56 16.754 -1.180 15.093 1.00 47.49 O HETATM 3900 O HOH 57 13.753 21.814 -5.896 1.00 56.71 O HETATM 3901 O HOH 58 4.540 6.094 -12.520 1.00 40.89 O HETATM 3902 O HOH 59 2.199 -17.994 17.115 1.00 64.04 O HETATM 3903 O HOH 60 19.253 4.040 10.214 1.00 45.75 O HETATM 3904 O HOH 61 8.941 9.995 7.292 1.00 37.36 O HETATM 3905 O HOH 62 22.222 18.478 1.440 1.00 39.27 O HETATM 3906 O HOH 63 -3.874 -3.842 2.416 1.00 48.84 O HETATM 3907 O HOH 64 33.717 9.676 -2.627 1.00 45.25 O HETATM 3908 O HOH 65 20.140 -9.525 1.823 1.00 48.46 O HETATM 3909 O HOH 66 8.959 -2.146 15.694 1.00 42.05 O HETATM 3910 O HOH 67 16.089 -17.116 -7.119 1.00 50.42 O HETATM 3911 O HOH 68 26.568 18.210 7.115 1.00 50.18 O HETATM 3912 O HOH 69 16.978 16.059 -9.074 1.00 55.39 O HETATM 3913 O HOH 70 -4.771 1.672 14.204 1.00 52.77 O HETATM 3914 O HOH 71 19.638 18.037 1.215 1.00 52.80 O HETATM 3915 O HOH 72 27.779 14.768 8.163 1.00 47.77 O HETATM 3916 O HOH 73 18.467 5.219 12.609 1.00 49.74 O HETATM 3917 O HOH 74 14.687 -11.110 6.896 1.00 34.48 O HETATM 3918 O HOH 75 15.184 -15.129 4.545 1.00 40.69 O HETATM 3919 O HOH 76 20.139 3.493 -2.328 1.00 22.49 O HETATM 3920 C1 LUN A 77 10.411 -7.633 14.651 1.00 0.02 C HETATM 3921 C2 LUN A 77 9.060 -7.027 14.881 1.00 -0.02 C HETATM 3922 C6 LUN A 77 8.140 -7.994 15.202 1.00 0.10 C HETATM 3923 N8 LUN A 77 8.730 -9.263 15.212 1.00 -0.20 N HETATM 3924 C3 LUN A 77 10.114 -9.122 14.786 1.00 0.04 C HETATM 3925 H1 LUN A 77 10.783 -9.571 15.535 1.00 0.05 H HETATM 3926 H2 LUN A 77 10.260 -9.622 13.817 1.00 0.05 H HETATM 3927 C13 LUN A 77 7.951 -10.429 15.124 1.00 0.27 C HETATM 3928 C16 LUN A 77 8.543 -11.645 14.662 1.00 0.14 C HETATM 3929 C20 LUN A 77 9.832 -12.149 14.640 1.00 -0.04 C HETATM 3930 C24 LUN A 77 9.809 -13.437 14.036 1.00 -0.02 C HETATM 3931 C25 LUN A 77 8.495 -13.698 13.699 1.00 0.06 C HETATM 3932 N21 LUN A 77 7.768 -12.611 14.091 1.00 -0.27 N HETATM 3933 H20 LUN A 77 6.748 -12.530 13.969 1.00 0.23 H HETATM 3934 C28 LUN A 77 8.061 -14.854 13.085 1.00 -0.04 C HETATM 3935 C30 LUN A 77 9.042 -15.782 12.819 1.00 -0.04 C HETATM 3936 C29 LUN A 77 10.360 -15.562 13.145 1.00 0.12 C HETATM 3937 C27 LUN A 77 10.779 -14.392 13.752 1.00 -0.04 C HETATM 3938 H27 LUN A 77 11.822 -14.226 13.997 1.00 0.05 H HETATM 3939 F31 LUN A 77 11.270 -16.529 12.846 1.00 -0.19 F HETATM 3940 H29 LUN A 77 8.768 -16.714 12.338 1.00 0.05 H HETATM 3941 H28 LUN A 77 7.021 -15.020 12.830 1.00 0.05 H HETATM 3942 H19 LUN A 77 10.717 -11.643 15.022 1.00 0.04 H HETATM 3943 O17 LUN A 77 6.756 -10.427 15.413 1.00 -0.36 O HETATM 3944 C11 LUN A 77 6.825 -7.685 15.446 1.00 -0.01 C HETATM 3945 C15 LUN A 77 6.434 -6.365 15.365 1.00 -0.05 C HETATM 3946 C12 LUN A 77 7.354 -5.373 15.049 1.00 -0.05 C HETATM 3947 C7 LUN A 77 8.674 -5.704 14.803 1.00 -0.05 C HETATM 3948 H7 LUN A 77 9.396 -4.935 14.552 1.00 0.08 H HETATM 3949 H12 LUN A 77 7.037 -4.338 14.995 1.00 0.06 H HETATM 3950 H14 LUN A 77 5.399 -6.099 15.550 1.00 0.08 H HETATM 3951 H11 LUN A 77 6.110 -8.461 15.697 1.00 0.06 H HETATM 3952 C4 LUN A 77 11.031 -7.366 13.294 1.00 -0.06 C HETATM 3953 N9 LUN A 77 12.450 -6.977 13.548 1.00 0.23 N HETATM 3954 C10 LUN A 77 12.751 -7.127 14.992 1.00 -0.04 C HETATM 3955 C5 LUN A 77 11.401 -7.181 15.674 1.00 -0.04 C HETATM 3956 H5 LUN A 77 11.430 -7.893 16.512 1.00 0.02 H HETATM 3957 H6 LUN A 77 11.127 -6.184 16.049 1.00 0.02 H HETATM 3958 H9 LUN A 77 13.313 -8.055 15.175 1.00 0.08 H HETATM 3959 H10 LUN A 77 13.333 -6.268 15.356 1.00 0.08 H HETATM 3960 C14 LUN A 77 13.464 -7.610 12.655 1.00 0.02 C HETATM 3961 C18 LUN A 77 14.846 -7.042 12.964 1.00 0.00 C HETATM 3962 C22 LUN A 77 15.863 -7.551 11.946 1.00 -0.01 C HETATM 3963 C26 LUN A 77 15.413 -7.216 10.533 1.00 -0.03 C HETATM 3964 N23 LUN A 77 14.082 -7.790 10.298 1.00 0.23 N HETATM 3965 C19 LUN A 77 13.127 -7.205 11.240 1.00 0.01 C HETATM 3966 H17 LUN A 77 13.164 -6.109 11.159 1.00 0.09 H HETATM 3967 H18 LUN A 77 12.114 -7.557 10.994 1.00 0.09 H HETATM 3968 H23 LUN A 77 13.790 -7.588 9.354 1.00 0.20 H HETATM 3969 H24 LUN A 77 14.118 -8.788 10.432 1.00 0.20 H HETATM 3970 H25 LUN A 77 16.127 -7.637 9.810 1.00 0.08 H HETATM 3971 H26 LUN A 77 15.369 -6.124 10.411 1.00 0.08 H HETATM 3972 H21 LUN A 77 15.961 -8.642 12.046 1.00 0.03 H HETATM 3973 H22 LUN A 77 16.837 -7.077 12.138 1.00 0.03 H HETATM 3974 H15 LUN A 77 15.152 -7.358 13.972 1.00 0.03 H HETATM 3975 H16 LUN A 77 14.806 -5.944 12.920 1.00 0.03 H HETATM 3976 H13 LUN A 77 13.457 -8.704 12.770 1.00 0.09 H HETATM 3977 H8 LUN A 77 12.505 -5.990 13.349 1.00 0.20 H HETATM 3978 H3 LUN A 77 10.498 -6.549 12.786 1.00 0.07 H HETATM 3979 H4 LUN A 77 10.991 -8.273 12.672 1.00 0.07 H CONECT 1 2 15 16 17 CONECT 15 1 CONECT 16 1 CONECT 17 1 CONECT 99 100 118 119 120 CONECT 118 99 CONECT 119 99 CONECT 120 99 CONECT 412 413 427 428 429 CONECT 427 412 CONECT 428 412 CONECT 429 412 CONECT 553 554 563 564 565 CONECT 563 553 CONECT 564 553 CONECT 565 553 CONECT 1051 1052 1069 1070 1071 CONECT 1069 1051 CONECT 1070 1051 CONECT 1071 1051 CONECT 2262 2263 2280 2281 2282 CONECT 2280 2262 CONECT 2281 2262 CONECT 2282 2262 CONECT 3920 3921 3924 3952 3955 CONECT 3921 3920 3922 3947 CONECT 3922 3921 3923 3944 CONECT 3923 3922 3924 3927 CONECT 3924 3920 3923 3925 3926 CONECT 3925 3924 CONECT 3926 3924 CONECT 3927 3923 3928 3943 CONECT 3928 3927 3929 3932 CONECT 3929 3928 3930 3942 CONECT 3930 3929 3931 3937 CONECT 3931 3930 3932 3934 CONECT 3932 3928 3931 3933 CONECT 3933 3932 CONECT 3934 3931 3935 3941 CONECT 3935 3934 3936 3940 CONECT 3936 3935 3937 3939 CONECT 3937 3930 3936 3938 CONECT 3938 3937 CONECT 3939 3936 CONECT 3940 3935 CONECT 3941 3934 CONECT 3942 3929 CONECT 3943 3927 CONECT 3944 3922 3945 3951 CONECT 3945 3944 3946 3950 CONECT 3946 3945 3947 3949 CONECT 3947 3921 3946 3948 CONECT 3948 3947 CONECT 3949 3946 CONECT 3950 3945 CONECT 3951 3944 CONECT 3952 3920 3953 3978 3979 CONECT 3953 3952 3954 3960 3977 CONECT 3954 3953 3955 3958 3959 CONECT 3955 3920 3954 3956 3957 CONECT 3956 3955 CONECT 3957 3955 CONECT 3958 3954 CONECT 3959 3954 CONECT 3960 3953 3961 3965 3976 CONECT 3961 3960 3962 3974 3975 CONECT 3962 3961 3963 3972 3973 CONECT 3963 3962 3964 3970 3971 CONECT 3964 3963 3965 3968 3969 CONECT 3965 3960 3964 3966 3967 CONECT 3966 3965 CONECT 3967 3965 CONECT 3968 3964 CONECT 3969 3964 CONECT 3970 3963 CONECT 3971 3963 CONECT 3972 3962 CONECT 3973 3962 CONECT 3974 3961 CONECT 3975 3961 CONECT 3976 3960 CONECT 3977 3953 CONECT 3978 3952 CONECT 3979 3952 MASTER 0 0 0 0 0 0 0 0 3972 7 84 22 END
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Related entries of code: 3qup
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
4feq
RCSB PDB
PDBbind
323aa, >4FEQ_1|Chain... at 100%
4ff8
RCSB PDB
PDBbind
323aa, >4FF8_1|Chain... at 100%
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
3qup
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
kinase domain of the murine receptor tyrosine kinase TYRO3 (Sky)
Ligand Name
LUN
EC.Number
E.C.2.7.10.1
Resolution
1.9(Å)
Affinity (Kd/Ki/IC50)
IC50=0.476uM
Release Year
2011
Protein/NA Sequence
Check fasta file
Primary Reference
(2012) Bioorg. Med. Chem. Lett. Vol. 22: pp. 190-193
Ligand Properties
Formula
C
2
5
H
2
9
FN
4
O
Molecular Weight
420.522
Exact Mass
420.233
No. of atoms
60
No. of bonds
65
Polar Surface Area
57.15
LOGP Value
3.63 (
Computed with XLOGP3
)
4.42 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 1
No. of Rotatable Bonds: 3
No. of Nitrogen and Oxygen Atoms: 5
No. of Rings: 6
Canonical SMILES
Fc1ccc2c(c1)cc([nH]2)C(=O)N1C[C@@]2(c3c1cccc3)CC[N@H+](C2)[C@@H]1CCC[NH2+]C1
InChI String
InChI=1S/C25H27FN4O/c26-18-7-8-21-17(12-18)13-22(28-21)24(31)30-16-25(20-5-1-2-6-23(20)30)9-11-29(15-25)19-4-3-10-27-14-19/h1-2,5-8,12-13,19,27-28H,3-4,9-11,14-16H2/p+2/t19-,25-/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P55144
Entrez Gene ID
NCBI Entrez Gene ID:
22174
ASD
Information of known allosteric effects of PDB entries
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