Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4lxs_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 7.A N GLY 3.A O no hydrogen 3.081 N/A SER 8.A N ARG 4.A O no hydrogen 3.081 N/A SER 8.A OG ASP 5.A O no hydrogen 2.784 N/A GLU 9.A N ALA 6.A O no hydrogen 3.253 N/A CYS 13.A SG GLN 59.A O no hydrogen 3.708 N/A GLN 14.A N ILE 25.A O no hydrogen 3.199 N/A GLU 21.A N ILE 18.A O no hydrogen 2.669 N/A TYR 22.A N ILE 39.A O no hydrogen 2.871 N/A GLU 23.A N ALA 16.A O no hydrogen 3.436 N/A ILE 25.A N GLN 14.A O no hydrogen 2.966 N/A CYS 26.A N PHE 35.A O no hydrogen 3.067 N/A THR 34.A OG1 GLN 59.A OE1 no hydrogen 2.703 N/A PHE 35.A N CYS 26.A O no hydrogen 2.892 N/A ARG 36.A N MET 48.A O no hydrogen 2.882 N/A THR 38.A N GLN 46.A O no hydrogen 2.879 N/A THR 38.A OG1 GLU 23.A OE1 no hydrogen 3.216 N/A ILE 39.A N TYR 22.A O no hydrogen 2.843 N/A GLN 40.A N TYR 44.A O no hydrogen 3.383 N/A ASP 43.A N GLN 40.A O no hydrogen 3.033 N/A TYR 44.A N GLN 40.A O no hydrogen 3.137 N/A VAL 45.A N ARG 71.A O no hydrogen 2.919 N/A GLN 46.A N THR 38.A O no hydrogen 3.109 N/A ILE 47.A N GLN 73.A O no hydrogen 2.642 N/A CYS 49.A N ARG 75.A O no hydrogen 2.962 N/A CYS 49.A SG ARG 75.A O no hydrogen 4.048 N/A THR 52.A N ASP 56.A OD2 no hydrogen 2.855 N/A THR 52.A OG1 ASP 56.A OD2 no hydrogen 3.415 N/A ASP 53.A N THR 52.A OG1 no hydrogen 2.470 N/A TYR 57.A OH MET 78.A O no hydrogen 2.428 N/A GLN 59.A N ASP 56.A O no hydrogen 3.082 N/A LEU 60.A N TYR 57.A O no hydrogen 3.434 N/A GLY 67.A N GLY 93.A O no hydrogen 3.232 N/A ASP 70.A N ASP 43.A O no hydrogen 2.585 N/A ARG 71.A N ASP 43.A O no hydrogen 3.272 N/A ARG 71.A NH1 GLN 73.A OE1 no hydrogen 3.012 N/A VAL 72.A N THR 99.A O no hydrogen 2.653 N/A GLN 73.A N VAL 45.A O no hydrogen 3.057 N/A MET 74.A N ILE 101.A O no hydrogen 2.701 N/A ARG 75.A N ILE 47.A O no hydrogen 2.974 N/A ARG 76.A N GLU 103.A O no hydrogen 3.044 N/A ARG 76.A NE CYS 49.A O no hydrogen 3.169 N/A ARG 76.A NH1 ASN 50.A OD1 no hydrogen 2.796 N/A CYS 77.A SG ILE 47.A O no hydrogen 3.782 N/A CYS 77.A SG ARG 75.A O no hydrogen 3.527 N/A LEU 79.A N LEU 107.A O no hydrogen 2.747 N/A GLY 81.A N LEU 79.A O no hydrogen 2.876 N/A THR 83.A N PRO 80.A O no hydrogen 2.852 N/A ILE 85.A N HIS 115.A O no hydrogen 3.022 N/A SER 87.A N PRO 84.A O no hydrogen 2.978 N/A SER 87.A OG PRO 84.A O no hydrogen 2.944 N/A LEU 89.A N ILE 85.A O no hydrogen 3.229 N/A ASP 90.A N ALA 86.A O no hydrogen 3.033 N/A TYR 91.A N SER 87.A O no hydrogen 2.779 N/A LEU 92.A N ILE 88.A O no hydrogen 3.061 N/A GLY 93.A N ASP 90.A O no hydrogen 3.005 N/A ILE 94.A N LEU 89.A O no hydrogen 2.966 N/A VAL 95.A N GLY 67.A O no hydrogen 3.293 N/A THR 98.A N ASP 70.A O no hydrogen 2.824 N/A THR 99.A N ASP 70.A O no hydrogen 2.824 N/A LEU 100.A N ARG 124.A O no hydrogen 3.010 N/A ILE 101.A N VAL 72.A O no hydrogen 2.687 N/A PHE 102.A N ARG 126.A O no hydrogen 2.688 N/A GLU 103.A N MET 74.A O no hydrogen 2.926 N/A SER 104.A N THR 128.A O no hydrogen 3.086 N/A SER 104.A OG CYS 77.A O no hydrogen 3.104 N/A ASN 106.A N SER 104.A OG no hydrogen 2.634 N/A GLN 114.A N THR 112.A OG1 no hydrogen 3.003 N/A GLN 114.A NE2 HIS 82.A O no hydrogen 2.656 N/A HIS 115.A N THR 112.A O no hydrogen 3.020 N/A LEU 116.A N ARG 113.A O no hydrogen 2.963 N/A ASP 117.A N GLN 114.A O no hydrogen 3.326 N/A ARG 118.A NH2 SER 87.A OG no hydrogen 2.873 N/A LYS 123.A N THR 98.A O no hydrogen 3.084 N/A ARG 124.A N THR 98.A O no hydrogen 3.012 N/A PHE 125.A N HIS 148.A O no hydrogen 3.213 N/A ARG 126.A N LEU 100.A O no hydrogen 3.071 N/A ARG 126.A NH1 GLU 103.A OE2 no hydrogen 2.586 N/A ARG 126.A NH2 GLU 103.A OE2 no hydrogen 2.923 N/A PHE 127.A N GLU 150.A O no hydrogen 2.945 N/A THR 128.A N PHE 102.A O no hydrogen 2.752 N/A THR 129.A N ARG 152.A O no hydrogen 2.919 N/A THR 129.A OG1 SER 104.A O no hydrogen 3.173 N/A ARG 130.A N ASP 105.A OD1 no hydrogen 2.628 N/A ARG 130.A NE ASP 105.A OD1 no hydrogen 3.269 N/A ARG 130.A NH2 ASP 105.A OD2 no hydrogen 2.546 N/A ARG 131.A N THR 129.A OG1 no hydrogen 3.016 N/A ARG 131.A NH1 ASP 105.A O no hydrogen 2.665 N/A THR 133.A OG1 ASN 110.A OD1 no hydrogen 3.013 N/A THR 133.A OG1 LEU 132.A O no hydrogen 3.198 N/A HIS 134.A N ASN 110.A OD1 no hydrogen 3.349 N/A LEU 139.A N PRO 136.A O no hydrogen 3.269 N/A THR 141.A OG1 ASN 138.A O no hydrogen 2.483 N/A SER 147.A N LYS 123.A O no hydrogen 2.838 N/A SER 147.A OG LYS 123.A O no hydrogen 2.814 N/A HIS 148.A N LYS 123.A O no hydrogen 3.105 N/A HIS 148.A ND1 SER 171.A OG no hydrogen 2.997 N/A LEU 149.A N SER 171.A O no hydrogen 3.183 N/A GLU 150.A N PHE 125.A O no hydrogen 3.235 N/A ARG 152.A N PHE 127.A O no hydrogen 2.869 N/A ARG 152.A NH2 GLU 150.A OE2 no hydrogen 2.926 N/A ALA 153.A N ASN 177.A OD1 no hydrogen 3.104 N/A ILE 155.A N ASN 177.A OD1 no hydrogen 3.325 N/A LEU 162.A N PRO 159.A O no hydrogen 3.020 N/A PHE 163.A N SER 160.A O no hydrogen 3.138 N/A LEU 169.A N LEU 166.A O no hydrogen 3.183 N/A GLU 170.A N SER 147.A O no hydrogen 2.919 N/A SER 171.A N SER 147.A O no hydrogen 3.124 N/A SER 171.A OG SER 147.A O no hydrogen 3.454 N/A SER 171.A OG HIS 148.A ND1 no hydrogen 2.997 N/A ILE 172.A N GLN 195.A O no hydrogen 2.872 N/A GLU 173.A N LEU 149.A O no hydrogen 2.920 N/A PHE 174.A N ASN 197.A O no hydrogen 3.014 N/A GLY 175.A N GLU 173.A OE2 no hydrogen 2.849 N/A SER 176.A N TRP 199.A O no hydrogen 3.231 N/A SER 176.A OG GLY 175.A O no hydrogen 2.392 N/A ASN 177.A ND2 LEU 151.A O no hydrogen 2.999 N/A ASN 177.A ND2 PHE 174.A O no hydrogen 2.791 N/A LYS 178.A N ILE 155.A O no hydrogen 2.537 N/A LEU 179.A N ASN 201.A OD1 no hydrogen 3.128 N/A ARG 184.A NE ASP 210.A OD1 no hydrogen 2.600 N/A LYS 189.A N ILE 186.A O no hydrogen 3.132 N/A MET 190.A N PHE 187.A O no hydrogen 3.368 N/A LYS 194.A N GLU 170.A O no hydrogen 2.276 N/A LYS 194.A NZ GLU 170.A OE1 no hydrogen 2.452 N/A GLN 195.A N GLU 170.A O no hydrogen 3.112 N/A GLN 195.A NE2 ASN 197.A OD1 no hydrogen 2.889 N/A LEU 196.A N GLY 219.A O no hydrogen 2.715 N/A ASN 197.A N ILE 172.A O no hydrogen 2.824 N/A ASN 197.A ND2 GLU 173.A OE1 no hydrogen 3.012 N/A LEU 198.A N ASP 221.A O no hydrogen 2.768 N/A TRP 199.A NE1 GLU 173.A OE1 no hydrogen 2.764 N/A SER 200.A N HIS 223.A O no hydrogen 2.987 N/A SER 200.A OG ASP 224.A OD2 no hydrogen 2.145 N/A ASN 201.A N ASN 225.A OD1 no hydrogen 3.047 N/A ASN 201.A ND2 PHE 174.A O no hydrogen 3.218 N/A ASN 201.A ND2 LEU 198.A O no hydrogen 2.881 N/A GLN 202.A N LEU 179.A O no hydrogen 2.994 N/A LEU 203.A N ASN 225.A OD1 no hydrogen 3.144 N/A HIS 204.A N GLN 202.A O no hydrogen 2.320 N/A HIS 204.A ND1 GLN 202.A O no hydrogen 2.453 N/A LEU 206.A N HIS 204.A O no hydrogen 2.839 N/A ASP 210.A N THR 207.A O no hydrogen 2.438 N/A GLU 212.A N HIS 209.A O no hydrogen 3.319 N/A ALA 214.A N PHE 211.A O no hydrogen 3.008 N/A SER 216.A OG PRO 191.A O no hydrogen 3.449 N/A SER 216.A OG LEU 193.A O no hydrogen 2.257 N/A LEU 218.A N LYS 194.A O no hydrogen 2.868 N/A GLY 219.A N LYS 194.A O no hydrogen 2.929 N/A ILE 220.A N ASP 243.A O no hydrogen 2.898 N/A ASP 221.A N LEU 196.A O no hydrogen 3.160 N/A ILE 222.A N ASN 245.A O no hydrogen 3.112 N/A HIS 223.A N ASP 221.A OD1 no hydrogen 2.824 N/A HIS 223.A ND1 ASP 221.A OD1 no hydrogen 2.657 N/A HIS 223.A ND1 ASP 221.A OD2 no hydrogen 2.872 N/A ASP 224.A N SER 247.A O no hydrogen 2.706 N/A ASN 225.A N ASN 249.A OD1 no hydrogen 2.723 N/A ASN 225.A ND2 LEU 198.A O no hydrogen 2.769 N/A ASN 225.A ND2 ILE 222.A O no hydrogen 3.245 N/A VAL 234.A N PRO 231.A O no hydrogen 3.126 N/A ALA 236.A N ASP 233.A O no hydrogen 2.744 N/A LEU 238.A N PHE 235.A O no hydrogen 2.630 N/A THR 239.A OG1 ASN 240.A OD1 no hydrogen 2.555 N/A VAL 241.A N LEU 238.A O no hydrogen 3.487 N/A THR 242.A N LEU 218.A O no hydrogen 2.579 N/A THR 242.A OG1 LEU 218.A O no hydrogen 3.441 N/A THR 242.A OG1 ASP 243.A OD1 no hydrogen 3.273 N/A THR 242.A OG1 ASP 243.A OD2 no hydrogen 3.382 N/A ASP 243.A N LEU 218.A O no hydrogen 3.145 N/A ILE 244.A N GLU 267.A O no hydrogen 3.258 N/A LEU 246.A N ARG 269.A O no hydrogen 2.912 N/A SER 247.A N ASN 245.A OD1 no hydrogen 3.199 N/A SER 247.A OG ASN 245.A OD1 no hydrogen 2.465 N/A SER 247.A OG ARG 269.A O no hydrogen 3.309 N/A ALA 248.A N MET 271.A O no hydrogen 3.020 N/A ASN 249.A ND2 LEU 246.A O no hydrogen 2.893 N/A LEU 250.A N ILE 227.A O no hydrogen 3.091 N/A ASP 260.A N GLY 257.A O no hydrogen 2.983 N/A ASN 262.A N PHE 259.A O no hydrogen 2.947 N/A ASN 262.A ND2 PHE 235.A O no hydrogen 2.856 N/A ASN 262.A ND2 LEU 238.A O no hydrogen 3.112 N/A LYS 263.A NZ ASN 287.A O no hydrogen 3.422 N/A ASN 266.A N THR 242.A O no hydrogen 2.932 N/A GLU 267.A N THR 242.A O no hydrogen 3.053 N/A ARG 269.A N ILE 244.A O no hydrogen 3.364 N/A ARG 269.A NH1 GLU 267.A OE1 no hydrogen 3.403 N/A LEU 270.A N ARG 295.A O no hydrogen 2.755 N/A MET 271.A N SER 247.A OG no hydrogen 3.078 N/A ASN 273.A N ARG 297.A O no hydrogen 3.186 N/A ARG 274.A N ASN 249.A O no hydrogen 2.886 N/A LEU 277.A N ALA 298.A O no hydrogen 2.892 N/A THR 279.A OG1 LEU 280.A O no hydrogen 3.053 N/A THR 279.A OG1 SER 302.A O no hydrogen 3.559 N/A SER 282.A OG ASP 306.A OD1 no hydrogen 3.084 N/A ARG 283.A N ASP 306.A OD1 no hydrogen 2.600 N/A PHE 285.A N LEU 307.A O no hydrogen 3.024 N/A ALA 286.A N ARG 283.A O no hydrogen 3.008 N/A ASN 287.A N GLU 309.A O no hydrogen 2.753 N/A GLN 288.A N SER 311.A OG no hydrogen 3.236 N/A GLN 288.A NE2 ASN 262.A O no hydrogen 2.597 N/A GLN 292.A N ASN 266.A O no hydrogen 3.300 N/A LEU 294.A N ASN 316.A O no hydrogen 3.022 N/A ARG 295.A N VAL 268.A O no hydrogen 3.286 N/A ARG 295.A NH1 LEU 294.A O no hydrogen 3.159 N/A LEU 296.A N SER 318.A O no hydrogen 2.890 N/A ARG 297.A N LEU 270.A O no hydrogen 3.178 N/A ALA 298.A N ASN 322.A OD1 no hydrogen 3.150 N/A LEU 300.A N ASN 322.A OD1 no hydrogen 3.225 N/A GLN 301.A N ALA 278.A O no hydrogen 2.733 N/A LEU 307.A N PRO 304.A O no hydrogen 3.089 N/A GLU 309.A N ASP 306.A O no hydrogen 3.324 N/A HIS 310.A ND1 ASN 287.A OD1 no hydrogen 3.139 N/A SER 311.A N PHE 308.A O no hydrogen 2.939 N/A SER 311.A OG PHE 285.A O no hydrogen 2.402 N/A THR 312.A OG1 GLN 313.A OE1 no hydrogen 3.431 N/A GLN 313.A N SER 311.A O no hydrogen 2.702 N/A ILE 314.A N SER 311.A O no hydrogen 3.435 N/A THR 315.A N GLN 292.A O no hydrogen 3.310 N/A THR 315.A OG1 ASN 316.A OD1 no hydrogen 2.677 N/A ILE 317.A N SER 340.A O no hydrogen 3.248 N/A SER 318.A N LEU 294.A O no hydrogen 3.042 N/A ASP 321.A N SER 344.A O no hydrogen 2.720 N/A ASN 322.A ND2 LEU 296.A O no hydrogen 3.679 N/A LEU 323.A N LEU 300.A O no hydrogen 2.755 N/A LEU 324.A N ASN 346.A OD1 no hydrogen 3.137 N/A LYS 325.A NZ ARG 347.A O no hydrogen 3.479 N/A THR 326.A OG1 LEU 327.A O no hydrogen 3.174 N/A THR 326.A OG1 HIS 350.A O no hydrogen 3.046 N/A GLU 333.A N THR 330.A O no hydrogen 2.772 N/A HIS 334.A N GLN 335.A OE1 no hydrogen 3.177 N/A GLN 335.A NE2 PHE 308.A O no hydrogen 2.703 N/A GLN 335.A NE2 SER 311.A O no hydrogen 3.392 N/A VAL 336.A N HIS 334.A O no hydrogen 2.751 N/A ASN 337.A ND2 THR 312.A O no hydrogen 2.735 N/A LEU 338.A N GLN 335.A O no hydrogen 3.109 N/A LEU 339.A N THR 315.A O no hydrogen 2.709 N/A LEU 343.A N ARG 366.A O no hydrogen 2.946 N/A SER 344.A N ASP 342.A OD1 no hydrogen 3.233 N/A SER 344.A OG ASP 342.A OD1 no hydrogen 2.316 N/A ASN 345.A N GLU 368.A O no hydrogen 2.943 N/A ASN 346.A N ASP 369.A O no hydrogen 3.181 N/A ASN 346.A ND2 LEU 319.A O no hydrogen 3.617 N/A ASN 346.A ND2 LEU 343.A O no hydrogen 2.877 N/A ARG 347.A N LEU 324.A O no hydrogen 2.911 N/A LEU 348.A N ASN 370.A OD1 no hydrogen 3.287 N/A THR 349.A N LYS 325.A O no hydrogen 2.974 N/A LEU 355.A N PRO 352.A O no hydrogen 2.701 N/A ALA 357.A N SER 354.A O no hydrogen 3.180 N/A THR 360.A N HIS 358.A O no hydrogen 2.416 N/A THR 360.A OG1 HIS 358.A O no hydrogen 2.558 N/A LEU 362.A N THR 359.A O no hydrogen 3.131 N/A THR 363.A N LEU 339.A O no hydrogen 3.054 N/A THR 363.A OG1 ASN 361.A O no hydrogen 3.238 N/A ASP 364.A N LEU 339.A O no hydrogen 3.061 N/A LEU 365.A N THR 388.A O no hydrogen 3.449 N/A ARG 366.A N LEU 341.A O no hydrogen 3.348 N/A LEU 367.A N VAL 390.A O no hydrogen 2.974 N/A GLU 368.A N GLU 368.A OE1 no hydrogen 2.562 N/A ASP 369.A N SER 392.A O no hydrogen 2.935 N/A ASN 370.A ND2 LEU 343.A O no hydrogen 3.235 N/A ASN 370.A ND2 LEU 367.A O no hydrogen 2.451 N/A LEU 371.A N LEU 348.A O no hydrogen 2.790 N/A SER 376.A OG ASP 353.A OD1 no hydrogen 2.579 N/A SER 381.A N ASP 378.A O no hydrogen 3.253 N/A SER 381.A OG ASP 378.A O no hydrogen 2.606 N/A LEU 383.A N PHE 380.A O no hydrogen 3.112 N/A GLY 384.A N ASN 382.A O no hydrogen 2.905 N/A LEU 386.A N LEU 383.A O no hydrogen 3.316 N/A VAL 387.A N THR 363.A O no hydrogen 2.861 N/A LEU 389.A N HIS 412.A O no hydrogen 2.778 N/A VAL 390.A N LEU 365.A O no hydrogen 3.251 N/A MET 391.A N HIS 414.A O no hydrogen 2.865 N/A SER 392.A OG ASP 416.A OD2 no hydrogen 3.074 N/A ARG 393.A N ASP 416.A O no hydrogen 2.982 N/A ARG 393.A NE ASP 369.A OD1 no hydrogen 3.067 N/A ARG 393.A NE ASP 369.A OD2 no hydrogen 2.947 N/A ARG 393.A NH2 ASP 369.A OD2 no hydrogen 3.145 N/A ASN 394.A ND2 LEU 367.A O no hydrogen 3.417 N/A ARG 395.A N LEU 372.A O no hydrogen 3.074 N/A ARG 395.A NH2 ASP 419.A OD1 no hydrogen 3.000 N/A LEU 396.A N ASN 418.A OD1 no hydrogen 3.011 N/A ARG 397.A N THR 373.A O no hydrogen 2.959 N/A ASP 400.A N ILE 375.A O no hydrogen 2.851 N/A ASN 408.A N SER 406.A O no hydrogen 2.800 N/A LEU 410.A N THR 407.A O no hydrogen 3.351 N/A ARG 411.A N VAL 387.A O no hydrogen 2.688 N/A ARG 411.A NE LEU 410.A O no hydrogen 2.567 N/A ARG 411.A NH2 ASN 408.A O no hydrogen 2.571 N/A HIS 412.A N VAL 387.A O no hydrogen 3.348 N/A HIS 412.A ND1 THR 447.A OG1 no hydrogen 2.831 N/A LEU 413.A N THR 447.A O no hydrogen 2.738 N/A HIS 414.A N LEU 389.A O no hydrogen 2.995 N/A HIS 417.A N ARG 451.A O no hydrogen 2.740 N/A ASN 418.A ND2 MET 391.A O no hydrogen 3.582 N/A ASN 418.A ND2 LEU 415.A O no hydrogen 2.626 N/A ASP 419.A N LEU 396.A O no hydrogen 2.965 N/A ILE 420.A N ASN 453.A OD1 no hydrogen 3.120 N/A GLN 423.A N ASP 421.A OD1 no hydrogen 2.507 N/A MET 430.A N LEU 426.A O no hydrogen 3.212 N/A LEU 431.A N LEU 427.A O no hydrogen 3.331 N/A GLN 432.A N ILE 429.A O no hydrogen 2.913 N/A THR 433.A N ASP 428.A O no hydrogen 2.995 N/A THR 433.A OG1 ASP 428.A O no hydrogen 2.869 N/A THR 433.A OG1 ASP 428.A OD1 no hydrogen 3.035 N/A THR 433.A OG1 LEU 431.A O no hydrogen 3.563 N/A SER 437.A N ASP 461.A OD1 no hydrogen 3.045 N/A SER 437.A OG ASP 461.A OD2 no hydrogen 2.095 N/A GLY 440.A N SER 437.A O no hydrogen 2.889 N/A MET 442.A N PHE 439.A O no hydrogen 3.092 N/A HIS 443.A N TYR 441.A O no hydrogen 3.104 N/A LEU 446.A N ARG 411.A O no hydrogen 2.657 N/A THR 447.A N ARG 411.A O no hydrogen 2.673 N/A THR 447.A OG1 HIS 412.A ND1 no hydrogen 2.831 N/A LEU 448.A N GLU 471.A O no hydrogen 2.905 N/A ASN 449.A N LEU 413.A O no hydrogen 2.998 N/A LEU 450.A N ASP 473.A O no hydrogen 2.901 N/A ARG 451.A N ASN 449.A OD1 no hydrogen 3.369 N/A ARG 451.A NE ASP 473.A OD1 no hydrogen 3.288 N/A ARG 451.A NE ASP 473.A OD2 no hydrogen 2.820 N/A ARG 451.A NH2 ASP 473.A OD2 no hydrogen 3.156 N/A ASN 452.A N SER 475.A O no hydrogen 3.102 N/A ASN 452.A ND2 HIS 417.A ND1 no hydrogen 2.791 N/A ASN 453.A N LEU 450.A O no hydrogen 3.290 N/A ASN 453.A ND2 LEU 415.A O no hydrogen 3.125 N/A ASN 453.A ND2 LEU 450.A O no hydrogen 2.845 N/A SER 454.A N ILE 420.A O no hydrogen 2.946 N/A ILE 455.A N ASN 477.A OD1 no hydrogen 2.805 N/A TYR 459.A OH ASP 421.A O no hydrogen 3.371 N/A ASN 460.A ND2 ASN 436.A OD1 no hydrogen 3.090 N/A ASP 461.A N ASP 461.A OD1 no hydrogen 2.391 N/A TRP 462.A N TYR 459.A O no hydrogen 3.385 N/A TRP 462.A NE1 SER 437.A OG no hydrogen 2.563 N/A LYS 463.A N ASN 460.A O no hydrogen 3.223 N/A LYS 463.A NZ GLU 485.A O no hydrogen 2.849 N/A ASN 464.A N ASN 460.A O no hydrogen 3.382 N/A THR 465.A N ASP 461.A O no hydrogen 3.141 N/A THR 465.A OG1 ASP 461.A O no hydrogen 2.373 N/A MET 466.A N ASP 461.A O no hydrogen 3.074 N/A ARG 470.A N LEU 446.A O no hydrogen 2.971 N/A GLU 471.A N LEU 446.A O no hydrogen 2.946 N/A LEU 472.A N HIS 496.A O no hydrogen 3.415 N/A ASP 473.A N LEU 448.A O no hydrogen 3.023 N/A LEU 474.A N ASN 498.A O no hydrogen 2.793 N/A SER 475.A N ASP 473.A OD1 no hydrogen 3.174 N/A SER 475.A OG ASP 473.A OD1 no hydrogen 2.567 N/A TYR 476.A N THR 500.A O no hydrogen 2.856 N/A ASN 477.A N ASN 502.A OD1 no hydrogen 3.045 N/A ASN 477.A ND2 LEU 450.A O no hydrogen 2.994 N/A ASN 477.A ND2 LEU 474.A O no hydrogen 2.792 N/A ASN 478.A N ILE 455.A O no hydrogen 2.916 N/A LEU 482.A N ARG 506.A O no hydrogen 3.430 N/A GLY 483.A N ASP 486.A OD2 no hydrogen 2.815 N/A GLU 485.A N GLU 485.A OE1 no hydrogen 2.646 N/A ASP 486.A N GLY 483.A O no hydrogen 2.722 N/A LEU 490.A N LYS 463.A O no hydrogen 2.810 N/A SER 491.A OG LEU 467.A O no hydrogen 3.054 N/A ASN 493.A ND2 GLN 468.A O no hydrogen 2.559 N/A HIS 496.A N ARG 470.A O no hydrogen 3.007 N/A HIS 496.A ND1 ARG 494.A O no hydrogen 3.325 N/A VAL 497.A N HIS 516.A O no hydrogen 2.705 N/A ASN 498.A N LEU 472.A O no hydrogen 2.806 N/A MET 499.A N ASP 518.A O no hydrogen 2.957 N/A THR 500.A N ASN 498.A OD1 no hydrogen 3.314 N/A THR 500.A OG1 ASN 498.A OD1 no hydrogen 2.198 N/A HIS 501.A N ASN 520.A O no hydrogen 3.307 N/A ASN 502.A ND2 LEU 474.A O no hydrogen 3.360 N/A ASN 502.A ND2 MET 499.A O no hydrogen 3.095 N/A LYS 503.A N ILE 479.A O no hydrogen 3.122 N/A ILE 504.A N ASN 522.A OD1 no hydrogen 3.260 N/A ARG 505.A N SER 480.A O no hydrogen 2.832 N/A ALA 508.A N LEU 482.A O no hydrogen 3.246 N/A HIS 516.A N LEU 495.A O no hydrogen 2.862 N/A VAL 517.A N LYS 550.A O no hydrogen 3.251 N/A ASP 518.A N VAL 497.A O no hydrogen 3.002 N/A LEU 519.A N ARG 552.A O no hydrogen 2.864 N/A ASN 520.A N ASP 518.A OD1 no hydrogen 2.850 N/A ASN 520.A ND2 ASP 554.A OD1 no hydrogen 2.878 N/A ASP 521.A N ARG 555.A O no hydrogen 2.672 N/A ASN 522.A ND2 MET 499.A O no hydrogen 3.590 N/A ASN 522.A ND2 LEU 519.A O no hydrogen 2.969 N/A ASN 522.A ND2 ASN 520.A O no hydrogen 2.952 N/A VAL 525.A N ARG 505.A O no hydrogen 2.744 N/A CYS 526.A N GLN 560.A O no hydrogen 2.697 N/A THR 529.A N ASP 527.A OD1 no hydrogen 3.434 N/A THR 529.A OG1 ASP 527.A OD1 no hydrogen 2.216 N/A ILE 530.A N ASP 527.A O no hydrogen 3.368 N/A ILE 534.A N ILE 530.A O no hydrogen 3.475 N/A ILE 534.A N LEU 531.A O no hydrogen 3.119 N/A GLN 535.A N LEU 531.A O no hydrogen 3.418 N/A LEU 536.A N TRP 532.A O no hydrogen 2.965 N/A VAL 537.A N PHE 533.A O no hydrogen 2.780 N/A ARG 538.A N ILE 534.A O no hydrogen 3.203 N/A HIS 541.A N GLN 535.A O no hydrogen 3.031 N/A GLN 544.A N LYS 542.A O no hydrogen 2.934 N/A TYR 545.A N PRO 543.A O no hydrogen 2.784 N/A TYR 545.A OH PRO 510.A O no hydrogen 3.044 N/A ARG 547.A N GLN 544.A O no hydrogen 3.381 N/A GLN 548.A N TYR 545.A O no hydrogen 2.934 N/A LYS 550.A N VAL 515.A O no hydrogen 2.807 N/A LYS 550.A NZ LEU 551.A O no hydrogen 3.115 N/A ARG 552.A N VAL 517.A O no hydrogen 2.987 N/A LEU 556.A N THR 553.A O no hydrogen 2.930 N/A CYS 558.A N THR 567.A O no hydrogen 3.469 N/A CYS 558.A SG THR 567.A O no hydrogen 3.561 N/A SER 559.A N LEU 524.A O no hydrogen 2.885 N/A GLU 565.A N PRO 561.A O no hydrogen 2.852 N/A GLY 566.A N CYS 558.A O no hydrogen 3.145 N/A THR 567.A N LEU 564.A O no hydrogen 3.253 N/A THR 567.A OG1 LEU 564.A O no hydrogen 2.412 N/A THR 576.A N GLU 573.A O no hydrogen 2.879 N/A THR 576.A OG1 GLU 573.A O no hydrogen 2.662 N/A CYS 579.A N VAL 592.A O no hydrogen 2.760 N/A CYS 584.A N ASP 582.A O no hydrogen 3.406 N/A CYS 584.A SG LEU 581.A O no hydrogen 3.863 N/A CYS 588.A N PRO 585.A O no hydrogen 3.278 N/A CYS 588.A SG ARG 586.A O no hydrogen 3.829 N/A CYS 590.A SG CYS 588.A O no hydrogen 3.229 N/A HIS 591.A N VAL 600.A O no hydrogen 3.382 N/A VAL 592.A N CYS 579.A O no hydrogen 3.245 N/A THR 594.A OG1 CYS 528.A O no hydrogen 2.790 N/A ALA 598.A N ARG 593.A O no hydrogen 3.275 N/A LEU 599.A N LEU 623.A O no hydrogen 2.604 N/A VAL 600.A N HIS 591.A O no hydrogen 3.185 N/A ILE 601.A N GLU 625.A O no hydrogen 3.121 N/A ASN 602.A N ASN 589.A O no hydrogen 3.018 N/A CYS 603.A N HIS 627.A O no hydrogen 3.019 N/A LEU 617.A N ASN 616.A OD1 no hydrogen 3.072 N/A MET 621.A N HIS 618.A O no hydrogen 3.059 N/A GLN 622.A N LYS 597.A O no hydrogen 3.138 N/A LEU 623.A N LYS 597.A O no hydrogen 3.199 N/A MET 624.A N THR 648.A OG1 no hydrogen 2.951 N/A GLU 625.A N LEU 599.A O no hydrogen 2.640 N/A LEU 626.A N SER 649.A O no hydrogen 2.973 N/A HIS 627.A N ILE 601.A O no hydrogen 2.953 N/A HIS 627.A ND1 GLU 629.A OE1 no hydrogen 2.475 N/A HIS 627.A NE2 GLU 625.A OE2 no hydrogen 3.020 N/A LEU 628.A N HIS 651.A O no hydrogen 2.955 N/A GLU 629.A N GLU 629.A OE2 no hydrogen 2.589 N/A ASN 630.A N ALA 653.A O no hydrogen 2.753 N/A ASN 631.A ND2 CYS 603.A O no hydrogen 3.322 N/A LEU 633.A N ASN 655.A OD1 no hydrogen 2.490 N/A LEU 634.A N THR 609.A O no hydrogen 2.866 N/A SER 638.A OG THR 641.A OG1 no hydrogen 3.310 N/A ASN 640.A N SER 638.A OG no hydrogen 3.214 N/A THR 641.A OG1 SER 638.A O no hydrogen 3.302 N/A THR 641.A OG1 SER 638.A OG no hydrogen 3.310 N/A TYR 644.A OH GLN 664.A O no hydrogen 2.716 N/A GLU 645.A N THR 641.A O no hydrogen 2.585 N/A SER 646.A N GLY 643.A O no hydrogen 3.222 N/A VAL 647.A N TYR 644.A O no hydrogen 3.157 N/A THR 648.A N MET 624.A O no hydrogen 3.113 N/A THR 648.A OG1 MET 624.A O no hydrogen 3.394 N/A SER 649.A N MET 624.A O no hydrogen 3.064 N/A SER 649.A OG HIS 651.A NE2 no hydrogen 2.190 N/A HIS 651.A N LEU 626.A O no hydrogen 3.026 N/A LEU 652.A N ASP 673.A O no hydrogen 2.964 N/A GLY 654.A N SER 675.A O no hydrogen 3.294 N/A ASN 655.A N TRP 676.A O no hydrogen 3.086 N/A ASN 655.A ND2 LEU 628.A O no hydrogen 2.668 N/A ASN 655.A ND2 LEU 652.A O no hydrogen 3.034 N/A ASN 655.A ND2 ALA 653.A O no hydrogen 3.622 N/A LEU 657.A N ASN 677.A OD1 no hydrogen 2.780 N/A GLN 664.A N ASP 661.A O no hydrogen 3.023 N/A LEU 669.A N PRO 666.A O no hydrogen 3.324 N/A THR 670.A N THR 648.A O no hydrogen 2.614 N/A THR 670.A OG1 TRP 692.A O no hydrogen 3.563 N/A HIS 671.A N THR 648.A O no hydrogen 3.133 N/A HIS 671.A ND1 SER 694.A O no hydrogen 2.987 N/A LEU 672.A N SER 694.A O no hydrogen 3.185 N/A ASP 673.A N LEU 650.A O no hydrogen 3.018 N/A ILE 674.A N LEU 672.A O no hydrogen 3.218 N/A ILE 674.A N LYS 696.A O no hydrogen 3.308 N/A SER 675.A N ASP 673.A OD1 no hydrogen 3.091 N/A SER 675.A OG ASP 673.A OD1 no hydrogen 2.746 N/A TRP 676.A N SER 698.A O no hydrogen 3.020 N/A ASN 677.A N ASN 700.A OD1 no hydrogen 3.046 N/A ASN 677.A ND2 LEU 652.A O no hydrogen 3.539 N/A ASN 677.A ND2 ILE 674.A O no hydrogen 3.458 N/A ASN 677.A ND2 SER 675.A O no hydrogen 2.841 N/A HIS 678.A N LEU 657.A O no hydrogen 2.803 N/A THR 685.A N ASN 683.A OD1 no hydrogen 3.167 N/A VAL 686.A N ASN 683.A O no hydrogen 3.283 N/A PHE 689.A N THR 685.A O no hydrogen 3.305 N/A LEU 690.A N VAL 686.A O no hydrogen 3.074 N/A ASN 691.A N GLY 688.A O no hydrogen 3.193 N/A ARG 693.A NE PHE 689.A O no hydrogen 2.938 N/A ARG 693.A NH1 LEU 669.A O no hydrogen 2.719 N/A SER 694.A N THR 670.A O no hydrogen 3.153 N/A VAL 695.A N ARG 721.A O no hydrogen 2.649 N/A LYS 696.A N LEU 672.A O no hydrogen 3.231 N/A LYS 696.A NZ ASP 673.A OD2 no hydrogen 3.092 N/A LEU 697.A N ASP 724.A OD1 no hydrogen 3.215 N/A LEU 697.A N ASP 724.A OD2 no hydrogen 3.056 N/A SER 698.A N ASP 724.A OD2 no hydrogen 2.826 N/A SER 698.A OG ASP 724.A OD2 no hydrogen 2.895 N/A ASN 700.A ND2 ILE 674.A O no hydrogen 3.518 N/A TRP 702.A N ASN 700.A O no hydrogen 2.753 N/A TRP 702.A NE1 LEU 697.A O no hydrogen 3.048 N/A MET 703.A N GLN 680.A O no hydrogen 3.114 N/A CYS 704.A SG TRP 702.A O no hydrogen 3.310 N/A CYS 706.A SG ILE 745.A O no hydrogen 3.371 N/A THR 707.A N ASP 705.A OD1 no hydrogen 2.518 N/A LEU 712.A N ALA 708.A O no hydrogen 2.932 N/A LEU 713.A N LYS 709.A O no hydrogen 3.082 N/A LEU 713.A N PRO 710.A O no hydrogen 3.002 N/A PHE 714.A N PRO 710.A O no hydrogen 2.888 N/A THR 715.A N LEU 711.A O no hydrogen 3.063 N/A THR 715.A OG1 LEU 712.A O no hydrogen 3.135 N/A GLN 716.A N LEU 712.A O no hydrogen 3.418 N/A ASP 717.A N PHE 714.A O no hydrogen 3.067 N/A ASN 718.A N PHE 714.A O no hydrogen 2.707 N/A ASN 718.A ND2 PHE 714.A O no hydrogen 3.595 N/A GLU 720.A N GLU 720.A OE1 no hydrogen 2.367 N/A ARG 721.A NE LEU 690.A O no hydrogen 2.599 N/A GLY 723.A N VAL 695.A O no hydrogen 3.428 N/A ARG 725.A NH1 THR 715.A O no hydrogen 3.235 N/A GLU 727.A N ASP 724.A O no hydrogen 2.953 N/A MET 728.A N ARG 725.A O no hydrogen 2.904 N/A CYS 730.A N THR 735.A O no hydrogen 2.994 N/A VAL 731.A N TRP 702.A O no hydrogen 3.155 N/A ARG 736.A NE GLU 739.A OE2 no hydrogen 2.845 N/A ARG 736.A NH2 GLU 739.A OE2 no hydrogen 2.724 N/A MET 737.A N MET 728.A O no hydrogen 2.722 N/A GLU 739.A N ARG 736.A O no hydrogen 3.102 N/A LEU 740.A N MET 737.A O no hydrogen 3.097 N/A SER 741.A N ASP 744.A OD2 no hydrogen 2.896 N/A