Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8iak_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 2.A OG1 PHE 142.A O no hydrogen 3.535 N/A CYS 7.A SG PRO 5.A O no hydrogen 3.830 N/A GLN 17.A N PRO 13.A O no hydrogen 3.238 N/A GLN 17.A NE2 LEU 12.A O no hydrogen 3.625 N/A LYS 18.A N ASP 14.A O no hydrogen 2.901 N/A GLU 19.A N ASP 15.A O no hydrogen 2.939 N/A ASN 20.A N ILE 16.A O no hydrogen 2.857 N/A GLU 21.A N GLN 17.A O no hydrogen 2.963 N/A TYR 22.A N LYS 18.A O no hydrogen 3.018 N/A THR 24.A N GLU 19.A OE2 no hydrogen 3.291 N/A THR 24.A OG1 GLU 19.A OE2 no hydrogen 3.339 N/A GLY 29.A N SER 27.A OG no hydrogen 3.150 N/A GLN 33.A NE2 PRO 335.A O no hydrogen 3.198 N/A ARG 37.A N ILE 343.A O no hydrogen 3.303 N/A ARG 37.A NH1 LYS 40.A O no hydrogen 2.287 N/A LYS 40.A N ARG 37.A O no hydrogen 3.154 N/A GLU 44.A N GLU 44.A OE2 no hydrogen 2.697 N/A THR 49.A N ASP 48.A OD1 no hydrogen 2.738 N/A ILE 54.A N PRO 51.A O no hydrogen 3.327 N/A LEU 56.A N TYR 52.A O no hydrogen 3.043 N/A LEU 57.A N TYR 53.A O no hydrogen 2.880 N/A THR 58.A N ILE 54.A O no hydrogen 2.972 N/A THR 58.A OG1 ILE 54.A O no hydrogen 3.096 N/A THR 58.A OG1 TYR 455.A O no hydrogen 2.219 N/A TYR 59.A N SER 55.A O no hydrogen 2.981 N/A LEU 60.A N LEU 56.A O no hydrogen 2.959 N/A ASN 61.A N LEU 57.A O no hydrogen 2.948 N/A TYR 62.A N THR 58.A O no hydrogen 3.004 N/A LEU 63.A N TYR 59.A O no hydrogen 2.926 N/A ILE 64.A N LEU 60.A O no hydrogen 2.982 N/A LEU 65.A N ASN 61.A O no hydrogen 3.021 N/A ILE 66.A N TYR 62.A O no hydrogen 3.283 N/A ILE 67.A N LEU 63.A O no hydrogen 3.424 N/A LEU 68.A N ILE 64.A O no hydrogen 3.054 N/A GLY 69.A N LEU 65.A O no hydrogen 2.920 N/A HIS 70.A N ILE 66.A O no hydrogen 2.965 N/A VAL 71.A N ILE 67.A O no hydrogen 2.991 N/A HIS 72.A N LEU 68.A O no hydrogen 2.951 N/A HIS 72.A ND1 LEU 68.A O no hydrogen 2.879 N/A ASP 73.A N GLY 69.A O no hydrogen 2.935 N/A PHE 74.A N HIS 70.A O no hydrogen 2.955 N/A LEU 75.A N VAL 71.A O no hydrogen 2.979 N/A GLY 76.A N HIS 72.A O no hydrogen 2.912 N/A MET 77.A N ASP 73.A O no hydrogen 2.990 N/A THR 78.A N PHE 74.A O no hydrogen 2.948 N/A THR 78.A OG1 PHE 74.A O no hydrogen 2.915 N/A PHE 79.A N LEU 75.A O no hydrogen 2.928 N/A LYS 81.A NZ MET 77.A O no hydrogen 3.406 N/A HIS 84.A N LYS 81.A O no hydrogen 3.410 N/A LEU 87.A N HIS 84.A O no hydrogen 3.320 N/A LEU 88.A N LEU 85.A O no hydrogen 3.353 N/A HIS 90.A N LEU 93.A O no hydrogen 3.293 N/A LEU 93.A N HIS 90.A O no hydrogen 3.149 N/A SER 102.A OG SER 98.A O no hydrogen 3.477 N/A PHE 103.A N PHE 100.A O no hydrogen 3.288 N/A ARG 106.A N SER 102.A O no hydrogen 3.374 N/A ARG 106.A NH1 ASN 99.A O no hydrogen 2.982 N/A ARG 106.A NH2 ASN 99.A O no hydrogen 3.388 N/A ARG 107.A N PHE 103.A O no hydrogen 2.897 N/A ARG 107.A NE ASP 73.A OD1 no hydrogen 3.475 N/A ARG 107.A NH2 ASP 73.A OD1 no hydrogen 3.381 N/A ILE 108.A N TYR 104.A O no hydrogen 3.214 N/A LYS 109.A N TYR 104.A O no hydrogen 3.082 N/A MET 110.A N ARG 106.A O no hydrogen 2.972 N/A ASP 113.A N MET 110.A O no hydrogen 3.451 N/A CYS 115.A N ILE 112.A O no hydrogen 3.058 N/A CYS 115.A SG ASP 114.A OD1 no hydrogen 3.455 N/A PHE 116.A N ASP 113.A O no hydrogen 3.035 N/A SER 117.A OG PHE 116.A O no hydrogen 2.580 N/A ARG 118.A NE ASP 114.A O no hydrogen 3.372 N/A ARG 118.A NH2 SER 464.A OG no hydrogen 2.992 N/A THR 121.A N ARG 129.A O no hydrogen 3.217 N/A ARG 126.A NE ASP 501.A OD2 no hydrogen 2.684 N/A ARG 126.A NH1 GLU 19.A O no hydrogen 3.215 N/A ARG 126.A NH2 ASP 501.A OD1 no hydrogen 2.986 N/A ARG 126.A NH2 ASP 501.A OD2 no hydrogen 2.675 N/A PHE 127.A N ASN 20.A O no hydrogen 3.392 N/A ILE 128.A N CYS 151.A O no hydrogen 2.892 N/A ARG 129.A NH2 GLU 8.A O no hydrogen 3.473 N/A CYS 130.A N TYR 149.A O no hydrogen 3.127 N/A ILE 131.A N PRO 119.A O no hydrogen 3.326 N/A ILE 134.A N THR 143.A O no hydrogen 3.116 N/A HIS 136.A N TYR 141.A O no hydrogen 3.111 N/A ASN 139.A ND2 MET 110.A O no hydrogen 3.157 N/A GLU 140.A N ASN 137.A O no hydrogen 3.119 N/A THR 143.A N ILE 134.A O no hydrogen 3.116 N/A THR 143.A OG1 TYR 1.A O no hydrogen 3.160 N/A TYR 144.A N TYR 1.A O no hydrogen 3.509 N/A GLY 146.A N SER 145.A OG no hydrogen 2.502 N/A TYR 149.A N CYS 130.A O no hydrogen 3.264 N/A CYS 151.A N ILE 128.A O no hydrogen 2.730 N/A CYS 151.A SG TYR 149.A O no hydrogen 3.863 N/A MET 152.A N ARG 471.A O no hydrogen 3.257 N/A ASN 153.A N ARG 126.A O no hydrogen 3.146 N/A ASN 153.A ND2 GLY 125.A O no hydrogen 2.839 N/A ASN 153.A ND2 SER 156.A OG no hydrogen 2.878 N/A SER 155.A N ASN 153.A OD1 no hydrogen 3.381 N/A SER 155.A OG ASN 153.A OD1 no hydrogen 3.230 N/A TYR 159.A OH HIS 328.A ND1 no hydrogen 2.937 N/A GLY 161.A N ASN 158.A O no hydrogen 3.002 N/A ALA 163.A N ASN 158.A OD1 no hydrogen 3.365 N/A SER 165.A N GLU 21.A OE2 no hydrogen 3.399 N/A SER 165.A OG GLU 21.A OE1 no hydrogen 2.898 N/A SER 165.A OG GLU 21.A OE2 no hydrogen 3.421 N/A LYS 166.A NZ ASP 14.A OD2 no hydrogen 2.937 N/A LYS 166.A NZ GLN 17.A OE1 no hydrogen 2.287 N/A GLN 168.A N GLN 168.A OE1 no hydrogen 2.593 N/A GLN 168.A NE2 THR 406.A OG1 no hydrogen 3.115 N/A CYS 169.A SG SER 403.A OG no hydrogen 3.764 N/A THR 170.A OG1 GLN 164.A O no hydrogen 3.514 N/A ALA 172.A N GLN 168.A O no hydrogen 2.932 N/A ALA 173.A N CYS 169.A O no hydrogen 2.917 N/A LEU 174.A N THR 170.A O no hydrogen 2.913 N/A GLU 175.A N ASP 171.A O no hydrogen 2.931 N/A SER 176.A N ALA 172.A O no hydrogen 2.902 N/A SER 176.A OG ALA 172.A O no hydrogen 3.482 N/A SER 176.A OG ALA 173.A O no hydrogen 2.497 N/A VAL 177.A N ALA 173.A O no hydrogen 2.921 N/A ASP 178.A N LEU 174.A O no hydrogen 2.975 N/A LYS 179.A N GLU 175.A O no hydrogen 2.880 N/A TYR 180.A N SER 176.A O no hydrogen 2.893 N/A TYR 180.A OH ASP 195.A OD1 no hydrogen 2.554 N/A TYR 180.A OH ASP 195.A OD2 no hydrogen 3.291 N/A GLN 183.A N SER 181.A OG no hydrogen 2.879 N/A ARG 188.A NE THR 193.A OG1 no hydrogen 3.302 N/A ARG 188.A NH1 GLU 201.A OE1 no hydrogen 2.901 N/A ALA 189.A N VAL 386.A O no hydrogen 3.220 N/A GLN 190.A N PRO 187.A O no hydrogen 3.056 N/A ILE 191.A N PRO 187.A O no hydrogen 3.365 N/A GLY 192.A N PRO 187.A O no hydrogen 2.900 N/A THR 193.A OG1 ARG 188.A O no hydrogen 2.786 N/A THR 194.A OG1 HIS 197.A ND1 no hydrogen 2.750 N/A HIS 197.A ND1 THR 194.A OG1 no hydrogen 2.750 N/A LYS 199.A N ASP 195.A O no hydrogen 2.961 N/A ALA 200.A N LEU 196.A O no hydrogen 2.918 N/A GLU 201.A N HIS 197.A O no hydrogen 2.935 N/A LYS 202.A N ILE 198.A O no hydrogen 2.986 N/A LEU 203.A N LYS 199.A O no hydrogen 2.925 N/A VAL 204.A N ALA 200.A O no hydrogen 2.914 N/A ALA 205.A N GLU 201.A O no hydrogen 2.972 N/A ARG 206.A N LYS 202.A O no hydrogen 2.945 N/A PHE 207.A N LEU 203.A O no hydrogen 2.893 N/A ILE 208.A N VAL 204.A O no hydrogen 2.953 N/A GLY 209.A N ALA 205.A O no hydrogen 3.280 N/A LYS 210.A N ALA 205.A O no hydrogen 3.299 N/A LYS 210.A NZ VAL 351.A O no hydrogen 2.646 N/A ASP 212.A N ALA 371.A O no hydrogen 3.493 N/A ALA 213.A N ASP 212.A OD1 no hydrogen 3.033 N/A LEU 214.A N ILE 369.A O no hydrogen 3.103 N/A PHE 216.A N GLY 367.A O no hydrogen 2.874 N/A SER 217.A OG GLU 390.A O no hydrogen 3.532 N/A THR 222.A N MET 218.A O no hydrogen 3.047 N/A THR 222.A OG1 MET 218.A O no hydrogen 2.806 N/A ASN 223.A N GLY 219.A O no hydrogen 3.030 N/A ASN 223.A ND2 SER 246.A OG no hydrogen 3.089 N/A ALA 224.A N TYR 220.A O no hydrogen 2.893 N/A ASN 225.A N GLY 221.A O no hydrogen 2.936 N/A ALA 229.A N LEU 226.A O no hydrogen 3.097 N/A LEU 236.A N LYS 290.A O no hydrogen 3.104 N/A VAL 237.A N ALA 257.A O no hydrogen 3.020 N/A ILE 238.A N LEU 292.A O no hydrogen 2.826 N/A SER 239.A N ARG 259.A O no hydrogen 3.153 N/A LEU 242.A N ASP 240.A OD2 no hydrogen 3.314 N/A HIS 244.A ND1 SER 246.A OG no hydrogen 2.853 N/A SER 246.A N HIS 244.A ND1 no hydrogen 3.327 N/A SER 246.A OG HIS 244.A ND1 no hydrogen 2.853 N/A THR 249.A N THR 245.A O no hydrogen 2.928 N/A THR 249.A OG1 THR 245.A O no hydrogen 3.404 N/A GLY 250.A N SER 246.A O no hydrogen 2.912 N/A VAL 251.A N ILE 247.A O no hydrogen 2.916 N/A ARG 252.A N ARG 248.A O no hydrogen 2.917 N/A LEU 253.A N THR 249.A O no hydrogen 2.957 N/A SER 254.A N VAL 251.A O no hydrogen 3.276 N/A SER 254.A OG VAL 251.A O no hydrogen 2.812 N/A GLY 255.A N VAL 251.A O no hydrogen 3.481 N/A ALA 257.A N CYS 235.A O no hydrogen 3.376 N/A ARG 259.A N VAL 237.A O no hydrogen 3.144 N/A ARG 259.A NH1 VAL 258.A O no hydrogen 2.909 N/A GLU 270.A N MET 266.A O no hydrogen 2.929 N/A LYS 271.A N VAL 267.A O no hydrogen 2.948 N/A LEU 272.A N GLY 268.A O no hydrogen 2.895 N/A ILE 273.A N LEU 269.A O no hydrogen 2.911 N/A ARG 274.A N GLU 270.A O no hydrogen 2.993 N/A ARG 274.A NH1 TYR 318.A OH no hydrogen 3.347 N/A GLU 275.A N LYS 271.A O no hydrogen 2.947 N/A GLN 276.A N LEU 272.A O no hydrogen 2.904 N/A ILE 277.A N ILE 273.A O no hydrogen 2.938 N/A VAL 278.A N ARG 274.A O no hydrogen 2.983 N/A LEU 279.A N GLU 275.A O no hydrogen 2.905 N/A GLY 280.A N GLN 276.A O no hydrogen 3.375 N/A GLN 281.A N ARG 286.A O no hydrogen 2.851 N/A GLN 281.A NE2 PRO 287.A O no hydrogen 3.103 N/A THR 284.A N GLN 281.A O no hydrogen 3.325 N/A ASN 285.A N GLN 281.A O no hydrogen 2.577 N/A LYS 289.A N LYS 234.A O no hydrogen 3.316 N/A LYS 290.A NZ PHE 230.A O no hydrogen 3.420 N/A LEU 292.A N LEU 236.A O no hydrogen 3.031 N/A ILE 293.A N TYR 321.A O no hydrogen 2.927 N/A CYS 294.A N ILE 238.A O no hydrogen 2.896 N/A ALA 295.A N PHE 323.A O no hydrogen 3.041 N/A GLY 297.A N ASP 325.A O no hydrogen 3.134 N/A PHE 299.A N THR 304.A O no hydrogen 3.327 N/A SER 300.A OG HIS 328.A NE2 no hydrogen 3.124 N/A GLU 302.A N PHE 299.A O no hydrogen 3.325 N/A GLY 303.A N PHE 299.A O no hydrogen 3.022 N/A LEU 311.A N ASN 307.A O no hydrogen 3.146 N/A VAL 312.A N LEU 308.A O no hydrogen 2.915 N/A GLU 313.A N PRO 309.A O no hydrogen 2.921 N/A LEU 314.A N LYS 310.A O no hydrogen 2.949 N/A LYS 315.A N LEU 311.A O no hydrogen 2.873 N/A LYS 315.A NZ ASP 350.A O no hydrogen 2.955 N/A LYS 315.A NZ ASP 352.A OD1 no hydrogen 3.059 N/A LYS 316.A N VAL 312.A O no hydrogen 2.897 N/A LYS 316.A NZ ASP 350.A OD1 no hydrogen 2.455 N/A LYS 317.A N GLU 313.A O no hydrogen 2.936 N/A TYR 318.A N LEU 314.A O no hydrogen 2.927 N/A TYR 318.A OH GLU 270.A OE2 no hydrogen 2.957 N/A CYS 320.A N LYS 315.A O no hydrogen 3.383 N/A CYS 320.A SG TYR 318.A O no hydrogen 3.891 N/A LEU 322.A N ASP 352.A OD2 no hydrogen 3.206 N/A PHE 323.A N ILE 293.A O no hydrogen 2.883 N/A ILE 324.A N ILE 353.A O no hydrogen 3.163 N/A GLU 326.A N MET 355.A O no hydrogen 2.808 N/A HIS 328.A ND1 TYR 159.A OH no hydrogen 2.937 N/A GLY 331.A N GLY 337.A O no hydrogen 3.239 N/A ALA 332.A N SER 329.A O no hydrogen 3.478 N/A THR 336.A N GLU 342.A OE2 no hydrogen 2.616 N/A THR 336.A OG1 GLU 342.A OE1 no hydrogen 2.795 N/A THR 336.A OG1 GLU 342.A OE2 no hydrogen 2.470 N/A ARG 338.A NH1 THR 336.A O no hydrogen 3.568 N/A GLY 339.A N MET 333.A O no hydrogen 3.279 N/A VAL 340.A N GLU 326.A OE2 no hydrogen 3.002 N/A PHE 344.A N VAL 340.A O no hydrogen 2.923 N/A GLY 345.A N GLU 342.A O no hydrogen 3.261 N/A LYS 349.A N ASP 347.A O no hydrogen 2.612 N/A ASP 350.A N ASP 347.A O no hydrogen 3.416 N/A ILE 353.A N LEU 322.A O no hydrogen 3.345 N/A LEU 354.A N ALA 370.A O no hydrogen 3.127 N/A MET 355.A N ILE 324.A O no hydrogen 3.285 N/A GLY 356.A N TYR 368.A O no hydrogen 3.387 N/A THR 357.A OG1 THR 359.A OG1 no hydrogen 3.200 N/A PHE 358.A N GLY 366.A O no hydrogen 3.255 N/A THR 359.A OG1 THR 357.A OG1 no hydrogen 3.200 N/A SER 361.A OG ILE 330.A O no hydrogen 3.078 N/A ALA 364.A N PHE 358.A O no hydrogen 3.317 N/A GLY 367.A N PHE 216.A O no hydrogen 2.977 N/A TYR 368.A N GLY 356.A O no hydrogen 3.176 N/A ILE 369.A N LEU 214.A O no hydrogen 3.047 N/A ALA 370.A N LEU 354.A O no hydrogen 2.855 N/A ALA 371.A N ASP 212.A O no hydrogen 3.462 N/A GLN 373.A NE2 ASP 212.A OD2 no hydrogen 2.861 N/A GLN 373.A NE2 ASP 377.A OD2 no hydrogen 3.212 N/A ILE 376.A N ASP 372.A O no hydrogen 2.963 N/A ASP 377.A N GLN 373.A O no hydrogen 2.928 N/A ARG 378.A N TRP 374.A O no hydrogen 2.965 N/A LEU 379.A N ILE 375.A O no hydrogen 2.901 N/A ARG 380.A N ILE 376.A O no hydrogen 2.861 N/A ARG 380.A NH1 ASP 377.A OD1 no hydrogen 2.992 N/A LEU 381.A N ASP 377.A O no hydrogen 3.004 N/A ASP 382.A N ARG 378.A O no hydrogen 2.962 N/A ASP 382.A N LEU 379.A O no hydrogen 2.813 N/A LEU 383.A N LEU 379.A O no hydrogen 2.596 N/A THR 385.A OG1 SER 389.A OG no hydrogen 2.377 N/A SER 387.A N THR 384.A O no hydrogen 3.044 N/A TYR 388.A N THR 384.A O no hydrogen 2.945 N/A SER 389.A N THR 385.A O no hydrogen 3.421 N/A SER 389.A OG THR 385.A O no hydrogen 2.622 N/A SER 389.A OG THR 385.A OG1 no hydrogen 2.377 N/A SER 391.A OG GLY 186.A O no hydrogen 3.350 N/A ALA 398.A N ALA 394.A O no hydrogen 2.916 N/A GLN 399.A N PRO 395.A O no hydrogen 2.948 N/A THR 400.A N VAL 396.A O no hydrogen 2.952 N/A THR 400.A OG1 VAL 396.A O no hydrogen 3.181 N/A ILE 401.A N LEU 397.A O no hydrogen 2.900 N/A SER 402.A N ALA 398.A O no hydrogen 2.952 N/A SER 402.A OG ALA 398.A O no hydrogen 3.028 N/A SER 403.A N GLN 399.A O no hydrogen 2.959 N/A SER 403.A OG PHE 362.A O no hydrogen 3.378 N/A SER 403.A OG GLN 399.A O no hydrogen 3.070 N/A LEU 404.A N THR 400.A O no hydrogen 2.912 N/A GLN 405.A N ILE 401.A O no hydrogen 2.938 N/A THR 406.A N SER 402.A O no hydrogen 2.919 N/A THR 406.A OG1 SER 402.A O no hydrogen 3.044 N/A ILE 407.A N SER 403.A O no hydrogen 2.957 N/A SER 408.A N LEU 404.A O no hydrogen 2.896 N/A GLY 409.A N GLN 405.A O no hydrogen 3.015 N/A GLY 409.A N THR 406.A O no hydrogen 3.251 N/A GLU 410.A N GLN 405.A O no hydrogen 3.028 N/A CYS 412.A SG ILE 411.A O no hydrogen 3.022 N/A CYS 412.A SG GLN 415.A OE1 no hydrogen 3.967 N/A GLN 415.A N CYS 412.A O no hydrogen 3.204 N/A THR 417.A OG1 GLY 414.A O no hydrogen 3.287 N/A ARG 419.A N GLN 415.A O no hydrogen 2.914 N/A ARG 419.A NH1 LEU 160.A O no hydrogen 2.755 N/A ARG 419.A NH1 GLY 161.A O no hydrogen 2.904 N/A ARG 419.A NH2 GLN 164.A OE1 no hydrogen 3.414 N/A ARG 419.A NH2 GLN 415.A OE1 no hydrogen 3.537 N/A LEU 420.A N GLY 416.A O no hydrogen 2.994 N/A GLN 421.A N THR 417.A O no hydrogen 2.921 N/A GLN 421.A NE2 GLN 33.A OE1 no hydrogen 2.616 N/A ARG 422.A N GLU 418.A O no hydrogen 2.888 N/A ARG 422.A NH1 GLY 23.A O no hydrogen 3.207 N/A ARG 422.A NH2 GLY 23.A O no hydrogen 2.600 N/A ILE 423.A N ARG 419.A O no hydrogen 3.036 N/A ALA 424.A N LEU 420.A O no hydrogen 2.996 N/A PHE 425.A N GLN 421.A O no hydrogen 2.920 N/A ASN 426.A N ARG 422.A O no hydrogen 2.939 N/A ASN 426.A ND2 SER 494.A O no hydrogen 3.286 N/A ASN 426.A ND2 LEU 497.A O no hydrogen 2.941 N/A SER 427.A N ILE 423.A O no hydrogen 3.043 N/A SER 427.A OG ILE 423.A O no hydrogen 2.869 N/A ARG 428.A N ALA 424.A O no hydrogen 3.516 N/A ARG 428.A NE CYS 547.A O no hydrogen 3.106 N/A ARG 428.A NH2 ASP 550.A OD1 no hydrogen 2.320 N/A TYR 429.A N PHE 425.A O no hydrogen 2.944 N/A TYR 429.A OH ASP 503.A OD1 no hydrogen 2.536 N/A LEU 430.A N ASN 426.A O no hydrogen 2.988 N/A ARG 431.A N SER 427.A O no hydrogen 2.967 N/A ARG 431.A NH1 TYR 442.A O no hydrogen 2.600 N/A ARG 431.A NH2 SER 447.A OG no hydrogen 2.767 N/A LEU 432.A N ARG 428.A O no hydrogen 2.949 N/A ALA 433.A N TYR 429.A O no hydrogen 2.968 N/A LEU 434.A N LEU 430.A O no hydrogen 2.933 N/A GLN 435.A N ARG 431.A O no hydrogen 2.959 N/A ARG 436.A N LEU 432.A O no hydrogen 2.919 N/A LEU 437.A N ALA 433.A O no hydrogen 2.940 N/A GLY 438.A N LEU 434.A O no hydrogen 3.296 N/A PHE 439.A N LEU 434.A O no hydrogen 3.201 N/A TYR 442.A OH GLU 486.A OE1 no hydrogen 2.987 N/A SER 447.A OG VAL 449.A O no hydrogen 2.969 N/A ILE 450.A N PHE 491.A O no hydrogen 3.078 N/A LEU 452.A N VAL 489.A O no hydrogen 2.814 N/A LEU 454.A N SER 487.A O no hydrogen 2.826 N/A TYR 455.A N SER 487.A O no hydrogen 3.464 N/A LYS 459.A N CYS 456.A O no hydrogen 3.079 N/A LYS 459.A NZ ASN 517.A O no hydrogen 3.322 N/A PHE 463.A N LYS 459.A O no hydrogen 3.246 N/A SER 464.A N MET 460.A O no hydrogen 2.988 N/A ARG 465.A N PRO 461.A O no hydrogen 2.905 N/A ARG 465.A NE ASP 114.A OD2 no hydrogen 3.411 N/A ARG 465.A NH2 ASP 114.A OD1 no hydrogen 3.318 N/A ARG 465.A NH2 ASP 114.A OD2 no hydrogen 3.362 N/A MET 466.A N ALA 462.A O no hydrogen 2.953 N/A MET 467.A N PHE 463.A O no hydrogen 2.988 N/A LEU 468.A N SER 464.A O no hydrogen 2.935 N/A GLN 469.A N ARG 465.A O no hydrogen 2.939 N/A ARG 470.A N MET 466.A O no hydrogen 2.988 N/A ARG 470.A N MET 467.A O no hydrogen 3.250 N/A ARG 470.A NH1 HIS 508.A ND1 no hydrogen 3.318 N/A ARG 470.A NH1 GLU 511.A OE2 no hydrogen 3.237 N/A ARG 470.A NH2 GLU 511.A OE2 no hydrogen 3.547 N/A ARG 471.A N LEU 468.A O no hydrogen 3.168 N/A ARG 471.A NH1 LEU 468.A O no hydrogen 3.110 N/A ILE 472.A N MET 467.A O no hydrogen 2.779 N/A ALA 473.A N MET 152.A O no hydrogen 3.052 N/A VAL 477.A N ARG 488.A O no hydrogen 3.083 N/A THR 482.A N ALA 478.A O no hydrogen 3.121 N/A THR 482.A OG1 ALA 478.A O no hydrogen 2.676 N/A THR 482.A OG1 GLU 486.A O no hydrogen 3.003 N/A GLU 486.A N PRO 483.A O no hydrogen 2.731 N/A ARG 488.A NH1 MET 301.A O no hydrogen 2.652 N/A ARG 488.A NH1 GLU 302.A OE1 no hydrogen 3.505 N/A VAL 489.A N LEU 452.A O no hydrogen 2.960 N/A ARG 490.A N VAL 475.A O no hydrogen 3.111 N/A ARG 490.A NH1 TYR 157.A OH no hydrogen 3.124 N/A ARG 490.A NH2 TYR 157.A OH no hydrogen 3.276 N/A ARG 490.A NH2 SER 300.A O no hydrogen 3.336 N/A PHE 491.A N ILE 450.A O no hydrogen 3.333 N/A CYS 492.A N LEU 154.A O no hydrogen 3.454 N/A MET 493.A N PRO 448.A O no hydrogen 3.006 N/A SER 494.A OG ASN 158.A O no hydrogen 2.666 N/A SER 494.A OG SER 496.A OG no hydrogen 3.151 N/A ALA 495.A N TYR 159.A O no hydrogen 3.012 N/A SER 496.A N SER 494.A OG no hydrogen 3.203 N/A SER 496.A OG SER 494.A OG no hydrogen 3.151 N/A LYS 499.A NZ ASP 503.A OD2 no hydrogen 3.166 N/A ILE 502.A N THR 498.A O no hydrogen 3.204 N/A ASP 503.A N LYS 499.A O no hydrogen 2.915 N/A TYR 504.A N GLU 500.A O no hydrogen 2.953 N/A TYR 504.A OH ARG 470.A O no hydrogen 3.011 N/A LEU 505.A N ASP 501.A O no hydrogen 2.936 N/A LEU 506.A N ILE 502.A O no hydrogen 2.844 N/A ARG 507.A N ASP 503.A O no hydrogen 2.971 N/A HIS 508.A N TYR 504.A O no hydrogen 3.234 N/A VAL 509.A N LEU 505.A O no hydrogen 2.859 N/A SER 510.A N LEU 506.A O no hydrogen 2.883 N/A GLU 511.A N ARG 507.A O no hydrogen 3.044 N/A VAL 512.A N HIS 508.A O no hydrogen 2.962 N/A GLY 513.A N VAL 509.A O no hydrogen 2.875 N/A ASP 514.A N SER 510.A O no hydrogen 2.928 N/A LYS 515.A N GLU 511.A O no hydrogen 3.152 N/A LEU 516.A N VAL 512.A O no hydrogen 2.908 N/A LEU 518.A N GLY 513.A O no hydrogen 2.927 N/A LYS 519.A NZ SER 510.A OG no hydrogen 3.318 N/A ASN 521.A N GLY 438.A O no hydrogen 3.131 N/A ASN 521.A ND2 GLN 435.A O no hydrogen 3.368 N/A SER 522.A N ASP 48.A OD2 no hydrogen 3.453 N/A LYS 524.A N SER 522.A OG no hydrogen 3.350 N/A SER 525.A OG ASP 48.A OD2 no hydrogen 3.568 N/A SER 525.A OG ASN 521.A OD1 no hydrogen 2.618 N/A SER 526.A OG GLY 523.A O no hydrogen 3.198 N/A SER 526.A OG ASP 528.A OD1 no hydrogen 3.448 N/A SER 526.A OG LYS 530.A O no hydrogen 3.292 N/A GLY 529.A N SER 526.A OG no hydrogen 3.352 N/A ARG 533.A NH1 ASN 521.A O no hydrogen 3.314 N/A ARG 533.A NH1 GLN 532.A O no hydrogen 2.531 N/A ARG 533.A NH2 ASN 521.A O no hydrogen 2.418 N/A VAL 539.A N ASP 535.A O no hydrogen 3.123 N/A ILE 540.A N ILE 536.A O no hydrogen 2.945 N/A ARG 541.A N GLU 537.A O no hydrogen 2.928 N/A ARG 542.A N GLU 538.A O no hydrogen 2.986 N/A THR 543.A N VAL 539.A O no hydrogen 2.931 N/A THR 543.A OG1 VAL 539.A O no hydrogen 2.255 N/A CYS 547.A N THR 543.A O no hydrogen 2.914 N/A CYS 547.A SG PRO 544.A O no hydrogen 3.193 N/A LYS 548.A N GLU 545.A O no hydrogen 3.451 N/A LYS 548.A NZ GLY 29.A O no hydrogen 2.797 N/A LYS 548.A NZ PRO 544.A O no hydrogen 3.338 N/A ASP 549.A N ASP 546.A O no hydrogen 3.414 N/A LYS 551.A N ASP 549.A O no hydrogen 2.692 N/A LYS 551.A NZ ASP 549.A OD2 no hydrogen 3.511 N/A TYR 552.A OH ASP 546.A OD2 no hydrogen 2.490 N/A ASN 555.A ND2 GLY 443.A O no hydrogen 3.301 N/A