Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7aoi_BA.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 3.A NE ARG 1.A O no hydrogen 3.118 N/A ARG 3.A NH1 ARG 1.A O no hydrogen 2.758 N/A GLN 10.A N PRO 6.A O no hydrogen 2.925 N/A GLN 10.A N GLU 7.A O no hydrogen 3.245 N/A GLN 10.A NE2 ILE 5.A O no hydrogen 3.220 N/A PHE 18.A N GLU 15.A O no hydrogen 3.317 N/A THR 19.A OG1 PRO 24.A O no hydrogen 2.831 N/A ASP 27.A N LEU 30.A O no hydrogen 3.191 N/A SER 29.A N ASP 27.A OD2 no hydrogen 2.999 N/A SER 29.A OG ASP 27.A OD2 no hydrogen 2.578 N/A GLU 44.A N ILE 40.A O no hydrogen 3.523 N/A ALA 45.A N PRO 41.A O no hydrogen 2.917 N/A ALA 46.A N ASP 42.A O no hydrogen 2.880 N/A LYS 47.A N ILE 43.A O no hydrogen 2.912 N/A GLU 48.A N GLU 44.A O no hydrogen 2.890 N/A ARG 49.A N ALA 45.A O no hydrogen 2.903 N/A ARG 49.A NE GLU 15.A O no hydrogen 2.569 N/A ARG 49.A NH1 GLU 15.A O no hydrogen 3.399 N/A ARG 50.A N ALA 46.A O no hydrogen 2.891 N/A ARG 50.A NH1 TYR 32.A OH no hydrogen 3.253 N/A ARG 51.A N LYS 47.A O no hydrogen 2.909 N/A GLY 52.A N GLU 48.A O no hydrogen 2.898 N/A SER 53.A N ARG 49.A O no hydrogen 2.908 N/A SER 53.A OG ARG 49.A O no hydrogen 3.190 N/A SER 53.A OG ARG 50.A O no hydrogen 2.581 N/A ARG 54.A N ARG 50.A O no hydrogen 2.893 N/A LEU 55.A N ARG 51.A O no hydrogen 2.903 N/A ALA 56.A N GLY 52.A O no hydrogen 2.907 N/A ALA 57.A N SER 53.A O no hydrogen 2.902 N/A CYS 65.A SG SER 66.A O no hydrogen 3.771 N/A SER 66.A N GLU 69.A OE2 no hydrogen 2.691 N/A GLU 69.A N SER 66.A O no hydrogen 3.022 N/A GLU 70.A N HIS 67.A O no hydrogen 3.143 N/A ARG 72.A NE GLU 70.A OE1 no hydrogen 2.737 N/A ARG 72.A NH1 GLU 70.A OE1 no hydrogen 2.428 N/A TYR 74.A OH ASP 114.A OD1 no hydrogen 3.368 N/A TYR 74.A OH ASP 114.A OD2 no hydrogen 3.018 N/A VAL 75.A N HIS 87.A O no hydrogen 2.892 N/A SER 77.A N ARG 85.A O no hydrogen 2.893 N/A LEU 82.A N ASP 79.A O no hydrogen 3.244 N/A ILE 83.A N ASP 79.A O no hydrogen 2.448 N/A HIS 87.A N VAL 75.A O no hydrogen 2.891 N/A CYS 88.A SG GLY 73.A O no hydrogen 3.729 N/A THR 89.A N GLY 73.A O no hydrogen 2.910 N/A THR 89.A OG1 GLY 73.A O no hydrogen 3.425 N/A GLU 94.A N SER 91.A OG no hydrogen 3.191 N/A LEU 95.A N SER 91.A O no hydrogen 2.923 N/A VAL 96.A N ILE 92.A O no hydrogen 2.889 N/A ALA 97.A N GLU 93.A O no hydrogen 2.889 N/A GLN 98.A N GLU 94.A O no hydrogen 2.908 N/A PHE 99.A N LEU 95.A O no hydrogen 2.896 N/A GLU 100.A N VAL 96.A O no hydrogen 2.915 N/A ASP 101.A N ALA 97.A O no hydrogen 2.874 N/A ARG 102.A N GLN 98.A O no hydrogen 2.911 N/A SER 107.A OG ARG 102.A O no hydrogen 2.260 N/A SER 107.A OG GLN 104.A O no hydrogen 2.693 N/A ARG 108.A N GLN 104.A O no hydrogen 2.924 N/A VAL 109.A N ILE 105.A O no hydrogen 2.886 N/A ALA 110.A N GLU 106.A O no hydrogen 2.899 N/A ALA 111.A N SER 107.A O no hydrogen 2.924 N/A LEU 112.A N ARG 108.A O no hydrogen 2.881 N/A ALA 113.A N VAL 109.A O no hydrogen 2.884 N/A ASP 114.A N ALA 110.A O no hydrogen 2.936 N/A MET 115.A N ALA 111.A O no hydrogen 2.901 N/A ALA 116.A N LEU 112.A O no hydrogen 2.864 N/A SER 117.A N ALA 113.A O no hydrogen 2.925 N/A THR 118.A N ASP 114.A O no hydrogen 2.924 N/A THR 118.A OG1 ASP 114.A O no hydrogen 2.833 N/A THR 118.A OG1 MET 115.A O no hydrogen 3.228 N/A SER 120.A OG GLU 183.A OE1 no hydrogen 3.104 N/A PHE 121.A N THR 118.A O no hydrogen 3.029 N/A ARG 122.A N VAL 119.A O no hydrogen 3.081 N/A ARG 122.A NH2 ARG 90.A O no hydrogen 2.787 N/A SER 123.A N GLU 126.A OE1 no hydrogen 3.178 N/A LEU 127.A N SER 123.A O no hydrogen 2.893 N/A LEU 128.A N ASP 124.A O no hydrogen 2.909 N/A ARG 129.A N GLU 125.A O no hydrogen 2.926 N/A MET 130.A N GLU 126.A O no hydrogen 2.875 N/A PHE 131.A N LEU 127.A O no hydrogen 2.912 N/A THR 132.A N LEU 128.A O no hydrogen 2.919 N/A THR 132.A OG1 LEU 128.A O no hydrogen 2.811 N/A ALA 133.A N ARG 129.A O no hydrogen 2.906 N/A ILE 134.A N MET 130.A O no hydrogen 2.903 N/A SER 135.A N PHE 131.A O no hydrogen 2.920 N/A SER 135.A OG PHE 131.A O no hydrogen 2.873 N/A GLY 142.A N SER 139.A OG no hydrogen 3.222 N/A ARG 143.A NH2 ASP 218.A OD1 no hydrogen 2.400 N/A ARG 143.A NH2 ASN 602.A OD1 no hydrogen 3.266 N/A ASN 146.A ND2 LYS 212.A O no hydrogen 2.777 N/A ASN 146.A ND2 TRP 213.A O no hydrogen 3.126 N/A ASN 146.A ND2 THR 215.A O no hydrogen 2.435 N/A VAL 152.A N TYR 159.A O no hydrogen 2.923 N/A TYR 159.A N VAL 152.A O no hydrogen 2.891 N/A VAL 161.A N VAL 150.A O no hydrogen 2.922 N/A ASN 163.A N PHE 147.A O no hydrogen 2.809 N/A LEU 165.A N ASN 163.A OD1 no hydrogen 3.081 N/A ALA 168.A N SER 164.A O no hydrogen 3.378 N/A TYR 169.A N LEU 165.A O no hydrogen 3.076 N/A VAL 170.A N LEU 166.A O no hydrogen 2.938 N/A ASN 171.A N PRO 167.A O no hydrogen 2.871 N/A LEU 172.A N ALA 168.A O no hydrogen 2.909 N/A VAL 173.A N TYR 169.A O no hydrogen 2.900 N/A ASP 174.A N VAL 170.A O no hydrogen 2.917 N/A ALA 175.A N ASN 171.A O no hydrogen 2.876 N/A THR 176.A N LEU 172.A O no hydrogen 2.898 N/A THR 176.A OG1 LEU 172.A O no hydrogen 2.823 N/A THR 177.A N VAL 173.A O no hydrogen 2.893 N/A THR 177.A OG1 VAL 173.A O no hydrogen 3.006 N/A ILE 178.A N ASP 174.A O no hydrogen 2.921 N/A ALA 179.A N ALA 175.A O no hydrogen 2.895 N/A LEU 180.A N THR 176.A O no hydrogen 2.893 N/A ARG 182.A N ILE 178.A O no hydrogen 3.226 N/A ARG 182.A NE GLU 245.A OE1 no hydrogen 3.100 N/A ARG 182.A NE GLU 245.A OE2 no hydrogen 2.994 N/A ARG 182.A NH2 GLU 245.A OE1 no hydrogen 2.492 N/A GLN 184.A N ALA 179.A O no hydrogen 2.880 N/A ARG 187.A N GLN 184.A O no hydrogen 3.207 N/A ARG 187.A NH1 ARG 122.A O no hydrogen 3.367 N/A ARG 187.A NH2 ARG 122.A O no hydrogen 3.073 N/A ARG 187.A NH2 GLN 184.A OE1 no hydrogen 3.070 N/A ALA 190.A N TRP 186.A O no hydrogen 2.898 N/A SER 191.A N ARG 187.A O no hydrogen 2.899 N/A LEU 194.A N SER 191.A OG no hydrogen 3.389 N/A PHE 195.A N SER 191.A O no hydrogen 3.399 N/A ILE 196.A N PRO 192.A O no hydrogen 2.930 N/A GLN 197.A N ALA 193.A O no hydrogen 2.903 N/A VAL 198.A N LEU 194.A O no hydrogen 2.919 N/A LEU 199.A N PHE 195.A O no hydrogen 3.237 N/A GLN 200.A N ILE 196.A O no hydrogen 2.883 N/A PHE 201.A N GLN 197.A O no hydrogen 2.915 N/A MET 202.A N VAL 198.A O no hydrogen 2.919 N/A ALA 203.A N LEU 199.A O no hydrogen 2.883 N/A LEU 204.A N GLN 200.A O no hydrogen 2.871 N/A ILE 205.A N PHE 201.A O no hydrogen 2.953 N/A LYS 206.A NZ VAL 140.A O no hydrogen 3.276 N/A LYS 206.A NZ GLY 142.A O no hydrogen 3.142 N/A LYS 206.A NZ LEU 204.A O no hydrogen 3.451 N/A GLU 209.A N LYS 206.A O no hydrogen 3.304 N/A LYS 212.A N GLU 209.A O no hydrogen 3.075 N/A TRP 213.A N PRO 210.A O no hydrogen 2.913 N/A PHE 214.A N ASN 211.A O no hydrogen 3.130 N/A THR 215.A N ASN 211.A O no hydrogen 2.909 N/A THR 215.A OG1 ASN 211.A O no hydrogen 2.806 N/A ASP 218.A N ASN 602.A OD1 no hydrogen 2.851 N/A ALA 220.A N SER 217.A O no hydrogen 3.167 N/A SER 222.A N THR 215.A OG1 no hydrogen 2.913 N/A ASN 223.A ND2 ASN 211.A OD1 no hydrogen 3.685 N/A ARG 224.A N SER 222.A OG no hydrogen 3.370 N/A ARG 224.A NE ASN 234.A OD1 no hydrogen 3.274 N/A ASP 226.A N ASN 223.A O no hydrogen 3.280 N/A HIS 229.A N VAL 233.A O no hydrogen 3.491 N/A ILE 231.A N HIS 229.A ND1 no hydrogen 3.296 N/A GLY 232.A N HIS 229.A O no hydrogen 3.340 N/A ASN 234.A ND2 TYR 227.A O no hydrogen 3.562 N/A HIS 235.A NE2 HIS 229.A O no hydrogen 2.730 N/A THR 237.A OG1 ARG 224.A O no hydrogen 3.258 N/A PHE 239.A N ALA 225.A O no hydrogen 3.184 N/A TYR 247.A N GLY 243.A O no hydrogen 2.894 N/A ASP 248.A N GLU 244.A O no hydrogen 2.906 N/A PHE 249.A N GLU 245.A O no hydrogen 2.901 N/A MET 250.A N LEU 246.A O no hydrogen 2.916 N/A VAL 251.A N TYR 247.A O no hydrogen 2.899 N/A GLU 252.A N ASP 248.A O no hydrogen 2.904 N/A LEU 253.A N PHE 249.A O no hydrogen 2.896 N/A LEU 254.A N MET 250.A O no hydrogen 2.962 N/A ARG 255.A N VAL 251.A O no hydrogen 2.874 N/A ARG 255.A NH2 GLU 252.A OE1 no hydrogen 2.579 N/A VAL 256.A N GLU 252.A O no hydrogen 2.916 N/A ASP 261.A N PRO 257.A O no hydrogen 2.915 N/A LEU 262.A N THR 258.A O no hydrogen 2.906 N/A CYS 263.A N MET 259.A O no hydrogen 2.892 N/A CYS 263.A SG MET 259.A O no hydrogen 3.243 N/A CYS 263.A SG GLN 267.A OE1 no hydrogen 3.989 N/A THR 264.A N GLN 267.A OE1 no hydrogen 3.047 N/A ARG 265.A NH2 ASP 312.A OD1 no hydrogen 2.944 N/A MET 268.A N THR 264.A O no hydrogen 2.640 N/A VAL 269.A N ARG 265.A O no hydrogen 2.919 N/A ASP 270.A N GLU 266.A O no hydrogen 2.926 N/A LEU 271.A N GLN 267.A O no hydrogen 2.852 N/A LEU 272.A N MET 268.A O no hydrogen 2.933 N/A SER 273.A N VAL 269.A O no hydrogen 2.937 N/A SER 273.A OG VAL 269.A O no hydrogen 3.046 N/A SER 273.A OG ASP 270.A O no hydrogen 2.547 N/A GLY 274.A N ASP 270.A O no hydrogen 2.851 N/A PHE 275.A N LEU 271.A O no hydrogen 2.939 N/A CYS 276.A N LEU 272.A O no hydrogen 2.964 N/A CYS 276.A SG LEU 272.A O no hydrogen 3.550 N/A GLY 277.A N SER 273.A O no hydrogen 2.899 N/A VAL 278.A N GLY 274.A O no hydrogen 2.853 N/A MET 279.A N PHE 275.A O no hydrogen 2.992 N/A CYS 281.A SG LYS 283.A O no hydrogen 3.521 N/A GLY 282.A N MET 279.A O no hydrogen 2.813 N/A LYS 283.A NZ ASP 327.A OD2 no hydrogen 2.667 N/A PHE 289.A N VAL 285.A O no hydrogen 2.897 N/A LYS 290.A N GLY 286.A O no hydrogen 2.898 N/A LYS 290.A NZ ASP 294.A OD2 no hydrogen 3.440 N/A THR 291.A N ASP 287.A O no hydrogen 2.917 N/A THR 291.A OG1 ASP 287.A O no hydrogen 2.797 N/A ILE 292.A N VAL 288.A O no hydrogen 2.943 N/A THR 293.A N PHE 289.A O no hydrogen 2.892 N/A THR 293.A OG1 PHE 289.A O no hydrogen 2.867 N/A ASP 294.A N LYS 290.A O no hydrogen 2.897 N/A ALA 295.A N THR 291.A O no hydrogen 2.959 N/A PHE 296.A N ILE 292.A O no hydrogen 2.893 N/A LEU 297.A N THR 293.A O no hydrogen 2.885 N/A ARG 298.A N ASP 294.A O no hydrogen 2.933 N/A ARG 299.A N ALA 295.A O no hydrogen 2.945 N/A VAL 300.A N PHE 296.A O no hydrogen 2.877 N/A ARG 301.A N LEU 297.A O no hydrogen 2.913 N/A ARG 301.A NH1 GLU 332.A OE2 no hydrogen 2.993 N/A ASN 302.A N ARG 298.A O no hydrogen 2.918 N/A ASP 303.A N ARG 299.A O no hydrogen 2.893 N/A ILE 304.A N VAL 300.A O no hydrogen 2.887 N/A SER 305.A OG ASN 302.A O no hydrogen 3.289 N/A GLY 306.A N ASP 303.A O no hydrogen 3.135 N/A SER 309.A N ASP 312.A OD2 no hydrogen 2.946 N/A HIS 311.A N SER 309.A OG no hydrogen 3.410 N/A HIS 311.A NE2 GLU 266.A OE2 no hydrogen 2.487 N/A TRP 313.A N SER 309.A O no hydrogen 2.935 N/A ALA 314.A N ALA 310.A O no hydrogen 2.875 N/A ILE 315.A N HIS 311.A O no hydrogen 2.896 N/A VAL 316.A N ASP 312.A O no hydrogen 2.933 N/A GLU 317.A N TRP 313.A O no hydrogen 2.900 N/A ARG 318.A N ALA 314.A O no hydrogen 2.866 N/A MET 319.A N ILE 315.A O no hydrogen 2.910 N/A TYR 320.A N VAL 316.A O no hydrogen 2.928 N/A LEU 321.A N GLU 317.A O no hydrogen 2.900 N/A VAL 322.A N ARG 318.A O no hydrogen 2.852 N/A THR 323.A N MET 319.A O no hydrogen 2.907 N/A THR 323.A OG1 MET 319.A O no hydrogen 3.311 N/A THR 323.A OG1 TYR 320.A O no hydrogen 2.350 N/A VAL 324.A N TYR 320.A O no hydrogen 2.958 N/A LEU 325.A N LEU 321.A O no hydrogen 2.880 N/A CYS 326.A N VAL 322.A O no hydrogen 2.858 N/A CYS 326.A SG VAL 322.A O no hydrogen 2.826 N/A ASP 327.A N VAL 324.A O no hydrogen 2.879 N/A ALA 328.A N THR 323.A O no hydrogen 2.904 N/A ILE 333.A N ASN 330.A OD1 no hydrogen 3.099 N/A LEU 334.A N ASN 330.A O no hydrogen 2.914 N/A GLN 335.A N ASN 331.A O no hydrogen 2.885 N/A GLN 335.A NE2 ASN 331.A OD1 no hydrogen 3.381 N/A LEU 336.A N GLU 332.A O no hydrogen 2.890 N/A LEU 337.A N ILE 333.A O no hydrogen 2.920 N/A LEU 338.A N LEU 334.A O no hydrogen 2.911 N/A SER 339.A N GLN 335.A O no hydrogen 2.875 N/A SER 339.A OG GLN 335.A O no hydrogen 2.887 N/A ASP 340.A N LEU 336.A O no hydrogen 2.925 N/A THR 341.A OG1 SER 339.A O no hydrogen 3.206 N/A ALA 342.A N ASP 340.A OD1 no hydrogen 3.445 N/A SER 343.A OG PRO 344.A O no hydrogen 3.450 N/A ARG 345.A NE LEU 337.A O no hydrogen 3.041 N/A ARG 345.A NH1 SER 343.A O no hydrogen 2.357 N/A ARG 345.A NH2 LEU 337.A O no hydrogen 3.319 N/A ARG 345.A NH2 ASP 340.A OD2 no hydrogen 2.362 N/A GLY 346.A N GLU 317.A OE1 no hydrogen 2.920 N/A GLY 346.A N GLU 317.A OE2 no hydrogen 3.116 N/A PHE 349.A N GLY 346.A O no hydrogen 3.258 N/A ALA 351.A N PRO 347.A O no hydrogen 2.927 N/A ALA 352.A N ASP 348.A O no hydrogen 2.892 N/A VAL 353.A N PHE 349.A O no hydrogen 2.914 N/A SER 354.A N PHE 350.A O no hydrogen 2.912 N/A SER 354.A OG ALA 351.A O no hydrogen 2.507 N/A THR 361.A OG1 ASP 358.A OD2 no hydrogen 2.740 N/A LYS 362.A N ASP 358.A O no hydrogen 2.879 N/A LYS 362.A NZ THR 356.A O no hydrogen 3.077 N/A LYS 363.A N THR 359.A O no hydrogen 2.931 N/A ARG 364.A N PRO 360.A O no hydrogen 2.919 N/A ARG 364.A NE LEU 338.A O no hydrogen 3.529 N/A ARG 364.A NH2 LEU 338.A O no hydrogen 3.319 N/A ALA 365.A N THR 361.A O no hydrogen 2.877 N/A LEU 366.A N LYS 362.A O no hydrogen 2.849 N/A CYS 367.A N LYS 363.A O no hydrogen 2.968 N/A CYS 367.A SG LYS 363.A O no hydrogen 3.427 N/A LEU 368.A N ARG 364.A O no hydrogen 2.915 N/A LEU 369.A N ALA 365.A O no hydrogen 2.826 N/A GLN 370.A N LEU 366.A O no hydrogen 2.912 N/A GLN 370.A NE2 GLN 370.A O no hydrogen 3.146 N/A GLN 370.A NE2 ASP 374.A OD1 no hydrogen 2.797 N/A GLN 370.A NE2 ASP 374.A OD2 no hydrogen 3.328 N/A GLN 370.A NE2 ASN 412.A OD1 no hydrogen 3.286 N/A GLU 371.A N CYS 367.A O no hydrogen 2.970 N/A ALA 372.A N LEU 368.A O no hydrogen 2.858 N/A ILE 373.A N LEU 369.A O no hydrogen 2.876 N/A ASP 374.A N GLN 370.A O no hydrogen 2.944 N/A ASN 375.A N GLU 371.A O no hydrogen 2.917 N/A ALA 376.A N ALA 372.A O no hydrogen 2.871 N/A SER 377.A N ILE 373.A O no hydrogen 2.902 N/A SER 377.A OG ILE 373.A O no hydrogen 3.191 N/A SER 377.A OG ASP 374.A O no hydrogen 2.602 N/A ALA 378.A N ASP 374.A O no hydrogen 2.916 N/A LYS 379.A N ASN 375.A O no hydrogen 2.910 N/A ALA 380.A N SER 377.A O no hydrogen 3.291 N/A THR 384.A N ASP 381.A OD2 no hydrogen 2.901 N/A THR 384.A OG1 ASP 381.A OD2 no hydrogen 2.353 N/A LEU 385.A N ASP 381.A O no hydrogen 2.907 N/A LEU 386.A N LYS 382.A O no hydrogen 2.897 N/A GLY 387.A N VAL 383.A O no hydrogen 2.948 N/A LEU 388.A N THR 384.A O no hydrogen 2.899 N/A LEU 389.A N LEU 385.A O no hydrogen 2.861 N/A GLU 390.A N LEU 386.A O no hydrogen 2.947 N/A SER 391.A N GLY 387.A O no hydrogen 2.962 N/A SER 391.A OG GLY 387.A O no hydrogen 3.320 N/A SER 391.A OG LEU 388.A O no hydrogen 2.992 N/A GLY 392.A N LEU 388.A O no hydrogen 2.801 N/A SER 393.A N LEU 389.A O no hydrogen 2.859 N/A SER 393.A OG LEU 389.A O no hydrogen 2.843 N/A GLU 394.A N GLU 390.A O no hydrogen 3.046 N/A PHE 395.A N SER 391.A O no hydrogen 2.900 N/A LEU 396.A N GLY 392.A O no hydrogen 2.755 N/A LEU 397.A N SER 393.A O no hydrogen 2.948 N/A SER 398.A N GLU 394.A O no hydrogen 2.948 N/A SER 398.A OG SER 354.A O no hydrogen 2.259 N/A LEU 399.A N PHE 395.A O no hydrogen 2.882 N/A LYS 402.A NZ ILE 564.A O no hydrogen 3.562 N/A LYS 402.A NZ LEU 565.A O no hydrogen 2.565 N/A LYS 402.A NZ HIS 567.A O no hydrogen 2.585 N/A VAL 404.A N ASP 401.A OD1 no hydrogen 3.391 N/A ALA 405.A N ASP 401.A O no hydrogen 2.964 N/A HIS 406.A N LYS 402.A O no hydrogen 2.862 N/A THR 407.A N GLY 403.A O no hydrogen 2.939 N/A THR 407.A OG1 GLY 403.A O no hydrogen 2.993 N/A PHE 408.A N VAL 404.A O no hydrogen 2.884 N/A ALA 409.A N ALA 405.A O no hydrogen 2.930 N/A THR 410.A N HIS 406.A O no hydrogen 2.895 N/A THR 410.A OG1 HIS 406.A O no hydrogen 2.950 N/A THR 410.A OG1 THR 407.A O no hydrogen 2.615 N/A GLN 411.A N THR 407.A O no hydrogen 2.938 N/A ASN 412.A N PHE 408.A O no hydrogen 2.920 N/A ASN 412.A ND2 GLN 370.A OE1 no hydrogen 3.384 N/A ASN 412.A ND2 PHE 408.A O no hydrogen 2.580 N/A LEU 413.A N ALA 409.A O no hydrogen 2.916 N/A PHE 414.A N ALA 409.A O no hydrogen 3.404 N/A ARG 417.A N LEU 413.A O no hydrogen 3.367 N/A ILE 418.A N PHE 414.A O no hydrogen 2.914 N/A LEU 419.A N ASP 415.A O no hydrogen 2.918 N/A ASN 420.A N TYR 416.A O no hydrogen 2.910 N/A ASN 420.A ND2 TYR 416.A O no hydrogen 2.491 N/A SER 421.A N ARG 417.A O no hydrogen 2.893 N/A SER 421.A OG ILE 418.A O no hydrogen 2.497 N/A PHE 422.A N ILE 418.A O no hydrogen 2.963 N/A ALA 429.A N CYS 425.A O no hydrogen 2.878 N/A ASP 430.A N SER 426.A O no hydrogen 2.942 N/A ARG 431.A N LEU 427.A O no hydrogen 2.911 N/A LEU 432.A N VAL 428.A O no hydrogen 2.851 N/A ARG 433.A N ALA 429.A O no hydrogen 2.920 N/A VAL 434.A N ASP 430.A O no hydrogen 2.922 N/A GLU 435.A N ARG 431.A O no hydrogen 2.906 N/A ILE 439.A N GLU 435.A O no hydrogen 3.251 N/A THR 440.A N GLN 436.A O no hydrogen 2.832 N/A THR 440.A OG1 GLN 436.A O no hydrogen 2.988 N/A SER 441.A N SER 437.A O no hydrogen 2.910 N/A SER 441.A OG SER 437.A O no hydrogen 3.256 N/A SER 441.A OG VAL 438.A O no hydrogen 2.627 N/A LEU 442.A N VAL 438.A O no hydrogen 2.915 N/A ILE 443.A N ILE 439.A O no hydrogen 2.916 N/A ARG 448.A N SER 446.A OG no hydrogen 3.390 N/A ARG 448.A NE ASP 449.A OD1 no hydrogen 3.245 N/A GLN 453.A N ASP 449.A O no hydrogen 2.940 N/A GLN 453.A NE2 SER 446.A O no hydrogen 3.234 N/A MET 454.A N VAL 450.A O no hydrogen 2.872 N/A LEU 455.A N GLN 451.A O no hydrogen 2.916 N/A MET 456.A N VAL 452.A O no hydrogen 2.929 N/A SER 457.A N GLN 453.A O no hydrogen 2.907 N/A SER 457.A OG GLN 453.A O no hydrogen 2.999 N/A ASN 458.A N MET 454.A O no hydrogen 2.894 N/A GLU 459.A N LEU 455.A O no hydrogen 2.916 N/A ARG 460.A N MET 456.A O no hydrogen 2.918 N/A ASN 461.A N SER 457.A O no hydrogen 2.918 N/A ALA 462.A N ASN 458.A O no hydrogen 2.879 N/A LEU 463.A N GLU 459.A O no hydrogen 2.933 N/A LEU 468.A N GLU 435.A OE1 no hydrogen 2.320 N/A THR 470.A OG1 LEU 557.A O no hydrogen 2.584 N/A THR 470.A OG1 GLU 562.A OE1 no hydrogen 2.384 N/A THR 470.A OG1 GLU 562.A OE2 no hydrogen 2.739 N/A MET 471.A N LEU 557.A O no hydrogen 3.148 N/A LEU 472.A N GLU 562.A OE1 no hydrogen 3.459 N/A SER 473.A OG THR 470.A O no hydrogen 3.259 N/A GLN 474.A N THR 470.A O no hydrogen 2.891 N/A GLN 474.A N MET 471.A O no hydrogen 3.226 N/A LEU 478.A N GLN 474.A O no hydrogen 2.896 N/A ASN 479.A N LEU 475.A O no hydrogen 2.740 N/A ASN 479.A ND2 GLN 451.A OE1 no hydrogen 2.877 N/A SER 480.A N GLU 476.A O no hydrogen 2.923 N/A SER 480.A OG GLU 476.A O no hydrogen 3.196 N/A ILE 481.A N TYR 477.A O no hydrogen 2.901 N/A ASP 482.A N LYS 510.A O no hydrogen 3.110 N/A SER 483.A N LYS 510.A O no hydrogen 3.243 N/A SER 483.A OG HIS 596.A ND1 no hydrogen 3.034 N/A VAL 484.A N LYS 594.A O no hydrogen 2.901 N/A PHE 485.A N SER 512.A O no hydrogen 2.890 N/A ILE 486.A N HIS 596.A O no hydrogen 2.889 N/A LEU 487.A N ILE 514.A O no hydrogen 2.957 N/A HIS 488.A ND1 SER 490.A OG no hydrogen 2.972 N/A HIS 488.A NE2 ASP 576.A OD1 no hydrogen 2.530 N/A SER 489.A N GLU 575.A OE2 no hydrogen 2.428 N/A SER 489.A OG GLU 575.A OE1 no hydrogen 2.260 N/A SER 489.A OG GLU 575.A OE2 no hydrogen 2.955 N/A SER 490.A N HIS 488.A ND1 no hydrogen 3.213 N/A SER 490.A OG HIS 488.A ND1 no hydrogen 2.972 N/A LEU 491.A N HIS 488.A O no hydrogen 3.260 N/A MET 492.A N SER 489.A O no hydrogen 3.281 N/A ALA 493.A N SER 490.A O no hydrogen 3.041 N/A SER 495.A OG ASP 497.A OD2 no hydrogen 3.103 N/A THR 496.A OG1 ALA 538.A O no hydrogen 3.243 N/A VAL 500.A N THR 496.A O no hydrogen 2.896 N/A SER 501.A N ASP 497.A O no hydrogen 2.899 N/A ALA 502.A N GLN 498.A O no hydrogen 2.908 N/A VAL 503.A N LEU 499.A O no hydrogen 2.934 N/A ARG 504.A N VAL 500.A O no hydrogen 2.876 N/A ARG 505.A N SER 501.A O no hydrogen 2.904 N/A ARG 505.A NH1 ASP 511.A OD2 no hydrogen 3.393 N/A LEU 506.A N ALA 502.A O no hydrogen 2.937 N/A LEU 506.A N VAL 503.A O no hydrogen 3.259 N/A SER 508.A N ARG 505.A O no hydrogen 3.134 N/A SER 508.A OG ARG 505.A O no hydrogen 2.720 N/A GLY 509.A N LEU 506.A O no hydrogen 3.261 N/A SER 512.A N SER 483.A O no hydrogen 2.892 N/A ILE 514.A N PHE 485.A O no hydrogen 2.884 N/A VAL 515.A N VAL 556.A O no hydrogen 2.908 N/A THR 516.A OG1 SER 518.A OG no hydrogen 3.041 N/A MET 517.A N LEU 558.A O no hydrogen 3.158 N/A SER 518.A N GLU 563.A OE2 no hydrogen 3.007 N/A SER 518.A OG THR 516.A OG1 no hydrogen 3.041 N/A SER 518.A OG GLU 563.A OE2 no hydrogen 3.446 N/A CYS 519.A N THR 516.A OG1 no hydrogen 2.912 N/A CYS 519.A SG LEU 487.A O no hydrogen 4.017 N/A CYS 519.A SG GLU 575.A OE2 no hydrogen 3.435 N/A LEU 520.A N THR 516.A O no hydrogen 2.915 N/A ARG 521.A N MET 517.A O no hydrogen 2.896 N/A ALA 522.A N SER 518.A O no hydrogen 2.887 N/A LEU 523.A N CYS 519.A O no hydrogen 2.901 N/A SER 524.A N LEU 520.A O no hydrogen 2.914 N/A VAL 525.A N ARG 521.A O no hydrogen 2.919 N/A LYS 526.A N ALA 522.A O no hydrogen 2.929 N/A SER 527.A N LEU 523.A O no hydrogen 2.882 N/A SER 527.A OG LEU 523.A O no hydrogen 3.235 N/A SER 527.A OG SER 524.A O no hydrogen 2.655 N/A LEU 528.A N SER 524.A O no hydrogen 2.955 N/A THR 529.A OG1 VAL 525.A O no hydrogen 2.586 N/A SER 530.A N LYS 526.A O no hydrogen 2.864 N/A SER 530.A OG GLU 535.A OE1 no hydrogen 2.405 N/A GLU 535.A N SER 532.A OG no hydrogen 3.412 N/A ARG 536.A N SER 532.A O no hydrogen 2.907 N/A ARG 536.A NH1 SER 530.A O no hydrogen 2.535 N/A ILE 537.A N MET 533.A O no hydrogen 2.941 N/A ALA 538.A N LYS 534.A O no hydrogen 2.899 N/A CYS 539.A N GLU 535.A O no hydrogen 2.872 N/A CYS 539.A SG MET 492.A O no hydrogen 3.818 N/A CYS 539.A SG GLU 535.A O no hydrogen 3.181 N/A ALA 540.A N ARG 536.A O no hydrogen 2.952 N/A ARG 541.A N ILE 537.A O no hydrogen 2.917 N/A ALA 542.A N ALA 538.A O no hydrogen 2.863 N/A LEU 543.A N CYS 539.A O no hydrogen 2.891 N/A GLU 544.A N ALA 540.A O no hydrogen 2.965 N/A ILE 545.A N ARG 541.A O no hydrogen 2.894 N/A VAL 546.A N ALA 542.A O no hydrogen 2.888 N/A SER 547.A N LEU 543.A O no hydrogen 2.889 N/A SER 547.A OG HIS 424.A O no hydrogen 2.268 N/A TYR 548.A N GLU 544.A O no hydrogen 2.947 N/A GLU 549.A N ILE 545.A O no hydrogen 2.914 N/A LEU 550.A N VAL 546.A O no hydrogen 2.896 N/A GLU 551.A N SER 547.A O no hydrogen 2.889 N/A LYS 552.A N TYR 548.A O no hydrogen 2.934 N/A GLY 553.A N GLU 549.A O no hydrogen 2.888 N/A GLY 553.A N LEU 550.A O no hydrogen 3.095 N/A ARG 554.A NE GLU 549.A OE1 no hydrogen 3.115 N/A VAL 556.A N LEU 513.A O no hydrogen 2.769 N/A LEU 557.A N MET 469.A O no hydrogen 3.286 N/A PHE 560.A N ASP 415.A OD1 no hydrogen 2.629 N/A SER 561.A OG ASP 415.A OD2 no hydrogen 3.197 N/A GLU 563.A N PRO 559.A O no hydrogen 2.892 N/A ILE 564.A N PHE 560.A O no hydrogen 2.898 N/A LEU 565.A N SER 561.A O no hydrogen 2.946 N/A LEU 566.A N GLU 562.A O no hydrogen 2.877 N/A HIS 567.A N GLU 563.A O no hydrogen 2.900 N/A HIS 567.A ND1 ILE 564.A O no hydrogen 2.736 N/A HIS 567.A NE2 LEU 397.A O no hydrogen 2.868 N/A CYS 573.A SG ALA 571.A O no hydrogen 3.797 N/A ASP 576.A N ASP 574.A OD2 no hydrogen 3.431 N/A LEU 577.A N ASP 574.A OD1 no hydrogen 3.146 N/A MET 578.A N ASP 574.A O no hydrogen 2.877 N/A LEU 579.A N GLU 575.A O no hydrogen 2.902 N/A TRP 580.A N ASP 576.A O no hydrogen 2.935 N/A TRP 580.A NE1 ALA 605.A O no hydrogen 2.628 N/A THR 581.A N LEU 577.A O no hydrogen 2.856 N/A THR 581.A OG1 LEU 577.A O no hydrogen 3.143 N/A THR 581.A OG1 MET 578.A O no hydrogen 2.541 N/A VAL 582.A N MET 578.A O no hydrogen 2.934 N/A ALA 583.A N LEU 579.A O no hydrogen 2.926 N/A ALA 584.A N TRP 580.A O no hydrogen 2.860 N/A PHE 585.A N THR 581.A O no hydrogen 2.886 N/A LEU 586.A N VAL 582.A O no hydrogen 2.926 N/A ALA 587.A N ALA 583.A O no hydrogen 2.899 N/A ARG 588.A N ALA 584.A O no hydrogen 2.888 N/A ARG 588.A NE LEU 625.A O no hydrogen 2.454 N/A ARG 588.A NH1 ALA 630.A O no hydrogen 2.841 N/A ARG 588.A NH2 LEU 625.A O no hydrogen 3.013 N/A GLU 589.A N PHE 585.A O no hydrogen 2.883 N/A LEU 590.A N LEU 586.A O no hydrogen 2.826 N/A VAL 593.A N LEU 590.A O no hydrogen 3.168 N/A LYS 594.A N ASP 482.A O no hydrogen 2.868 N/A HIS 596.A N VAL 484.A O no hydrogen 2.883 N/A THR 597.A N HIS 646.A O no hydrogen 2.831 N/A LEU 598.A N ILE 486.A O no hydrogen 2.931 N/A HIS 600.A N SER 490.A OG no hydrogen 2.892 N/A CYS 603.A N HIS 600.A O no hydrogen 2.884 N/A ARG 606.A NH2 MET 599.A O no hydrogen 3.306 N/A THR 607.A N THR 604.A O no hydrogen 3.373 N/A ARG 610.A N THR 607.A O no hydrogen 3.030 N/A ARG 610.A NH1 HIS 219.A O no hydrogen 2.658 N/A ARG 610.A NH2 HIS 219.A O no hydrogen 2.520 N/A PHE 611.A N THR 607.A O no hydrogen 3.111 N/A LEU 619.A N ASN 617.A OD1 no hydrogen 2.932 N/A SER 624.A N SER 621.A O no hydrogen 2.970 N/A TYR 626.A N ARG 623.A O no hydrogen 3.088 N/A ASP 627.A N ARG 623.A O no hydrogen 2.931 N/A ALA 630.A N ASP 627.A O no hydrogen 3.308 N/A LEU 632.A N ASP 568.A OD1 no hydrogen 2.902 N/A LEU 633.A N ASP 568.A OD2 no hydrogen 3.270 N/A SER 634.A N PRO 631.A O no hydrogen 3.135 N/A SER 634.A OG PRO 631.A O no hydrogen 3.388 N/A SER 635.A N LEU 632.A O no hydrogen 3.057 N/A SER 635.A OG LEU 632.A O no hydrogen 2.678 N/A LEU 636.A N LEU 633.A O no hydrogen 2.980 N/A HIS 637.A N SER 634.A O no hydrogen 3.447 N/A SER 638.A N SER 635.A O no hydrogen 3.361 N/A SER 638.A OG SER 635.A O no hydrogen 3.284 N/A ARG 642.A NE ARG 606.A O no hydrogen 3.392 N/A ARG 642.A NH1 ARG 642.A O no hydrogen 3.232 N/A LEU 643.A N LYS 639.A O no hydrogen 2.574 N/A VAL 644.A N GLU 640.A O no hydrogen 2.913 N/A THR 645.A N LEU 641.A O no hydrogen 2.916 N/A THR 645.A OG1 LEU 641.A O no hydrogen 3.099 N/A HIS 646.A N VAL 595.A O no hydrogen 3.190 N/A ASN 647.A ND2 ARG 606.A O no hydrogen 3.092 N/A VAL 648.A N THR 597.A O no hydrogen 3.325 N/A LYS 658.A NZ TYR 663.A OH no hydrogen 3.244 N/A THR 660.A OG1 LYS 658.A O no hydrogen 2.859 N/A TYR 663.A N THR 660.A O no hydrogen 3.308 N/A ILE 667.A N ASN 665.A OD1 no hydrogen 3.380 N/A ARG 668.A NH2 THR 660.A O no hydrogen 3.162 N/A ARG 668.A NH2 TYR 663.A O no hydrogen 3.343 N/A ALA 669.A N ASN 665.A O no hydrogen 2.878 N/A ARG 670.A N PRO 666.A O no hydrogen 2.929 N/A PHE 671.A N ARG 668.A O no hydrogen 2.991 N/A VAL 672.A N ALA 669.A O no hydrogen 3.249 N/A LEU 679.A N ASP 676.A O no hydrogen 3.103 N/A PHE 680.A N LYS 677.A O no hydrogen 3.202 N/A ASN 689.A ND2 PHE 671.A O no hydrogen 2.891 N/A LEU 690.A N ALA 687.A O no hydrogen 2.967 N/A PHE 694.A N ALA 691.A O no hydrogen 3.157 N/A SER 695.A N HIS 701.A O no hydrogen 3.427 N/A LYS 700.A N GLN 662.A O no hydrogen 2.915 N/A HIS 701.A N ALA 698.A O no hydrogen 2.925 N/A TRP 703.A N GLY 693.A O no hydrogen 2.671 N/A ARG 704.A N ASP 702.A OD1 no hydrogen 2.669 N/A ARG 704.A NE ASP 702.A OD1 no hydrogen 3.273 N/A ARG 704.A NE ASP 702.A OD2 no hydrogen 2.679 N/A ARG 704.A NH2 ASP 702.A OD2 no hydrogen 2.739 N/A ARG 704.A NH2 HIS 719.A O no hydrogen 2.659 N/A HIS 713.A N THR 710.A O no hydrogen 3.218 N/A HIS 713.A ND1 ASP 712.A OD1 no hydrogen 2.389 N/A GLN 715.A NE2 VAL 708.A O no hydrogen 2.938 N/A GLN 715.A NE2 THR 710.A OG1 no hydrogen 2.754 N/A TRP 724.A NE1 GLN 722.A OE1 no hydrogen 2.382 N/A MET 725.A N GLN 722.A O no hydrogen 3.006 N/A LEU 726.A N GLN 722.A O no hydrogen 2.930 N/A GLY 727.A N THR 723.A O no hydrogen 2.883 N/A