Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4adg_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 3.A N PHE 323.A O no hydrogen 3.113 N/A THR 5.A N LEU 321.A O no hydrogen 3.200 N/A LEU 7.A N LEU 319.A O no hydrogen 2.868 N/A THR 9.A OG1 PRO 316.A O no hydrogen 2.726 N/A CYS 13.A N ALA 10.A O no hydrogen 3.124 N/A CYS 13.A SG ALA 10.A O no hydrogen 3.305 N/A THR 15.A N VAL 21.A O no hydrogen 2.974 N/A THR 15.A OG1 VAL 21.A O no hydrogen 3.538 N/A VAL 21.A N THR 15.A O no hydrogen 3.099 N/A ARG 22.A N SER 170.A O no hydrogen 2.954 N/A LEU 23.A N CYS 13.A O no hydrogen 2.999 N/A ALA 24.A N GLN 168.A O no hydrogen 2.745 N/A GLY 25.A N GLN 168.A O no hydrogen 3.288 N/A ARG 27.A N VAL 166.A O no hydrogen 2.922 N/A GLU 29.A N ARG 164.A O no hydrogen 2.810 N/A SER 30.A OG HIS 160.A ND1 no hydrogen 2.669 N/A LYS 31.A N THR 161.A O no hydrogen 2.763 N/A LYS 31.A NZ LEU 387.A O no hydrogen 3.451 N/A ILE 32.A N ASN 389.A OD1 no hydrogen 2.857 N/A VAL 33.A N PHE 159.A O no hydrogen 2.755 N/A ASP 34.A N GLN 348.A O no hydrogen 2.794 N/A GLY 35.A N VAL 157.A O no hydrogen 2.982 N/A GLY 36.A N ASP 34.A OD1 no hydrogen 2.961 N/A CYS 37.A N SER 236.A O no hydrogen 2.743 N/A PHE 38.A N VAL 155.A O no hydrogen 2.828 N/A ALA 39.A N ARG 234.A O no hydrogen 3.162 N/A TRP 41.A N GLN 233.A OE1 no hydrogen 2.779 N/A GLU 44.A N SER 146.A O no hydrogen 2.961 N/A THR 46.A N LEU 144.A O no hydrogen 2.794 N/A GLY 47.A N THR 46.A OG1 no hydrogen 2.865 N/A ALA 48.A N PHE 142.A O no hydrogen 2.927 N/A ILE 50.A N SER 140.A O no hydrogen 2.781 N/A ILE 53.A N GLU 52.A OE2 no hydrogen 2.952 N/A SER 58.A N ASP 56.A O no hydrogen 3.198 N/A SER 58.A OG ASP 56.A OD1 no hydrogen 2.833 N/A GLY 61.A N SER 58.A OG no hydrogen 3.155 N/A LEU 62.A N SER 58.A O no hydrogen 2.940 N/A GLY 63.A N GLU 60.A O no hydrogen 3.183 N/A TRP 65.A N LEU 62.A O no hydrogen 2.986 N/A VAL 66.A N LEU 62.A O no hydrogen 2.886 N/A CYS 71.A N PRO 67.A O no hydrogen 3.101 N/A ALA 72.A N THR 68.A O no hydrogen 3.151 N/A ARG 73.A N ALA 69.A O no hydrogen 3.068 N/A ILE 74.A N PRO 70.A O no hydrogen 2.874 N/A TRP 75.A N CYS 71.A O no hydrogen 2.839 N/A ASN 76.A N ALA 72.A O no hydrogen 3.382 N/A GLY 77.A N ILE 74.A O no hydrogen 3.078 N/A THR 78.A N TYR 147.A O no hydrogen 2.893 N/A GLN 79.A NE2 PRO 247.A O no hydrogen 2.937 N/A ARG 80.A NH1 TRP 75.A O no hydrogen 3.162 N/A ALA 81.A N ALA 145.A O no hydrogen 2.809 N/A THR 83.A N ALA 143.A O no hydrogen 3.020 N/A PHE 84.A N GLU 118.A O no hydrogen 2.800 N/A TRP 85.A N VAL 141.A O no hydrogen 2.805 N/A ALA 86.A N GLU 120.A O no hydrogen 3.101 N/A VAL 87.A N MET 139.A O no hydrogen 2.875 N/A ASN 88.A N MET 139.A O no hydrogen 2.910 N/A ASN 88.A ND2 ASP 127.A OD2 no hydrogen 2.675 N/A TYR 90.A N GLN 97.A O no hydrogen 3.056 N/A TYR 90.A OH GLU 52.A OE2 no hydrogen 2.588 N/A SER 91.A N ASP 136.A OD1 no hydrogen 3.247 N/A SER 91.A N ASP 136.A OD2 no hydrogen 3.036 N/A TYR 95.A N GLN 97.A OE1 no hydrogen 2.784 N/A GLN 97.A NE2 ILE 53.A O no hydrogen 2.755 N/A TYR 101.A N LEU 98.A O no hydrogen 3.207 N/A PHE 102.A N ALA 99.A O no hydrogen 3.030 N/A ASN 103.A ND2 SER 107.A OG no hydrogen 2.840 N/A GLY 105.A N GLU 120.A OE1 no hydrogen 3.076 N/A GLY 106.A N ASN 103.A O no hydrogen 2.771 N/A TYR 108.A N ASN 103.A OD1 no hydrogen 3.243 N/A TYR 109.A OH PRO 54.A O no hydrogen 2.659 N/A LYS 110.A N GLY 106.A O no hydrogen 2.959 N/A LYS 110.A NZ CYS 117.A O no hydrogen 3.105 N/A GLN 111.A N SER 107.A O no hydrogen 3.075 N/A TYR 112.A N TYR 109.A O no hydrogen 3.196 N/A HIS 113.A N TYR 109.A O no hydrogen 2.774 N/A HIS 113.A NE2 TYR 95.A O no hydrogen 2.653 N/A THR 115.A OG1 VAL 57.A O no hydrogen 2.638 N/A CYS 117.A N THR 115.A OG1 no hydrogen 3.157 N/A GLU 118.A N CYS 82.A O no hydrogen 2.843 N/A GLU 120.A N PHE 84.A O no hydrogen 2.914 N/A ALA 122.A N ALA 86.A O no hydrogen 2.827 N/A HIS 125.A N ALA 122.A O no hydrogen 3.199 N/A HIS 125.A ND1 ASP 256.A OD1 no hydrogen 2.705 N/A SER 126.A N ASP 256.A OD2 no hydrogen 2.764 N/A ALA 128.A N SER 126.A OG no hydrogen 3.428 N/A CYS 130.A N ASP 127.A O no hydrogen 3.138 N/A CYS 130.A SG VAL 138.A O no hydrogen 3.920 N/A TRP 131.A NE1 GLY 278.A O no hydrogen 2.849 N/A MET 139.A N ASN 88.A O no hydrogen 2.792 N/A SER 140.A N ILE 50.A O no hydrogen 2.717 N/A SER 140.A OG ILE 50.A O no hydrogen 3.548 N/A SER 140.A OG GLU 52.A O no hydrogen 2.747 N/A VAL 141.A N TRP 85.A O no hydrogen 2.888 N/A PHE 142.A N ALA 48.A O no hydrogen 2.857 N/A ALA 143.A N THR 83.A O no hydrogen 3.040 N/A LEU 144.A N THR 46.A O no hydrogen 2.831 N/A ALA 145.A N ALA 81.A O no hydrogen 2.868 N/A SER 146.A N GLU 44.A O no hydrogen 3.168 N/A SER 146.A OG ILE 74.A O no hydrogen 2.631 N/A TYR 147.A N THR 78.A O no hydrogen 2.773 N/A VAL 148.A N ASP 42.A O no hydrogen 2.969 N/A HIS 150.A NE2 GLU 44.A OE2 no hydrogen 2.953 N/A LYS 153.A N HIS 150.A O no hydrogen 3.032 N/A LYS 153.A NZ ASP 42.A OD1 no hydrogen 2.849 N/A LYS 153.A NZ ASP 42.A OD2 no hydrogen 3.450 N/A LYS 153.A NZ VAL 298.A O no hydrogen 2.853 N/A THR 154.A N PRO 151.A O no hydrogen 3.264 N/A THR 154.A OG1 HIS 150.A O no hydrogen 2.991 N/A VAL 155.A N PHE 38.A O no hydrogen 2.769 N/A ARG 156.A N ILE 207.A O no hydrogen 3.281 N/A ARG 156.A NH1 ASP 34.A OD1 no hydrogen 2.793 N/A ARG 156.A NH1 GLY 36.A O no hydrogen 3.243 N/A ARG 156.A NH2 ASP 34.A OD2 no hydrogen 3.082 N/A VAL 157.A N GLY 36.A O no hydrogen 2.940 N/A LYS 158.A N GLU 205.A O no hydrogen 3.061 N/A LYS 158.A NZ GLN 348.A OE1 no hydrogen 3.254 N/A PHE 159.A N VAL 33.A O no hydrogen 2.720 N/A HIS 160.A N LEU 203.A O no hydrogen 2.869 N/A HIS 160.A ND1 SER 30.A OG no hydrogen 2.669 N/A HIS 160.A NE2 GLU 205.A OE1 no hydrogen 2.731 N/A THR 161.A N LYS 31.A O no hydrogen 2.998 N/A THR 161.A OG1 LYS 31.A O no hydrogen 2.834 N/A THR 163.A OG1.A GLY 201.A O no hydrogen 3.078 N/A THR 163.A OG1.B GLY 201.A O no hydrogen 2.467 N/A ARG 164.A N GLU 29.A O no hydrogen 2.767 N/A ARG 164.A NH1 THR 163.A O no hydrogen 3.040 N/A ARG 164.A NH1 ASP 199.A OD2 no hydrogen 3.490 N/A ARG 164.A NH2 GLU 162.A OE1 no hydrogen 3.183 N/A THR 165.A N ASP 199.A OD1 no hydrogen 3.081 N/A VAL 166.A N ARG 27.A O no hydrogen 2.731 N/A TRP 167.A N VAL 178.A O no hydrogen 2.884 N/A GLN 168.A N GLY 25.A O no hydrogen 2.866 N/A GLN 168.A NE2 ASN 177.A OD1 no hydrogen 3.675 N/A LEU 169.A N CYS 176.A O no hydrogen 2.781 N/A SER 170.A N ARG 22.A O no hydrogen 2.931 N/A VAL 171.A N VAL 174.A O no hydrogen 2.791 N/A ALA 172.A N PRO 20.A O no hydrogen 2.959 N/A VAL 174.A N VAL 171.A O no hydrogen 2.957 N/A CYS 176.A N LEU 169.A O no hydrogen 2.928 N/A CYS 176.A SG PHE 184.A O no hydrogen 3.500 N/A VAL 178.A N TRP 167.A O no hydrogen 3.006 N/A THR 179.A N HIS 182.A O no hydrogen 3.173 N/A THR 180.A OG1 ASP 199.A OD1 no hydrogen 3.536 N/A THR 180.A OG1 ASP 199.A OD2 no hydrogen 2.646 N/A GLU 181.A N THR 179.A OG1 no hydrogen 3.263 N/A HIS 182.A N THR 179.A OG1 no hydrogen 3.047 N/A CYS 185.A N LEU 192.A O no hydrogen 2.787 N/A THR 187.A N GLY 190.A O no hydrogen 3.206 N/A GLY 190.A N THR 187.A O no hydrogen 3.216 N/A GLN 191.A N LYS 324.A O no hydrogen 2.960 N/A LEU 192.A N CYS 185.A O no hydrogen 2.739 N/A GLU 193.A N LYS 322.A O no hydrogen 2.885 N/A VAL 194.A N PRO 183.A O no hydrogen 2.827 N/A GLN 195.A N GLY 320.A O no hydrogen 2.707 N/A LEU 203.A N HIS 160.A O no hydrogen 2.992 N/A VAL 204.A N GLY 216.A O no hydrogen 2.834 N/A GLU 205.A N LYS 158.A O no hydrogen 2.868 N/A TYR 206.A N ARG 214.A O no hydrogen 2.817 N/A TYR 206.A OH SER 229.A OG no hydrogen 2.940 N/A ILE 207.A N ARG 156.A O no hydrogen 2.743 N/A MET 208.A N GLN 212.A O no hydrogen 2.680 N/A GLN 211.A N ASN 210.A O no hydrogen 2.273 N/A GLN 212.A N MET 208.A O no hydrogen 2.809 N/A GLN 212.A NE2 GLN 211.A O no hydrogen 3.249 N/A SER 213.A OG GLU 205.A OE2 no hydrogen 2.621 N/A ARG 214.A N TYR 206.A O no hydrogen 2.799 N/A ARG 214.A NE THR 308.A OG1 no hydrogen 2.839 N/A TRP 215.A N THR 309.A O no hydrogen 2.797 N/A GLY 216.A N VAL 204.A O no hydrogen 2.758 N/A GLY 218.A N ASP 202.A O no hydrogen 2.912 N/A HIS 223.A N ASN 221.A OD1 no hydrogen 3.018 N/A GLY 224.A N ASN 221.A O no hydrogen 3.461 N/A TRP 227.A N GLY 224.A O no hydrogen 3.109 N/A SER 229.A N ASP 226.A O no hydrogen 3.080 N/A SER 229.A OG TYR 206.A OH no hydrogen 2.940 N/A VAL 231.A N SER 229.A OG no hydrogen 3.408 N/A CYS 232.A N SER 229.A O no hydrogen 2.909 N/A CYS 232.A SG ASP 226.A O no hydrogen 3.937 N/A GLN 233.A N PRO 230.A O no hydrogen 2.979 N/A GLN 233.A NE2 SER 229.A O no hydrogen 3.692 N/A ARG 234.A N ALA 39.A O no hydrogen 3.002 N/A ARG 234.A NH2 THR 78.A OG1 no hydrogen 2.886 N/A HIS 235.A NE2 GLY 35.A O no hydrogen 2.764 N/A SER 236.A N CYS 37.A O no hydrogen 2.852 N/A SER 236.A OG ARG 241.A O no hydrogen 2.868 N/A CYS 239.A N SER 236.A O no hydrogen 3.320 N/A SER 240.A N SER 236.A OG no hydrogen 2.853 N/A ARG 241.A N ASP 238.A OD1 no hydrogen 2.815 N/A ARG 241.A NE ASP 238.A OD2 no hydrogen 2.894 N/A ARG 241.A NH2 ASP 238.A OD2 no hydrogen 3.213 N/A VAL 243.A N HIS 235.A O no hydrogen 3.103 N/A THR 246.A OG1 GLY 244.A O no hydrogen 3.098 N/A ARG 249.A NH1 ARG 80.A O no hydrogen 2.750 N/A ARG 251.A N GLY 269.A O no hydrogen 2.983 N/A ARG 253.A N VAL 271.A O no hydrogen 2.863 N/A VAL 255.A N VAL 273.A O no hydrogen 2.863 N/A ASP 259.A N ASP 256.A O no hydrogen 3.043 N/A LEU 261.A N ASP 259.A OD1 no hydrogen 3.065 N/A LEU 262.A N ASP 259.A O no hydrogen 3.093 N/A ARG 263.A N PRO 260.A O no hydrogen 3.101 N/A THR 264.A N LEU 261.A O no hydrogen 3.057 N/A THR 264.A OG1 LEU 261.A O no hydrogen 2.714 N/A GLY 267.A N GLU 270.A OE1 no hydrogen 2.793 N/A GLY 269.A N GLY 291.A O no hydrogen 2.781 N/A GLU 270.A N GLY 267.A O no hydrogen 3.041 N/A VAL 271.A N ARG 251.A O no hydrogen 2.852 N/A TRP 272.A N ARG 289.A O no hydrogen 2.769 N/A VAL 273.A N ARG 253.A O no hydrogen 2.883 N/A THR 274.A N HIS 287.A O no hydrogen 2.757 N/A THR 274.A OG1 VAL 255.A O no hydrogen 2.701 N/A VAL 276.A N GLY 285.A O no hydrogen 2.741 N/A GLY 278.A N ALA 129.A O no hydrogen 3.526 N/A ARG 282.A N TRP 131.A O no hydrogen 2.766 N/A ARG 282.A NE GLY 132.A O no hydrogen 3.328 N/A LYS 283.A NZ GLN 280.A OE1 no hydrogen 3.071 N/A GLY 285.A N VAL 276.A O no hydrogen 2.994 N/A HIS 287.A N THR 274.A O no hydrogen 2.758 N/A ARG 289.A N TRP 272.A O no hydrogen 2.863 N/A GLY 291.A N GLU 270.A O no hydrogen 2.905 N/A HIS 295.A N PRO 292.A O no hydrogen 3.200 N/A GLU 302.A N GLU 302.A OE1 no hydrogen 2.855 N/A TRP 303.A N GLU 299.A O no hydrogen 2.851 N/A ILE 304.A N MET 300.A O no hydrogen 3.028 N/A HIS 305.A N PRO 301.A O no hydrogen 3.111 N/A ALA 306.A N GLU 302.A O no hydrogen 3.320 N/A HIS 307.A N TRP 303.A O no hydrogen 2.817 N/A HIS 307.A ND1 ASP 226.A OD1 no hydrogen 2.750 N/A THR 308.A OG1 ILE 304.A O no hydrogen 2.484 N/A THR 309.A N TRP 215.A O no hydrogen 2.957 N/A THR 309.A OG1 TRP 215.A O no hydrogen 3.402 N/A THR 309.A OG1 ASP 311.A O no hydrogen 2.715 N/A SER 310.A OG ASP 311.A OD2 no hydrogen 3.180 N/A HIS 314.A ND1 PRO 315.A O no hydrogen 2.902 N/A LEU 319.A N LEU 7.A O no hydrogen 2.813 N/A GLY 320.A N GLN 195.A O no hydrogen 2.912 N/A LEU 321.A N THR 5.A O no hydrogen 2.832 N/A LYS 322.A N GLU 193.A O no hydrogen 2.871 N/A LYS 322.A NZ GLU 193.A OE1 no hydrogen 3.063 N/A PHE 323.A N ALA 3.A O no hydrogen 2.765 N/A LYS 324.A N GLN 191.A O no hydrogen 2.838 N/A LYS 324.A NZ GLU 193.A OE1 no hydrogen 2.713 N/A ARG 327.A NH1 GLY 190.A O no hydrogen 3.096 N/A ALA 334.A N ASN 364.A O no hydrogen 3.149 N/A ARG 339.A N LEU 358.A O no hydrogen 2.849 N/A ARG 342.A N GLU 356.A O no hydrogen 2.754 N/A VAL 343.A N SER 406.A O no hydrogen 2.862 N/A THR 344.A N LEU 354.A O no hydrogen 2.928 N/A THR 344.A OG1 LEU 354.A O no hydrogen 3.568 N/A GLY 345.A N ARG 408.A O no hydrogen 3.139 N/A TYR 347.A N ILE 410.A O no hydrogen 3.398 N/A GLN 348.A N LEU 388.A O no hydrogen 2.776 N/A GLN 348.A NE2 ASN 389.A O no hydrogen 2.665 N/A CYS 349.A SG THR 351.A O no hydrogen 3.543 N/A ALA 353.A N ALA 386.A O no hydrogen 2.745 N/A LEU 354.A N THR 344.A O no hydrogen 2.781 N/A VAL 355.A N THR 384.A O no hydrogen 2.777 N/A GLU 356.A N ARG 342.A O no hydrogen 3.011 N/A GLY 357.A N PHE 382.A O no hydrogen 3.222 N/A LEU 358.A N ARG 339.A O no hydrogen 2.767 N/A ALA 359.A N GLY 380.A O no hydrogen 2.700 N/A CYS 365.A N PHE 377.A O no hydrogen 2.784 N/A LEU 367.A N GLY 375.A O no hydrogen 3.039 N/A THR 368.A N SER 397.A O no hydrogen 2.974 N/A THR 368.A OG1 SER 397.A O no hydrogen 3.446 N/A VAL 369.A N GLU 372.A O no hydrogen 2.885 N/A ASN 370.A N GLN 395.A O no hydrogen 2.916 N/A ASN 370.A ND2 THR 390.A OG1 no hydrogen 3.231 N/A ASN 370.A ND2 PRO 393.A O no hydrogen 2.982 N/A GLU 372.A N VAL 369.A O no hydrogen 3.042 N/A VAL 374.A N LEU 367.A O no hydrogen 3.074 N/A GLY 375.A N ASP 373.A OD1.B no hydrogen 3.142 N/A PHE 377.A N CYS 365.A O no hydrogen 2.894 N/A GLY 380.A N ALA 359.A O no hydrogen 2.826 N/A PHE 382.A N GLY 357.A O no hydrogen 3.027 N/A THR 384.A N VAL 355.A O no hydrogen 2.817 N/A ALA 386.A N ALA 353.A O no hydrogen 2.841 N/A ASN 389.A N GLU 372.A OE1 no hydrogen 2.740 N/A ASN 389.A ND2 SER 30.A O no hydrogen 2.737 N/A THR 390.A OG1 GLU 372.A OE2 no hydrogen 2.649 N/A TYR 394.A OH THR 390.A O no hydrogen 2.721 N/A GLN 395.A N ASN 370.A OD1 no hydrogen 2.804 N/A VAL 396.A N ASP 403.A O no hydrogen 2.799 N/A SER 397.A N THR 368.A O no hydrogen 3.270 N/A SER 397.A OG GLY 400.A O no hydrogen 3.180 N/A SER 397.A OG GLU 401.A O no hydrogen 3.259 N/A CYS 398.A SG ALA 336.A O no hydrogen 3.347 N/A GLY 399.A N SER 397.A OG no hydrogen 3.063 N/A ASP 403.A N VAL 396.A O no hydrogen 2.901 N/A ALA 405.A N TYR 394.A O no hydrogen 2.948 N/A SER 406.A N VAL 341.A O no hydrogen 2.811 N/A ARG 408.A N VAL 343.A O no hydrogen 2.919 N/A ILE 410.A N GLY 345.A O no hydrogen 3.004 N/A ALA 414.A N ASP 411.A OD1 no hydrogen 2.815 N/A GLN 415.A N ASP 411.A O no hydrogen 3.017 N/A SER 416.A N PRO 412.A O no hydrogen 3.076 N/A SER 416.A OG PRO 412.A O no hydrogen 2.858 N/A PHE 417.A N ALA 414.A O no hydrogen 3.211 N/A THR 418.A N GLN 415.A O no hydrogen 3.055 N/A THR 418.A OG1 ALA 414.A O no hydrogen 2.549 N/A TYR 422.A OH LEU 242.A O no hydrogen 2.694 N/A SER 430.A OG GLU 431.A O no hydrogen 3.284 N/A