Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3afo_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 3.A OG SER 5.A O no hydrogen 2.814 N/A SER 3.A OG VAL 8.A O no hydrogen 2.830 N/A GLY 4.A N SER 82.A OG no hydrogen 2.855 N/A SER 5.A N SER 3.A OG no hydrogen 3.238 N/A PHE 7.A N SER 5.A OG no hydrogen 3.215 N/A VAL 8.A N SER 5.A O no hydrogen 3.236 N/A LYS 9.A N.A HIS 97.A O no hydrogen 2.860 N/A LYS 9.A N.B HIS 97.A O no hydrogen 2.847 N/A LYS 11.A N LEU 99.A O no hydrogen 2.921 N/A VAL 13.A N THR 101.A O no hydrogen 2.821 N/A ASN 15.A N PRO 12.A O no hydrogen 3.066 N/A LEU 16.A N VAL 13.A O no hydrogen 2.874 N/A SER 19.A N ASN 109.A O no hydrogen 2.854 N/A SER 19.A OG ASN 109.A O no hydrogen 2.430 N/A SER 19.A OG THR 111.A O no hydrogen 3.388 N/A SER 20.A N ASP 112.A OD1 no hydrogen 3.172 N/A ASP 23.A N ILE 32.A O no hydrogen 2.813 N/A VAL 25.A N SER 30.A O no hydrogen 3.246 N/A GLN 29.A N CYS 171.A O no hydrogen 2.796 N/A GLN 29.A NE2 SER 26.A OG no hydrogen 2.831 N/A SER 30.A N VAL 25.A O no hydrogen 2.833 N/A LEU 31.A N ALA 169.A O no hydrogen 2.962 N/A ILE 32.A N ASP 23.A O no hydrogen 3.011 N/A TRP 33.A N SER 167.A OG no hydrogen 3.044 N/A TRP 33.A NE1 VAL 164.A O no hydrogen 2.948 N/A GLN 38.A N ASP 112.A OD2 no hydrogen 2.957 N/A GLN 38.A NE2 GLU 68.A O no hydrogen 3.149 N/A ASN 39.A N ASP 112.A OD2 no hydrogen 2.900 N/A ASN 39.A ND2 ARG 17.A O no hydrogen 2.926 N/A ASN 39.A ND2 ARG 110.A O no hydrogen 2.687 N/A VAL 40.A N ASN 70.A O no hydrogen 2.811 N/A TYR 41.A N LEU 113.A O no hydrogen 2.911 N/A ILE 42.A N ILE 72.A O no hydrogen 2.883 N/A THR 43.A N.A VAL 115.A O no hydrogen 2.947 N/A THR 43.A N.B VAL 115.A O no hydrogen 2.955 N/A LYS 44.A NZ GLU 80.A OE1 no hydrogen 2.965 N/A LYS 45.A N LEU 117.A O no hydrogen 2.944 N/A THR 51.A N THR 48.A O no hydrogen 2.973 N/A THR 51.A OG1 LYS 45.A O no hydrogen 2.647 N/A THR 51.A OG1 THR 48.A O no hydrogen 3.067 N/A ARG 52.A N THR 48.A O no hydrogen 3.339 N/A ARG 52.A NE ASP 84.A OD2 no hydrogen 2.620 N/A ARG 52.A NH1 GLU 80.A OE2 no hydrogen 3.445 N/A ARG 52.A NH2 ASP 84.A OD1 no hydrogen 2.723 N/A ARG 52.A NH2 ASP 84.A OD2 no hydrogen 3.291 N/A GLU 53.A N PRO 49.A O no hydrogen 2.858 N/A ALA 54.A N SER 50.A O no hydrogen 2.896 N/A MET 55.A N THR 51.A O no hydrogen 2.918 N/A VAL 56.A N ARG 52.A O no hydrogen 3.125 N/A GLU 57.A N GLU 53.A O no hydrogen 3.024 N/A PHE 58.A N ALA 54.A O no hydrogen 2.751 N/A ILE 59.A N MET 55.A O no hydrogen 2.921 N/A THR 60.A N VAL 56.A O no hydrogen 2.941 N/A THR 60.A OG1 VAL 56.A O no hydrogen 2.809 N/A HIS 61.A N GLU 57.A O no hydrogen 3.121 N/A LEU 62.A N PHE 58.A O no hydrogen 2.977 N/A HIS 63.A N ILE 59.A O no hydrogen 2.926 N/A HIS 63.A ND1 HIS 97.A ND1 no hydrogen 2.950 N/A GLU 64.A N THR 60.A O no hydrogen 2.843 N/A SER 65.A N HIS 61.A O no hydrogen 2.863 N/A TYR 66.A N LEU 62.A O no hydrogen 2.809 N/A TYR 66.A OH GLN 162.A OE1.B no hydrogen 2.696 N/A GLU 68.A N GLU 68.A OE1 no hydrogen 2.727 N/A VAL 69.A N TYR 66.A O no hydrogen 2.970 N/A ASN 70.A N GLN 38.A O no hydrogen 2.645 N/A ASN 70.A ND2 ASN 39.A OD1 no hydrogen 3.128 N/A ILE 72.A N VAL 40.A O no hydrogen 2.902 N/A VAL 73.A N TYR 100.A O no hydrogen 3.029 N/A ALA 78.A N GLN 74.A O.A no hydrogen 2.879 N/A ALA 78.A N GLN 74.A O.B no hydrogen 2.908 N/A GLU 79.A N PRO 75.A O no hydrogen 3.286 N/A GLU 80.A N ASP 76.A O no hydrogen 2.860 N/A ILE 81.A N VAL 77.A O no hydrogen 2.787 N/A SER 82.A OG ALA 78.A O no hydrogen 3.484 N/A SER 82.A OG GLU 79.A O no hydrogen 2.902 N/A GLN 83.A NE2.B GLU 80.A O no hydrogen 2.716 N/A ASP 84.A N ILE 81.A O no hydrogen 2.847 N/A LYS 86.A NZ GLN 83.A O.A no hydrogen 3.556 N/A LEU 89.A N ARG 95.A O no hydrogen 2.891 N/A ASP 92.A N LEU 89.A O no hydrogen 2.832 N/A ASN 94.A N ASP 92.A OD1 no hydrogen 2.901 N/A ARG 95.A N ASP 92.A O no hydrogen 2.867 N/A HIS 97.A N PHE 7.A O no hydrogen 2.699 N/A HIS 97.A ND1 HIS 63.A ND1 no hydrogen 2.950 N/A LEU 99.A N LYS 9.A O.A no hydrogen 2.994 N/A LEU 99.A N LYS 9.A O.B no hydrogen 2.985 N/A TYR 100.A N VAL 71.A O no hydrogen 2.796 N/A THR 101.A N LYS 11.A O no hydrogen 2.945 N/A THR 101.A OG1 VAL 73.A O no hydrogen 2.745 N/A ILE 107.A N PRO 103.A O no hydrogen 3.048 N/A VAL 108.A N GLU 104.A O no hydrogen 2.668 N/A ASN 109.A N GLN 105.A O no hydrogen 3.294 N/A ARG 110.A N ILE 107.A O no hydrogen 3.059 N/A ARG 110.A NE LEU 16.A O no hydrogen 2.980 N/A ARG 110.A NH1 ASP 106.A O no hydrogen 3.324 N/A THR 111.A N ILE 107.A O no hydrogen 3.167 N/A THR 111.A OG1 ILE 107.A O no hydrogen 2.945 N/A ASP 112.A N ASN 39.A O no hydrogen 2.905 N/A LEU 113.A N ASN 39.A O no hydrogen 3.342 N/A LEU 114.A N PRO 137.A O no hydrogen 2.999 N/A VAL 115.A N TYR 41.A O no hydrogen 2.789 N/A THR 116.A N LEU 139.A O no hydrogen 2.926 N/A LEU 117.A N THR 43.A O.A no hydrogen 2.872 N/A LEU 117.A N THR 43.A O.B no hydrogen 2.839 N/A GLY 118.A N PHE 141.A O no hydrogen 3.142 N/A GLY 119.A N THR 122.A OG1 no hydrogen 3.026 N/A THR 122.A N GLY 119.A O no hydrogen 3.142 N/A THR 122.A OG1 GLY 119.A O no hydrogen 3.525 N/A ILE 123.A N GLY 119.A O no hydrogen 3.371 N/A LEU 124.A N ASP 120.A O no hydrogen 2.973 N/A HIS 125.A N GLY 121.A O no hydrogen 2.942 N/A GLY 126.A N THR 122.A O no hydrogen 3.020 N/A VAL 127.A N ILE 123.A O no hydrogen 2.840 N/A SER 128.A N LEU 124.A O no hydrogen 2.940 N/A MET 129.A N GLY 126.A O no hydrogen 3.340 N/A PHE 130.A N VAL 127.A O no hydrogen 2.818 N/A GLY 131.A N SER 128.A O no hydrogen 3.302 N/A THR 133.A N PHE 130.A O no hydrogen 3.258 N/A GLN 134.A N THR 133.A OG1 no hydrogen 2.598 N/A VAL 138.A N TYR 333.A O no hydrogen 2.789 N/A LEU 139.A N LEU 114.A O no hydrogen 2.764 N/A PHE 141.A N THR 116.A O no hydrogen 2.942 N/A ALA 142.A N PHE 152.A O no hydrogen 2.684 N/A LEU 143.A N GLY 118.A O no hydrogen 2.980 N/A PHE 148.A N ASP 120.A OD1 no hydrogen 3.092 N/A PHE 148.A N ASP 120.A OD2 no hydrogen 2.806 N/A LEU 149.A N ASP 120.A OD1 no hydrogen 2.654 N/A ASP 153.A N GLU 156.A OE2 no hydrogen 2.963 N/A LYS 155.A N.A ASP 153.A OD1 no hydrogen 3.081 N/A LYS 155.A N.B ASP 153.A OD1 no hydrogen 3.111 N/A GLU 156.A N ASP 153.A O no hydrogen 2.984 N/A HIS 157.A N PHE 154.A O no hydrogen 3.001 N/A HIS 157.A ND1 PHE 154.A O no hydrogen 2.766 N/A VAL 160.A N GLU 156.A O no hydrogen 3.088 N/A PHE 161.A N HIS 157.A O no hydrogen 2.980 N/A GLN 162.A N.A LYS 158.A O no hydrogen 3.012 N/A GLN 162.A N.B LYS 158.A O no hydrogen 3.042 N/A GLU 163.A N LYS 159.A O.A no hydrogen 3.260 N/A GLU 163.A N LYS 159.A O.B no hydrogen 3.114 N/A VAL 164.A N VAL 160.A O no hydrogen 3.033 N/A ILE 165.A N PHE 161.A O no hydrogen 2.907 N/A SER 166.A N GLN 162.A O.A no hydrogen 3.168 N/A SER 166.A N GLN 162.A O.B no hydrogen 3.124 N/A SER 166.A OG GLN 162.A O.A no hydrogen 2.651 N/A SER 166.A OG GLN 162.A O.B no hydrogen 2.622 N/A SER 167.A N VAL 164.A O no hydrogen 3.110 N/A ARG 168.A N GLU 163.A O no hydrogen 2.848 N/A ARG 168.A NE GLU 163.A OE1 no hydrogen 2.845 N/A ARG 168.A NH2 GLU 163.A OE2 no hydrogen 3.175 N/A LYS 170.A NZ GLU 339.A OE2.A no hydrogen 3.144 N/A CYS 171.A N GLN 29.A O no hydrogen 2.708 N/A LEU 172.A N CYS 334.A O no hydrogen 2.800 N/A ARG 174.A N ILE 332.A O no hydrogen 2.665 N/A ARG 174.A NH1 THR 234.A OG1 no hydrogen 2.800 N/A THR 175.A OG1.A ASN 317.A OD1.B no hydrogen 2.743 N/A ARG 176.A NE GLU 318.A OE1 no hydrogen 3.204 N/A ARG 176.A NH1 PHE 130.A O no hydrogen 3.099 N/A ARG 176.A NH2 THR 133.A O no hydrogen 3.114 N/A ARG 176.A NH2 GLU 318.A OE2 no hydrogen 2.832 N/A LEU 177.A N ALA 194.A O no hydrogen 2.944 N/A GLU 178.A N ILE 316.A O no hydrogen 2.724 N/A CYS 179.A N THR 192.A O no hydrogen 2.860 N/A HIS 180.A N TYR 314.A O no hydrogen 2.708 N/A LEU 181.A N ILE 190.A O no hydrogen 2.856 N/A LYS 182.A N.A GLU 312.A O no hydrogen 2.837 N/A LYS 182.A N.B GLU 312.A O no hydrogen 2.846 N/A LYS 182.A NZ.B ASN 187.A O no hydrogen 3.067 N/A LYS 182.A NZ.B ASN 187.A OD1 no hydrogen 2.932 N/A LYS 183.A NZ ASP 311.A OD2 no hydrogen 2.820 N/A LYS 184.A N ASP 311.A OD1 no hydrogen 2.773 N/A LYS 184.A NZ ASP 185.A OD1 no hydrogen 3.320 N/A SER 186.A N LYS 183.A O no hydrogen 3.080 N/A SER 188.A N SER 186.A OG no hydrogen 3.127 N/A ILE 190.A N LEU 181.A O no hydrogen 2.944 N/A THR 192.A N CYS 179.A O no hydrogen 2.915 N/A ALA 194.A N LEU 177.A O no hydrogen 2.896 N/A MET 195.A N ASP 300.A OD2 no hydrogen 2.815 N/A ASN 196.A N ASP 300.A OD1 no hydrogen 2.755 N/A ASP 197.A N ASP 300.A OD1 no hydrogen 2.997 N/A ILE 198.A N LEU 230.A O no hydrogen 2.760 N/A PHE 199.A N SER 298.A O no hydrogen 2.905 N/A LEU 200.A N VAL 228.A O no hydrogen 2.978 N/A HIS 201.A N LYS 296.A O.A no hydrogen 2.997 N/A HIS 201.A N LYS 296.A O.B no hydrogen 2.990 N/A ARG 202.A N ASP 226.A O no hydrogen 2.728 N/A ARG 202.A NE ASP 226.A OD1 no hydrogen 2.761 N/A ARG 202.A NH1 SER 205.A O no hydrogen 2.909 N/A GLY 203.A N HIS 201.A ND1 no hydrogen 2.928 N/A SER 205.A N ARG 202.A O no hydrogen 3.013 N/A SER 205.A OG HIS 207.A O no hydrogen 3.563 N/A HIS 207.A N SER 205.A OG no hydrogen 3.271 N/A THR 209.A N ALA 225.A O no hydrogen 2.874 N/A THR 209.A OG1 ALA 225.A O no hydrogen 3.009 N/A LEU 211.A N THR 223.A O no hydrogen 2.854 N/A ASP 212.A N LYS 281.A O no hydrogen 2.960 N/A ILE 213.A N THR 221.A O no hydrogen 2.911 N/A PHE 214.A N ARG 279.A O no hydrogen 2.733 N/A ILE 215.A N GLU 218.A O.A no hydrogen 2.815 N/A ILE 215.A N GLU 218.A O.B no hydrogen 2.815 N/A ASP 216.A N HIS 277.A O no hydrogen 2.766 N/A GLU 218.A N.A ILE 215.A O no hydrogen 2.853 N/A GLU 218.A N.B ILE 215.A O no hydrogen 2.858 N/A PHE 219.A N GLU 218.A OE2.B no hydrogen 2.990 N/A LEU 220.A N ILE 213.A O no hydrogen 2.772 N/A THR 221.A N ILE 213.A O no hydrogen 3.427 N/A THR 221.A OG1 ARG 222.A O no hydrogen 3.505 N/A ARG 222.A NH1 ASP 212.A OD2 no hydrogen 3.423 N/A ARG 222.A NH1 SER 284.A O no hydrogen 3.400 N/A ARG 222.A NH2 SER 284.A O no hydrogen 2.557 N/A THR 223.A N LEU 211.A O no hydrogen 2.847 N/A THR 224.A OG1.A ASN 210.A OD1 no hydrogen 2.912 N/A THR 224.A OG1.B THR 209.A O no hydrogen 3.371 N/A THR 224.A OG1.B ASN 210.A OD1 no hydrogen 3.345 N/A ALA 225.A N THR 209.A O no hydrogen 3.112 N/A ASP 226.A N CYS 261.A O no hydrogen 3.274 N/A GLY 227.A N ILE 260.A O no hydrogen 3.184 N/A VAL 228.A N LEU 200.A O no hydrogen 3.054 N/A ALA 229.A N THR 258.A O no hydrogen 2.904 N/A LEU 230.A N ILE 198.A O no hydrogen 2.744 N/A ALA 231.A N LEU 256.A O no hydrogen 2.967 N/A THR 232.A N ASN 196.A O no hydrogen 2.968 N/A THR 232.A OG1 MET 195.A O no hydrogen 2.597 N/A THR 232.A OG1 ASN 196.A O no hydrogen 3.212 N/A GLY 235.A N THR 232.A OG1 no hydrogen 2.907 N/A SER 236.A N PRO 233.A O no hydrogen 3.052 N/A SER 236.A OG PRO 233.A O no hydrogen 2.706 N/A SER 236.A OG VAL 248.A O no hydrogen 3.287 N/A THR 237.A OG1 THR 234.A O no hydrogen 3.294 N/A ALA 238.A N GLY 235.A O no hydrogen 2.947 N/A SER 240.A OG THR 258.A OG1 no hydrogen 2.631 N/A SER 242.A N ALA 238.A O no hydrogen 3.368 N/A ALA 243.A N TYR 239.A O no hydrogen 3.016 N/A GLY 244.A N LEU 241.A O no hydrogen 2.947 N/A GLY 245.A N SER 240.A O no hydrogen 2.806 N/A VAL 248.A N SER 236.A OG no hydrogen 2.951 N/A LEU 251.A N SER 249.A OG no hydrogen 3.091 N/A VAL 252.A N SER 249.A O no hydrogen 2.917 N/A ILE 255.A N LEU 272.A O no hydrogen 2.864 N/A LEU 256.A N ALA 231.A O no hydrogen 2.853 N/A MET 257.A N LEU 270.A O no hydrogen 2.972 N/A THR 258.A N ALA 229.A O no hydrogen 2.883 N/A THR 258.A OG1 SER 240.A OG no hydrogen 2.631 N/A ILE 260.A N GLY 227.A O no hydrogen 2.935 N/A ARG 263.A N THR 224.A O.A no hydrogen 2.781 N/A ARG 263.A N THR 224.A O.B no hydrogen 2.815 N/A SER 266.A N SER 264.A OG no hydrogen 3.087 N/A SER 266.A OG SER 264.A OG no hydrogen 3.349 N/A LEU 270.A N MET 257.A O no hydrogen 2.963 N/A LEU 272.A N ILE 255.A O no hydrogen 2.820 N/A SER 276.A N PRO 273.A O no hydrogen 3.092 N/A SER 276.A OG PRO 273.A O no hydrogen 2.888 N/A HIS 277.A N ASP 216.A OD1 no hydrogen 2.996 N/A ILE 278.A N VAL 315.A O no hydrogen 3.053 N/A ARG 279.A N PHE 214.A O no hydrogen 2.901 N/A ARG 279.A NH1 GLU 312.A OE2 no hydrogen 2.706 N/A ILE 280.A N ILE 313.A O no hydrogen 2.874 N/A LYS 281.A N ASP 212.A O no hydrogen 2.924 N/A ILE 282.A N ASP 311.A O no hydrogen 2.977 N/A GLY 283.A N ASN 210.A O no hydrogen 2.715 N/A GLN 288.A NE2 LYS 285.A O no hydrogen 2.782 N/A LYS 289.A NZ LEU 208.A O no hydrogen 3.456 N/A SER 293.A N ASP 308.A OD1 no hydrogen 3.025 N/A LYS 296.A N.A HIS 201.A O no hydrogen 2.688 N/A LYS 296.A N.B HIS 201.A O no hydrogen 2.773 N/A LYS 296.A NZ.A ASP 306.A OD1 no hydrogen 3.118 N/A LEU 297.A N GLN 305.A O no hydrogen 2.924 N/A SER 298.A N PHE 199.A O no hydrogen 2.909 N/A VAL 299.A N ILE 302.A O no hydrogen 3.101 N/A ASP 300.A N ASP 197.A O no hydrogen 2.858 N/A ILE 302.A N VAL 299.A O no hydrogen 3.037 N/A GLN 304.A N LEU 297.A O no hydrogen 2.747 N/A GLN 305.A NE2 ASP 306.A O no hydrogen 3.577 N/A LEU 307.A N VAL 295.A O.A no hydrogen 2.676 N/A LEU 307.A N VAL 295.A O.B no hydrogen 2.691 N/A ASP 308.A N ASP 311.A OD2 no hydrogen 2.852 N/A VAL 309.A N VAL 291.A O no hydrogen 3.028 N/A GLY 310.A N ILE 282.A O no hydrogen 2.845 N/A ASP 311.A N ASP 308.A O no hydrogen 3.038 N/A GLU 312.A N LYS 182.A O.A no hydrogen 3.003 N/A GLU 312.A N LYS 182.A O.B no hydrogen 3.105 N/A ILE 313.A N ILE 280.A O no hydrogen 2.903 N/A TYR 314.A N HIS 180.A O no hydrogen 2.765 N/A TYR 314.A OH GLU 312.A OE1 no hydrogen 2.782 N/A VAL 315.A N ILE 278.A O no hydrogen 2.706 N/A ILE 316.A N GLU 178.A O no hydrogen 3.127 N/A ASN 317.A ND2.A THR 175.A OG1.A no hydrogen 2.686 N/A ASN 317.A ND2.B HIS 274.A O no hydrogen 2.960 N/A GLU 318.A N ARG 176.A O no hydrogen 2.930 N/A THR 321.A OG1 ASN 317.A O.A no hydrogen 3.413 N/A THR 321.A OG1 ASN 317.A O.B no hydrogen 3.479 N/A ILE 322.A N SER 275.A O no hydrogen 2.838 N/A THR 327.A N ILE 324.A O no hydrogen 3.142 N/A THR 327.A OG1 ILE 324.A O no hydrogen 2.728 N/A LYS 328.A NZ GLU 318.A OE2 no hydrogen 3.397 N/A ARG 329.A N GLN 134.A OE1 no hydrogen 2.734 N/A ARG 329.A NH1 VAL 135.A O no hydrogen 2.713 N/A GLY 331.A N GLU 318.A OE1 no hydrogen 2.781 N/A ILE 332.A N ARG 174.A O no hydrogen 2.668 N/A CYS 334.A N LEU 172.A O no hydrogen 2.873 N/A VAL 335.A N VAL 138.A O no hydrogen 2.975 N/A ALA 336.A N LYS 170.A O no hydrogen 2.846 N/A LYS 337.A N ASP 341.A OD2 no hydrogen 2.815 N/A THR 338.A N ASP 341.A OD1 no hydrogen 2.903 N/A THR 338.A OG1 ASP 341.A OD1 no hydrogen 2.639 N/A ASN 340.A N THR 338.A OG1 no hydrogen 3.085 N/A ARG 344.A N.A ASN 340.A O no hydrogen 3.312 N/A ARG 344.A N.B ASN 340.A O no hydrogen 3.304 N/A GLY 345.A N ASP 341.A O no hydrogen 2.830 N/A ILE 346.A N TRP 342.A O no hydrogen 3.029 N/A ASN 347.A N ILE 343.A O no hydrogen 3.111 N/A GLU 348.A N ARG 344.A O.A no hydrogen 2.862 N/A GLU 348.A N ARG 344.A O.B no hydrogen 2.801 N/A LEU 349.A N GLY 345.A O no hydrogen 2.874 N/A LEU 350.A N GLY 345.A O no hydrogen 3.371 N/A PHE 352.A N ILE 346.A O no hydrogen 2.953 N/A SER 354.A OG GLY 351.A O no hydrogen 2.671 N/A SER 355.A OG PHE 356.A O no hydrogen 2.671 N/A