Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1lee_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 1.A N GLU 152.A OE2 no hydrogen 3.234 N/A ASN 5.A ND2 GLU 176.A OE1 no hydrogen 2.966 N/A ASP 6.A N ILE 172.A O no hydrogen 3.022 N/A ILE 8.A N LEU 170.A O no hydrogen 2.955 N/A LEU 10.A N GLY 168.A O no hydrogen 3.060 N/A VAL 11.A N TYR 19.A O no hydrogen 2.728 N/A PHE 13.A N MET 17.A O no hydrogen 2.583 N/A ASN 15.A N ASP 12.A OD2 no hydrogen 2.802 N/A ILE 16.A N PHE 13.A O no hydrogen 2.866 N/A MET 17.A N PHE 13.A O no hydrogen 2.992 N/A TYR 19.A N VAL 11.A O no hydrogen 2.600 N/A GLY 20.A N PHE 33.A O no hydrogen 3.120 N/A ALA 22.A N PHE 31.A O no hydrogen 3.249 N/A GLU 23.A N THR 94.A O no hydrogen 3.032 N/A VAL 24.A N GLN 29.A O no hydrogen 3.011 N/A GLY 25.A N LEU 92.A O no hydrogen 2.668 N/A ASP 26.A N SER 65.A OG no hydrogen 3.174 N/A GLN 28.A N GLY 25.A O no hydrogen 2.711 N/A GLN 29.A N VAL 24.A O no hydrogen 2.902 N/A GLN 29.A NE2 ASN 27.A OD1 GLN 29.A HE21 2.855 1.897 GLN 29.A NE2 ASP 61.A O GLN 29.A HE22 3.124 2.142 PHE 31.A N ALA 22.A O no hydrogen 3.156 N/A THR 32.A N ASP 123.A OD2 no hydrogen 2.861 N/A THR 32.A OG1 ASP 21.A OD1 no hydrogen 3.104 N/A PHE 33.A N GLY 20.A O no hydrogen 2.787 N/A ILE 34.A N GLY 124.A O no hydrogen 3.046 N/A ASP 36.A N LEU 126.A O no hydrogen 2.744 N/A THR 37.A N SER 217.A OG no hydrogen 2.772 N/A THR 37.A OG1 VAL 215.A O no hydrogen 2.730 N/A THR 37.A OG1 SER 217.A OG no hydrogen 3.334 N/A GLY 38.A N ASP 36.A OD2 no hydrogen 3.073 N/A SER 39.A N ASP 36.A O no hydrogen 3.365 N/A SER 39.A OG ASP 36.A OD1 no hydrogen 2.442 N/A ASN 41.A ND2 ILE 135.A O no hydrogen 2.833 N/A TRP 43.A N ILE 125.A O no hydrogen 3.058 N/A VAL 44.A N ILE 105.A O no hydrogen 2.929 N/A SER 46.A N VAL 107.A O no hydrogen 2.899 N/A SER 46.A OG GLU 106.A OE2 no hydrogen 2.810 N/A VAL 47.A N TYR 60.A O no hydrogen 2.883 N/A LYS 48.A N SER 46.A OG no hydrogen 2.979 N/A CYS 49.A N SER 46.A O no hydrogen 3.011 N/A CYS 49.A SG THR 51.A OG1 no hydrogen 3.297 N/A CYS 49.A SG ILE 108.A O no hydrogen 3.256 N/A THR 51.A OG1 THR 110.A OG1 no hydrogen 2.673 N/A GLY 53.A N GLU 114.A OE2 no hydrogen 2.743 N/A CYS 54.A SG THR 51.A OG1 no hydrogen 3.595 N/A LEU 55.A N ALA 52.A O no hydrogen 3.231 N/A LYS 57.A N CYS 54.A O no hydrogen 3.388 N/A LYS 57.A NZ TYR 117.A O no hydrogen 2.847 N/A LYS 57.A NZ SER 120.A O no hydrogen 2.661 N/A LYS 57.A NZ PHE 122.A O no hydrogen 3.028 N/A HIS 58.A N ASP 123.A OD1 no hydrogen 2.829 N/A TYR 60.A N PRO 45.A O no hydrogen 2.892 N/A TYR 60.A OH ASP 91.A OD1 no hydrogen 2.558 N/A ASP 61.A N GLN 29.A OE1 no hydrogen 3.102 N/A SER 63.A N ASP 61.A OD1 no hydrogen 3.077 N/A SER 63.A OG ASP 61.A OD1 no hydrogen 2.731 N/A SER 63.A OG ASP 61.A OD2 no hydrogen 3.567 N/A LYS 64.A N ASP 61.A O no hydrogen 3.201 N/A SER 65.A OG THR 67.A OG1 no hydrogen 3.405 N/A SER 65.A OG ASP 91.A OD1 no hydrogen 2.578 N/A SER 65.A OG ASP 91.A OD2 no hydrogen 2.780 N/A ARG 66.A N ASP 26.A OD2 no hydrogen 3.117 N/A THR 67.A OG1 SER 65.A OG no hydrogen 3.405 N/A THR 67.A OG1 ASP 91.A OD2 no hydrogen 2.930 N/A TYR 68.A N SER 65.A O no hydrogen 3.320 N/A GLU 69.A N LYS 90.A O no hydrogen 2.631 N/A GLY 72.A N PHE 88.A O no hydrogen 2.721 N/A THR 73.A N ASP 71.A OD2 no hydrogen 3.028 N/A THR 73.A OG1 ASP 71.A OD2 no hydrogen 2.866 N/A VAL 75.A N GLY 86.A O no hydrogen 3.022 N/A MET 77.A N VAL 84.A O no hydrogen 2.634 N/A ASN 78.A ND2 THR 83.A OG1 no hydrogen 2.644 N/A TYR 79.A N GLY 82.A O no hydrogen 2.911 N/A GLY 82.A N TYR 79.A O no hydrogen 3.379 N/A THR 83.A N GLY 112.A O no hydrogen 2.677 N/A VAL 84.A N MET 77.A O no hydrogen 3.041 N/A SER 85.A N ASP 109.A O no hydrogen 2.824 N/A SER 85.A OG VAL 75.A O no hydrogen 3.197 N/A GLY 86.A N VAL 75.A O no hydrogen 2.842 N/A PHE 87.A N GLU 106.A O no hydrogen 2.782 N/A PHE 88.A N THR 73.A O no hydrogen 2.700 N/A SER 89.A N PHE 104.A O no hydrogen 3.037 N/A SER 89.A OG GLU 106.A OE1 no hydrogen 2.760 N/A LYS 90.A N GLU 69.A O no hydrogen 2.949 N/A ASP 91.A N TYR 102.A O no hydrogen 3.068 N/A LEU 92.A N ASP 91.A OD2 no hydrogen 2.614 N/A VAL 93.A N LEU 100.A O no hydrogen 3.010 N/A THR 94.A N GLU 23.A O no hydrogen 2.805 N/A THR 94.A OG1 GLN 28.A OE1 no hydrogen 2.860 N/A THR 94.A OG1 SER 99.A OG no hydrogen 2.911 N/A VAL 95.A N LEU 98.A O no hydrogen 2.784 N/A ASN 97.A N ASP 6.A OD1 no hydrogen 2.813 N/A LEU 98.A N VAL 95.A O no hydrogen 3.180 N/A SER 99.A OG THR 94.A OG1 no hydrogen 2.911 N/A LEU 100.A N VAL 93.A O no hydrogen 3.159 N/A TYR 102.A N ASP 91.A O no hydrogen 2.849 N/A TYR 102.A OH ASP 139.A O no hydrogen 2.638 N/A PHE 104.A N SER 89.A O no hydrogen 2.985 N/A ILE 105.A N LEU 42.A O no hydrogen 2.819 N/A GLU 106.A N PHE 87.A O no hydrogen 2.934 N/A VAL 107.A N VAL 44.A O no hydrogen 2.976 N/A ILE 108.A N SER 85.A O no hydrogen 2.865 N/A ASP 109.A N SER 85.A O no hydrogen 3.112 N/A THR 110.A OG1 THR 51.A OG1 no hydrogen 2.673 N/A THR 110.A OG1 GLU 114.A OE2 no hydrogen 2.767 N/A ASN 111.A N ASP 109.A OD2 no hydrogen 2.782 N/A PHE 113.A N THR 110.A O no hydrogen 2.908 N/A GLU 114.A N ASN 111.A O no hydrogen 3.369 N/A TYR 117.A N PHE 113.A O no hydrogen 2.668 N/A TYR 117.A OH ASP 123.A O no hydrogen 2.662 N/A ALA 119.A N PRO 115.A O no hydrogen 3.095 N/A ALA 119.A N THR 116.A O no hydrogen 2.954 N/A SER 120.A N TYR 117.A O no hydrogen 3.097 N/A SER 120.A OG THR 116.A O no hydrogen 2.723 N/A ASP 123.A N THR 32.A O no hydrogen 2.574 N/A GLY 124.A N THR 32.A O no hydrogen 3.090 N/A LEU 126.A N ILE 34.A O no hydrogen 2.909 N/A GLY 127.A N ASN 41.A O no hydrogen 2.966 N/A LEU 128.A N ASP 36.A O no hydrogen 2.927 N/A GLY 129.A N SER 39.A O no hydrogen 2.983 N/A TRP 130.A N LEU 193.A O no hydrogen 2.910 N/A LYS 131.A NZ SER 137.A O no hydrogen 2.853 N/A LYS 131.A NZ ASP 139.A OD1 no hydrogen 2.962 N/A LEU 133.A N TRP 130.A O no hydrogen 2.867 N/A SER 134.A N LYS 131.A O no hydrogen 3.011 N/A SER 134.A OG LYS 131.A O no hydrogen 2.721 N/A ILE 135.A N ASN 41.A OD1 no hydrogen 2.853 N/A VAL 138.A N SER 134.A OG no hydrogen 3.026 N/A GLU 144.A N PRO 140.A O no hydrogen 3.188 N/A LEU 145.A N ILE 141.A O no hydrogen 3.004 N/A LYS 146.A N VAL 142.A O no hydrogen 3.165 N/A LYS 146.A NZ GLU 152.A O no hydrogen 2.839 N/A ASN 147.A N VAL 143.A O no hydrogen 2.957 N/A GLN 148.A N GLU 144.A O no hydrogen 2.852 N/A ASN 149.A N LYS 146.A O no hydrogen 3.100 N/A LYS 150.A N LEU 145.A O no hydrogen 2.878 N/A LYS 150.A NZ GLN 148.A OE1 no hydrogen 2.504 N/A ASN 153.A N GLY 173.A O no hydrogen 3.182 N/A ASN 153.A ND2 GLY 173.A O no hydrogen 3.199 N/A ALA 154.A N ASP 318.A OD1 no hydrogen 2.792 N/A PHE 156.A N PHE 315.A O no hydrogen 2.863 N/A THR 157.A N THR 171.A O no hydrogen 2.792 N/A PHE 158.A N THR 313.A O no hydrogen 3.065 N/A TYR 159.A N PHE 169.A O no hydrogen 2.811 N/A TYR 159.A OH LYS 328.A O no hydrogen 2.564 N/A VAL 162.A N HIS 166.A O no hydrogen 2.951 N/A LYS 165.A N VAL 162.A O no hydrogen 2.833 N/A LYS 165.A NZ LYS 329.A O no hydrogen 2.795 N/A HIS 166.A N VAL 162.A O no hydrogen 3.025 N/A PHE 169.A N TYR 159.A O no hydrogen 2.728 N/A LEU 170.A N ILE 8.A O no hydrogen 2.848 N/A THR 171.A N THR 157.A O no hydrogen 2.930 N/A ILE 172.A N ASP 6.A O no hydrogen 2.945 N/A GLY 173.A N LEU 155.A O no hydrogen 2.922 N/A ARG 178.A NH1 GLU 176.A OE2 no hydrogen 3.225 N/A PHE 179.A N GLU 176.A O no hydrogen 3.309 N/A TYR 180.A N GLU 177.A O no hydrogen 3.253 N/A GLU 181.A N LEU 326.A O no hydrogen 2.845 N/A THR 185.A N ILE 324.A O no hydrogen 3.008 N/A GLU 187.A N VAL 322.A O no hydrogen 2.761 N/A LYS 188.A NZ GLU 187.A OE2 no hydrogen 2.758 N/A LEU 189.A N HIS 320.A O no hydrogen 2.725 N/A ASN 190.A N GLN 196.A O no hydrogen 2.836 N/A ASN 190.A ND2 HIS 191.A ND1 no hydrogen 3.031 N/A ASN 190.A ND2 GLN 196.A OE1 no hydrogen 3.054 N/A TRP 195.A NE1 LEU 128.A O no hydrogen 2.727 N/A ILE 197.A N CYS 213.A O no hydrogen 2.988 N/A THR 198.A OG1 ASN 190.A OD1 no hydrogen 3.137 N/A LEU 199.A N ALA 211.A O no hydrogen 3.060 N/A ASP 200.A N THR 262.A O no hydrogen 2.863 N/A ALA 201.A N LEU 208.A O no hydrogen 2.730 N/A HIS 202.A N GLU 260.A O no hydrogen 2.757 N/A VAL 203.A N ILE 206.A O no hydrogen 3.095 N/A ILE 206.A N VAL 203.A O no hydrogen 3.193 N/A LEU 208.A N ALA 201.A O no hydrogen 2.793 N/A LYS 210.A N ASP 200.A OD1 no hydrogen 2.745 N/A LYS 210.A NZ GLU 209.A OE1 no hydrogen 2.822 N/A ALA 211.A N LEU 199.A O no hydrogen 2.753 N/A ASN 212.A N PRO 299.A O no hydrogen 3.161 N/A ASN 212.A ND2 THR 300.A OG1 no hydrogen 3.206 N/A CYS 213.A N ILE 197.A O no hydrogen 2.862 N/A CYS 213.A SG ALA 211.A O no hydrogen 3.758 N/A ILE 214.A N PHE 301.A O no hydrogen 2.913 N/A VAL 215.A N TRP 195.A O no hydrogen 2.929 N/A ASP 216.A N LEU 303.A O no hydrogen 3.112 N/A SER 217.A N THR 37.A OG1 no hydrogen 2.806 N/A SER 217.A OG LEU 35.A O no hydrogen 2.780 N/A SER 217.A OG THR 37.A OG1 no hydrogen 3.334 N/A GLY 218.A N ASP 216.A OD2 no hydrogen 2.901 N/A THR 219.A N ASP 216.A O no hydrogen 3.360 N/A THR 219.A OG1 ASP 216.A OD1 no hydrogen 2.892 N/A ILE 222.A N ASN 290.A O no hydrogen 2.946 N/A THR 223.A N ILE 302.A O no hydrogen 3.150 N/A VAL 224.A N ILE 292.A O no hydrogen 2.953 N/A THR 226.A N ASP 295.A OD2 no hydrogen 2.844 N/A THR 226.A OG1 ASP 295.A OD1 no hydrogen 2.691 N/A THR 226.A OG1 ASP 295.A OD2 no hydrogen 3.306 N/A LEU 229.A N PRO 225.A O no hydrogen 3.044 N/A ASN 230.A N THR 226.A O no hydrogen 2.611 N/A LYS 231.A N ASP 227.A O no hydrogen 2.966 N/A MET 232.A N PHE 228.A O no hydrogen 3.065 N/A LEU 233.A N LEU 229.A O no hydrogen 3.033 N/A LEU 236.A N LEU 233.A O no hydrogen 3.057 N/A VAL 238.A N LEU 236.A O no hydrogen 2.743 N/A ILE 239.A N VAL 248.A O no hydrogen 2.974 N/A VAL 241.A N PHE 246.A O no hydrogen 2.841 N/A VAL 248.A N ILE 239.A O no hydrogen 2.830 N/A THR 249.A N CYS 287.A O no hydrogen 2.814 N/A THR 249.A OG1 ASP 237.A O no hydrogen 3.378 N/A THR 249.A OG1 LEU 250.A O no hydrogen 3.398 N/A THR 249.A OG1 ASN 253.A OD1 no hydrogen 3.254 N/A CYS 251.A N GLY 285.A O no hydrogen 2.918 N/A ASN 253.A N LEU 250.A O no hydrogen 3.030 N/A LYS 255.A NZ ASN 235.A O no hydrogen 2.898 N/A LYS 255.A NZ ASP 237.A OD1 no hydrogen 3.316 N/A LEU 256.A N ASN 253.A O no hydrogen 3.403 N/A PHE 259.A N LEU 270.A O no hydrogen 2.920 N/A GLU 260.A N HIS 202.A O no hydrogen 2.837 N/A PHE 261.A N TYR 268.A O no hydrogen 2.698 N/A THR 262.A N ASP 200.A O no hydrogen 3.049 N/A SER 263.A N GLY 266.A O no hydrogen 3.057 N/A SER 263.A OG GLU 187.A OE1 no hydrogen 2.643 N/A SER 263.A OG GLU 187.A OE2 no hydrogen 3.097 N/A SER 263.A OG GLY 266.A O no hydrogen 3.408 N/A ASN 265.A N SER 263.A OG no hydrogen 2.942 N/A ASN 265.A ND2 TYR 186.A O no hydrogen 3.112 N/A GLY 266.A N SER 263.A OG no hydrogen 2.940 N/A LYS 267.A NZ GLU 260.A OE1 no hydrogen 2.949 N/A LYS 267.A NZ GLU 260.A OE2 no hydrogen 2.913 N/A TYR 268.A N PHE 261.A O no hydrogen 2.631 N/A TYR 268.A OH GLU 187.A OE1 no hydrogen 2.537 N/A THR 269.A N TYR 311.A OH no hydrogen 3.087 N/A THR 269.A OG1 GLU 271.A OE1 no hydrogen 2.403 N/A LEU 270.A N PHE 259.A O no hydrogen 2.891 N/A TYR 274.A N GLU 271.A O no hydrogen 3.021 N/A TYR 275.A N PRO 272.A O no hydrogen 3.046 N/A TYR 275.A OH PRO 257.A O no hydrogen 2.680 N/A LEU 276.A N PRO 272.A O no hydrogen 2.995 N/A GLN 277.A N MET 288.A O no hydrogen 2.745 N/A HIS 278.A ND1 LEU 286.A O no hydrogen 2.587 N/A CYS 287.A N THR 249.A O no hydrogen 2.553 N/A CYS 287.A SG GLN 277.A O no hydrogen 3.252 N/A MET 288.A N GLN 277.A O no hydrogen 2.763 N/A LEU 289.A N TYR 247.A O no hydrogen 2.761 N/A ASN 290.A N TYR 275.A O no hydrogen 2.701 N/A ASN 290.A ND2 SER 220.A O no hydrogen 3.140 N/A ILE 292.A N ILE 222.A O no hydrogen 3.058 N/A LEU 294.A N VAL 224.A O no hydrogen 2.563 N/A THR 300.A OG1 VAL 298.A O no hydrogen 2.625 N/A PHE 301.A N ASN 212.A O no hydrogen 2.977 N/A ILE 302.A N THR 223.A O no hydrogen 3.191 N/A ILE 302.A N THR 223.A OG1 no hydrogen 3.175 N/A LEU 303.A N ILE 214.A O no hydrogen 2.657 N/A ASP 305.A N THR 219.A O no hydrogen 2.670 N/A PHE 307.A N GLY 304.A O no hydrogen 2.837 N/A MET 308.A N GLY 304.A O no hydrogen 3.268 N/A ARG 309.A N ASP 305.A O no hydrogen 2.859 N/A LYS 310.A N PHE 307.A O no hydrogen 3.068 N/A LYS 310.A NZ THR 269.A O no hydrogen 3.035 N/A LYS 310.A NZ GLU 271.A OE1 no hydrogen 3.411 N/A LYS 310.A NZ GLU 271.A OE2 no hydrogen 2.686 N/A LYS 310.A NZ TYR 311.A OH no hydrogen 3.385 N/A TYR 311.A N PHE 307.A O no hydrogen 2.853 N/A PHE 312.A N ALA 325.A O no hydrogen 2.730 N/A THR 313.A N PHE 158.A O no hydrogen 3.457 N/A VAL 314.A N GLY 323.A O no hydrogen 2.724 N/A PHE 315.A N PHE 156.A O no hydrogen 2.740 N/A ASP 316.A N SER 321.A O no hydrogen 3.163 N/A TYR 317.A N ALA 154.A O no hydrogen 2.766 N/A TYR 317.A OH GLY 129.A O no hydrogen 2.937 N/A ASP 318.A N ALA 154.A O no hydrogen 3.356 N/A ASN 319.A N ASP 316.A OD1 no hydrogen 2.677 N/A HIS 320.A ND1 ASP 192.A OD1 no hydrogen 2.726 N/A SER 321.A N ASP 316.A O no hydrogen 3.390 N/A VAL 322.A N GLU 187.A O no hydrogen 2.733 N/A GLY 323.A N VAL 314.A O no hydrogen 2.849 N/A ILE 324.A N THR 185.A O no hydrogen 2.837 N/A ALA 325.A N PHE 312.A O no hydrogen 3.030 N/A ALA 327.A N LYS 310.A O no hydrogen 3.034 N/A LYS 328.A N PHE 179.A O no hydrogen 2.782 N/A LYS 328.A NZ ASN 330.A O no hydrogen 3.372 N/A LEU 331.A N ASN 330.A OD1 no hydrogen 2.961 N/A