Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4q6b_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 3.A N LYS 39.A O no hydrogen 2.838 N/A ILE 5.A N SER 41.A O no hydrogen 3.064 N/A GLY 6.A N ALA 69.A O no hydrogen 2.883 N/A VAL 7.A N VAL 43.A O no hydrogen 2.911 N/A ALA 8.A N ILE 71.A O no hydrogen 2.964 N/A TRP 9.A N ALA 45.A O no hydrogen 3.184 N/A TRP 9.A NE1 ASP 16.A OD2 no hydrogen 2.930 N/A ALA 12.A N ASP 46.A OD2 no hydrogen 2.946 N/A SER 13.A OG PRO 10.A O no hydrogen 3.410 N/A PHE 18.A N ASP 16.A OD1 no hydrogen 3.050 N/A GLU 20.A N GLU 20.A OE2 no hydrogen 2.766 N/A GLY 21.A N LEU 17.A O no hydrogen 3.132 N/A LEU 22.A N PHE 18.A O no hydrogen 3.042 N/A GLU 23.A N ALA 19.A O no hydrogen 2.909 N/A LEU 24.A N GLU 20.A O no hydrogen 2.950 N/A ALA 25.A N GLY 21.A O no hydrogen 3.207 N/A VAL 26.A N LEU 22.A O no hydrogen 3.026 N/A GLN 27.A N.A GLU 23.A O no hydrogen 2.994 N/A GLN 27.A N.B GLU 23.A O no hydrogen 3.008 N/A GLU 28.A N LEU 24.A O no hydrogen 3.081 N/A ILE 29.A N ALA 25.A O no hydrogen 2.907 N/A ASN 30.A N VAL 26.A O no hydrogen 2.916 N/A ASN 30.A ND2 LEU 40.A O no hydrogen 3.013 N/A GLU 31.A N GLN 27.A O.A no hydrogen 2.905 N/A GLU 31.A N GLN 27.A O.B no hydrogen 2.964 N/A GLN 32.A N GLU 28.A O no hydrogen 3.130 N/A GLN 32.A N ILE 29.A O no hydrogen 3.152 N/A GLY 33.A N ASN 30.A O no hydrogen 3.062 N/A GLY 34.A N ILE 29.A O no hydrogen 2.889 N/A VAL 35.A N ARG 38.A O no hydrogen 2.955 N/A GLN 36.A N GLU 278.A OE2 no hydrogen 2.920 N/A GLN 36.A NE2 LEU 277.A O no hydrogen 3.062 N/A GLN 36.A NE2 GLU 278.A O no hydrogen 3.207 N/A GLN 36.A NE2 SER 280.A O no hydrogen 2.771 N/A ARG 38.A N VAL 35.A O no hydrogen 2.832 N/A LYS 39.A N GLU 1.A O no hydrogen 2.950 N/A LEU 40.A N ASN 30.A OD1 no hydrogen 2.868 N/A SER 41.A N ILE 3.A O no hydrogen 2.880 N/A SER 41.A OG GLU 2.A OE1 no hydrogen 2.584 N/A VAL 43.A N ILE 5.A O no hydrogen 2.901 N/A ALA 45.A N VAL 7.A O no hydrogen 2.759 N/A ASP 47.A N TRP 9.A O no hydrogen 3.068 N/A GLU 48.A N ASP 46.A OD1 no hydrogen 2.919 N/A ALA 49.A N ASP 47.A OD1 no hydrogen 2.926 N/A GLU 50.A N ASP 47.A O no hydrogen 2.901 N/A LYS 53.A NZ ASP 46.A O no hydrogen 2.860 N/A LYS 53.A NZ GLU 48.A OE2 no hydrogen 3.064 N/A GLY 54.A N GLU 50.A O no hydrogen 2.872 N/A LEU 55.A N LEU 51.A O no hydrogen 2.925 N/A ALA 56.A N GLU 52.A O no hydrogen 3.176 N/A ILE 57.A N LYS 53.A O no hydrogen 2.956 N/A ALA 58.A N GLY 54.A O no hydrogen 2.943 N/A GLN 59.A N.A LEU 55.A O no hydrogen 3.072 N/A GLN 59.A N.B LEU 55.A O no hydrogen 3.074 N/A ALA 60.A N ALA 56.A O no hydrogen 2.950 N/A PHE 61.A N ILE 57.A O no hydrogen 2.783 N/A ALA 62.A N ALA 58.A O no hydrogen 2.798 N/A ASP 63.A N GLN 59.A O.A no hydrogen 2.924 N/A ASP 63.A N GLN 59.A O.B no hydrogen 2.922 N/A ASN 64.A N PHE 61.A O no hydrogen 3.075 N/A GLY 66.A N ASN 64.A OD1 no hydrogen 2.954 N/A ILE 67.A N ASN 64.A O no hydrogen 3.055 N/A GLN 68.A N PHE 4.A O no hydrogen 2.928 N/A VAL 70.A N VAL 92.A O no hydrogen 2.805 N/A ILE 71.A N GLY 6.A O no hydrogen 2.828 N/A GLY 72.A N LEU 93.A O no hydrogen 2.924 N/A HIS 73.A N SER 79.A OG no hydrogen 2.910 N/A HIS 73.A ND1 ASP 47.A OD2 no hydrogen 2.836 N/A HIS 73.A NE2 TYR 86.A OH no hydrogen 2.929 N/A ILE 78.A N ASN 75.A O no hydrogen 3.073 N/A SER 79.A N ASN 75.A O no hydrogen 2.911 N/A SER 79.A OG ASN 75.A O no hydrogen 3.549 N/A SER 79.A OG SER 97.A OG no hydrogen 2.785 N/A ILE 80.A N SER 76.A O no hydrogen 2.963 N/A ALA 82.A N ILE 78.A O no hydrogen 2.954 N/A ALA 83.A N SER 79.A O no hydrogen 2.758 N/A SER 84.A N PRO 81.A O no hydrogen 2.988 N/A TYR 86.A N ALA 82.A O no hydrogen 3.132 N/A TYR 86.A OH HIS 73.A NE2 no hydrogen 2.929 N/A ASP 87.A N ALA 83.A O no hydrogen 2.748 N/A GLN 88.A N SER 84.A O no hydrogen 2.998 N/A ALA 89.A N ILE 85.A O no hydrogen 3.093 N/A GLY 90.A N ASP 87.A O no hydrogen 3.084 N/A LEU 91.A N TYR 86.A O no hydrogen 3.031 N/A SER 94.A N PHE 111.A O no hydrogen 2.904 N/A SER 94.A OG HIS 73.A O no hydrogen 2.684 N/A SER 94.A OG SER 97.A OG no hydrogen 3.277 N/A ALA 96.A N SER 94.A OG no hydrogen 3.220 N/A SER 97.A N SER 94.A OG no hydrogen 2.974 N/A SER 97.A OG HIS 73.A O no hydrogen 3.204 N/A SER 97.A OG ARG 74.A O no hydrogen 2.778 N/A SER 97.A OG SER 79.A OG no hydrogen 2.785 N/A SER 97.A OG SER 94.A OG no hydrogen 3.277 N/A THR 98.A OG1 ASP 117.A OD1 no hydrogen 2.611 N/A SER 99.A N SER 76.A OG no hydrogen 3.106 N/A ASP 101.A N SER 99.A OG no hydrogen 3.126 N/A LEU 102.A N SER 99.A O no hydrogen 3.170 N/A THR 103.A N PRO 100.A O no hydrogen 3.300 N/A THR 103.A OG1 PRO 100.A O no hydrogen 3.396 N/A THR 103.A OG1 ASP 310.A OD1 no hydrogen 3.137 N/A THR 103.A OG1 ASP 310.A OD2 no hydrogen 2.770 N/A ASP 104.A N ASP 101.A O no hydrogen 3.086 N/A HIS 105.A NE2 ASP 101.A OD2 no hydrogen 2.937 N/A TYR 107.A OH ILE 80.A O no hydrogen 2.888 N/A ILE 108.A N ASP 87.A OD1 no hydrogen 2.711 N/A HIS 109.A N ASP 87.A OD1 no hydrogen 2.908 N/A ARG 112.A N GLY 309.A O no hydrogen 3.231 N/A ARG 112.A NE ASP 310.A OD1 no hydrogen 2.964 N/A ARG 112.A NH1 SER 99.A O no hydrogen 3.040 N/A ARG 112.A NH1 ASP 310.A OD1 no hydrogen 2.777 N/A ARG 112.A NH2 SER 97.A O no hydrogen 2.836 N/A ARG 112.A NH2 SER 99.A O no hydrogen 2.822 N/A ASN 113.A N SER 94.A O no hydrogen 3.111 N/A ASN 113.A ND2 ALA 265.A O no hydrogen 2.988 N/A ASP 117.A N THR 98.A O no hydrogen 2.829 N/A GLN 118.A NE2 TYR 155.A OH no hydrogen 3.051 N/A GLU 119.A N SER 116.A OG no hydrogen 3.323 N/A ILE 120.A N SER 116.A O no hydrogen 3.053 N/A ALA 121.A N ASP 117.A O no hydrogen 2.935 N/A ARG 122.A N.A GLN 118.A O no hydrogen 3.009 N/A ARG 122.A N.B GLN 118.A O no hydrogen 3.007 N/A ARG 122.A NE.A GLU 119.A OE1 no hydrogen 2.909 N/A ARG 122.A NH1.A GLU 119.A OE1 no hydrogen 3.049 N/A ARG 122.A NH1.A GLU 119.A OE2 no hydrogen 3.312 N/A GLN 123.A N GLU 119.A O no hydrogen 3.108 N/A GLN 123.A NE2 GLU 119.A OE2 no hydrogen 2.894 N/A LEU 124.A N ILE 120.A O no hydrogen 2.933 N/A ALA 125.A N ALA 121.A O no hydrogen 2.964 N/A ILE 126.A N ARG 122.A O.A no hydrogen 3.231 N/A ILE 126.A N ARG 122.A O.B no hydrogen 3.217 N/A TYR 127.A N GLN 123.A O no hydrogen 3.122 N/A LEU 128.A N LEU 124.A O no hydrogen 2.866 N/A ALA 129.A N ALA 125.A O no hydrogen 2.970 N/A GLU 130.A N ILE 126.A O no hydrogen 3.155 N/A GLN 131.A N TYR 127.A O no hydrogen 2.950 N/A GLN 131.A NE2 GLU 130.A OE2 no hydrogen 2.681 N/A GLY 132.A N ALA 129.A O no hydrogen 3.007 N/A HIS 133.A N LEU 128.A O no hydrogen 3.077 N/A HIS 133.A ND1 ASP 188.A OD2 no hydrogen 2.969 N/A GLU 134.A N ASP 188.A OD1 no hydrogen 2.826 N/A ARG 135.A N ASP 188.A OD1 no hydrogen 3.121 N/A ARG 135.A NH1 PHE 186.A O no hydrogen 2.686 N/A ILE 137.A N ASP 165.A O no hydrogen 3.033 N/A TYR 138.A N PHE 191.A O no hydrogen 2.952 N/A TYR 139.A N PHE 167.A O no hydrogen 2.921 N/A THR 140.A N ALA 193.A O no hydrogen 3.452 N/A ASP 142.A N THR 140.A O no hydrogen 2.779 N/A GLY 145.A N ASP 142.A OD1 no hydrogen 2.753 N/A ASN 146.A N ASP 142.A O no hydrogen 2.821 N/A GLY 147.A N SER 143.A O no hydrogen 2.835 N/A LEU 148.A N TYR 144.A O no hydrogen 3.081 N/A ALA 149.A N GLY 145.A O no hydrogen 3.043 N/A ASN 150.A N ASN 146.A O no hydrogen 2.858 N/A ALA 151.A N GLY 147.A O no hydrogen 3.054 N/A PHE 152.A N LEU 148.A O no hydrogen 2.903 N/A GLU 153.A N ALA 149.A O no hydrogen 2.877 N/A ASP 154.A N ASN 150.A O no hydrogen 2.993 N/A TYR 155.A N ALA 151.A O no hydrogen 2.983 N/A ALA 156.A N PHE 152.A O no hydrogen 2.742 N/A ARG 157.A N GLU 153.A O no hydrogen 2.906 N/A ARG 157.A NH1 ASP 154.A OD2 no hydrogen 3.206 N/A ALA 158.A N ASP 154.A O no hydrogen 3.309 N/A GLN 159.A N TYR 155.A O no hydrogen 3.239 N/A GLN 159.A N ALA 156.A O no hydrogen 2.924 N/A GLY 160.A N ARG 157.A O no hydrogen 3.054 N/A ILE 161.A N ALA 156.A O no hydrogen 2.955 N/A THR 162.A N GLU 134.A O no hydrogen 2.814 N/A ARG 166.A NH1 ASN 150.A OD1 no hydrogen 3.191 N/A ARG 166.A NH1 GLU 153.A OE1 no hydrogen 2.518 N/A ARG 166.A NH2 ASN 150.A OD1 no hydrogen 3.441 N/A PHE 167.A N ILE 137.A O no hydrogen 2.964 N/A TYR 170.A OH ASP 206.A OD2 no hydrogen 2.466 N/A ASP 175.A N ASN 172.A OD1 no hydrogen 3.178 N/A LEU 176.A N ASN 172.A O no hydrogen 3.213 N/A GLU 177.A N LEU 173.A O no hydrogen 2.862 N/A ARG 178.A N LYS 174.A O no hydrogen 3.033 N/A ARG 178.A NE ASP 175.A OD1 no hydrogen 3.009 N/A ARG 178.A NH2 ASP 175.A OD1 no hydrogen 3.378 N/A ARG 178.A NH2 ASP 175.A OD2 no hydrogen 3.208 N/A LEU 179.A N ASP 175.A O no hydrogen 2.889 N/A TYR 180.A N LEU 176.A O no hydrogen 2.836 N/A ASP 181.A N GLU 177.A O no hydrogen 2.923 N/A LYS 182.A N ARG 178.A O no hydrogen 3.107 N/A LYS 182.A NZ ASP 165.A OD2 no hydrogen 3.134 N/A TRP 183.A N LEU 179.A O no hydrogen 2.785 N/A TRP 183.A NE1 ASP 165.A OD2 no hydrogen 2.816 N/A GLN 184.A N TYR 180.A O no hydrogen 2.834 N/A ALA 185.A N ASP 181.A O no hydrogen 3.177 N/A PHE 186.A N LYS 182.A O no hydrogen 3.114 N/A PHE 186.A N TRP 183.A O no hydrogen 3.142 N/A GLY 187.A N GLN 184.A O no hydrogen 2.973 N/A ILE 190.A N PRO 215.A O no hydrogen 3.005 N/A PHE 191.A N VAL 136.A O no hydrogen 2.858 N/A ILE 192.A N ILE 217.A O no hydrogen 2.748 N/A ALA 193.A N TYR 138.A O no hydrogen 2.742 N/A LYS 194.A NZ TYR 138.A OH no hydrogen 3.522 N/A LYS 194.A NZ TYR 139.A O no hydrogen 3.414 N/A ALA 196.A N SER 221.A OG no hydrogen 3.256 N/A GLY 198.A N THR 195.A O no hydrogen 3.082 N/A GLY 200.A N THR 195.A O no hydrogen 3.007 N/A THR 201.A N ALA 196.A O no hydrogen 3.165 N/A THR 201.A OG1 ALA 196.A O no hydrogen 3.302 N/A THR 201.A OG1 GLU 202.A OE1 no hydrogen 3.414 N/A GLU 202.A N GLU 202.A OE1 no hydrogen 2.784 N/A PHE 203.A N GLY 199.A O no hydrogen 3.366 N/A LEU 204.A N GLY 200.A O no hydrogen 3.126 N/A VAL 205.A N THR 201.A O no hydrogen 3.014 N/A ASP 206.A N GLU 202.A O no hydrogen 2.888 N/A ALA 207.A N PHE 203.A O no hydrogen 2.680 N/A LYS 208.A N LEU 204.A O no hydrogen 3.032 N/A SER 209.A N VAL 205.A O no hydrogen 3.028 N/A SER 209.A OG VAL 205.A O no hydrogen 3.148 N/A VAL 210.A N ASP 206.A O no hydrogen 3.015 N/A GLY 211.A N ALA 207.A O no hydrogen 3.070 N/A ILE 212.A N ALA 207.A O no hydrogen 2.969 N/A GLU 213.A N TYR 180.A OH no hydrogen 3.402 N/A ILE 217.A N ILE 190.A O no hydrogen 2.875 N/A ALA 218.A N LEU 230.A O no hydrogen 2.876 N/A ASN 220.A ND2.B GLY 232.A O no hydrogen 2.965 N/A TRP 222.A N GLY 219.A O no hydrogen 3.198 N/A TRP 222.A NE1 LYS 194.A O no hydrogen 2.971 N/A ASP 223.A N ASN 220.A O.A no hydrogen 3.168 N/A ASP 223.A N ASN 220.A O.B no hydrogen 2.886 N/A LEU 229.A N ALA 226.A O no hydrogen 2.897 N/A LEU 230.A N LEU 216.A O no hydrogen 3.035 N/A VAL 231.A N LYS 319.A O no hydrogen 2.734 N/A GLY 232.A N ALA 218.A O no hydrogen 2.905 N/A SER 233.A N VAL 317.A O no hydrogen 2.984 N/A SER 233.A OG ASP 223.A OD2 no hydrogen 2.499 N/A GLN 238.A N ASN 236.A OD1 no hydrogen 2.775 N/A ARG 239.A N ASN 236.A O no hydrogen 3.115 N/A ARG 239.A NE THR 244.A OG1 no hydrogen 3.062 N/A ARG 239.A NH2 THR 244.A OG1 no hydrogen 3.107 N/A ASP 241.A N ARG 239.A O no hydrogen 2.765 N/A THR 244.A N ASP 241.A OD2 no hydrogen 3.170 N/A THR 244.A OG1 VAL 301.A O no hydrogen 2.762 N/A GLN 245.A N ASP 241.A O no hydrogen 2.899 N/A GLN 245.A NE2 PRO 237.A O no hydrogen 3.002 N/A GLN 245.A NE2 ARG 239.A O no hydrogen 2.930 N/A ASP 246.A N SER 242.A O.A no hydrogen 2.800 N/A ASP 246.A N SER 242.A O.B no hydrogen 2.790 N/A PHE 247.A N ARG 243.A O no hydrogen 3.125 N/A VAL 248.A N THR 244.A O no hydrogen 2.935 N/A GLU 249.A N GLN 245.A O no hydrogen 3.092 N/A ALA 250.A N ASP 246.A O no hydrogen 2.951 N/A PHE 251.A N PHE 247.A O no hydrogen 2.750 N/A ARG 252.A N VAL 248.A O no hydrogen 2.938 N/A ARG 253.A N GLU 249.A O no hydrogen 2.914 N/A GLU 254.A N ALA 250.A O no hydrogen 2.998 N/A TYR 255.A N PHE 251.A O no hydrogen 2.828 N/A TYR 255.A OH GLU 20.A O no hydrogen 3.231 N/A TYR 255.A OH GLU 23.A OE1 no hydrogen 2.622 N/A GLY 256.A N ARG 252.A O no hydrogen 2.809 N/A THR 260.A OG1 ASP 16.A O no hydrogen 2.609 N/A SER 261.A OG ASP 223.A OD2 no hydrogen 3.479 N/A ALA 263.A N THR 260.A OG1 no hydrogen 3.037 N/A ALA 264.A N THR 260.A O no hydrogen 3.046 N/A ALA 265.A N SER 261.A O no hydrogen 2.922 N/A GLY 266.A N TYR 262.A O no hydrogen 2.824 N/A TYR 267.A N ALA 263.A O no hydrogen 2.921 N/A ASP 268.A N ALA 264.A O no hydrogen 2.928 N/A ALA 269.A N ALA 265.A O no hydrogen 2.938 N/A VAL 270.A N GLY 266.A O no hydrogen 3.103 N/A ILE 271.A N TYR 267.A O no hydrogen 2.981 N/A LEU 272.A N.A ASP 268.A O no hydrogen 2.811 N/A LEU 272.A N.B ASP 268.A O no hydrogen 2.792 N/A LEU 273.A N ALA 269.A O no hydrogen 2.971 N/A ALA 274.A N VAL 270.A O no hydrogen 2.923 N/A GLU 275.A N ILE 271.A O no hydrogen 2.986 N/A ALA 276.A N LEU 272.A O.A no hydrogen 3.015 N/A ALA 276.A N LEU 272.A O.B no hydrogen 2.999 N/A LEU 277.A N LEU 273.A O no hydrogen 2.759 N/A GLU 278.A N ALA 274.A O no hydrogen 2.928 N/A LYS 279.A N ALA 276.A O no hydrogen 3.151 N/A SER 280.A N LEU 277.A O no hydrogen 3.036 N/A SER 280.A OG LEU 277.A O no hydrogen 3.071 N/A THR 283.A N ASP 281.A OD2 no hydrogen 2.975 N/A THR 283.A OG1 ASP 281.A OD1 no hydrogen 3.168 N/A THR 283.A OG1 ASP 281.A OD2 no hydrogen 2.875 N/A THR 283.A OG1 HIS 284.A ND1 no hydrogen 2.995 N/A HIS 284.A N ASP 281.A O no hydrogen 3.009 N/A HIS 284.A ND1 ASP 281.A OD1 no hydrogen 2.792 N/A THR 287.A N HIS 284.A O no hydrogen 2.989 N/A THR 287.A OG1 HIS 284.A O no hydrogen 2.721 N/A LEU 288.A N PRO 285.A O no hydrogen 3.182 N/A GLN 290.A NE2 ASP 294.A OD2 no hydrogen 3.293 N/A LEU 292.A N LEU 288.A O no hydrogen 2.860 N/A ARG 293.A N ALA 289.A O no hydrogen 3.127 N/A ARG 293.A NE ASP 306.A O no hydrogen 2.975 N/A ARG 293.A NH1 ILE 108.A O no hydrogen 2.879 N/A ARG 293.A NH2 ILE 108.A O no hydrogen 3.515 N/A ASP 294.A N GLN 290.A O no hydrogen 2.904 N/A LEU 295.A N LEU 292.A O no hydrogen 3.299 N/A GLY 296.A N ARG 293.A O no hydrogen 3.140 N/A TRP 298.A N HIS 303.A O no hydrogen 2.812 N/A TRP 298.A NE1 GLU 275.A OE2 no hydrogen 2.887 N/A GLY 300.A N GLY 302.A O no hydrogen 2.910 N/A VAL 301.A N ASP 268.A OD1 no hydrogen 2.784 N/A HIS 303.A ND1 ASP 311.A OD2 no hydrogen 2.605 N/A HIS 303.A NE2 ASP 268.A OD2 no hydrogen 2.778 N/A ARG 304.A N ASP 311.A OD1 no hydrogen 2.792 N/A ASP 306.A N ASP 310.A O no hydrogen 2.961 N/A ARG 308.A N.A ASP 306.A OD1 no hydrogen 2.965 N/A ARG 308.A N.B ASP 306.A OD1 no hydrogen 2.962 N/A ARG 308.A NH1.A ASP 104.A OD1 no hydrogen 2.757 N/A ARG 308.A NH2.A ASP 104.A OD1 no hydrogen 3.042 N/A ARG 308.A NH2.A ASP 310.A OD2 no hydrogen 3.177 N/A GLY 309.A N ASP 306.A O no hydrogen 3.092 N/A ASP 310.A N ASP 306.A OD1 no hydrogen 3.046 N/A ILE 312.A N ARG 304.A O no hydrogen 2.719 N/A GLY 313.A N ASP 311.A OD1 no hydrogen 3.204 N/A VAL 317.A N SER 233.A O no hydrogen 2.807 N/A LYS 319.A N VAL 231.A O no hydrogen 2.920 N/A LYS 319.A NZ ASP 223.A OD2 no hydrogen 2.745 N/A LYS 319.A NZ PHE 234.A O no hydrogen 2.956 N/A LYS 319.A NZ PHE 235.A O no hydrogen 2.997 N/A LYS 320.A N GLU 326.A O no hydrogen 2.975 N/A LYS 320.A NZ GLY 228.A O no hydrogen 2.762 N/A ASP 322.A N GLU 227.A OE1 no hydrogen 2.858 N/A ASP 322.A N GLU 227.A OE2 no hydrogen 3.267 N/A ARG 324.A N LYS 321.A O no hydrogen 3.061 N/A GLU 326.A N LYS 320.A O no hydrogen 2.742 N/A LEU 328.A N LEU 318.A O no hydrogen 3.065 N/A