Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4e9w_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 1.A N ASP 42.A OD1 no hydrogen 2.904 N/A ARG 3.A N ASP 43.A O no hydrogen 2.733 N/A ARG 3.A NE ASP 42.A OD2 no hydrogen 2.724 N/A PHE 5.A N ILE 45.A O no hydrogen 2.756 N/A MET 7.A N ASN 47.A O no hydrogen 2.822 N/A THR 8.A N ASN 28.A OD1 no hydrogen 2.851 N/A THR 8.A OG1 GLU 10.A OE2 no hydrogen 2.682 N/A ILE 9.A N THR 49.A O no hydrogen 2.916 N/A GLU 10.A N GLY 26.A O no hydrogen 3.007 N/A VAL 12.A N VAL 24.A O no hydrogen 3.326 N/A THR 13.A N GLU 315.A O no hydrogen 2.842 N/A ILE 14.A N TYR 22.A O no hydrogen 2.875 N/A LYS 15.A NZ ASP 21.A OD1 no hydrogen 2.675 N/A VAL 16.A N LEU 20.A O no hydrogen 2.825 N/A ALA 17.A N LEU 20.A O no hydrogen 3.379 N/A LEU 20.A N ALA 17.A O no hydrogen 2.770 N/A TYR 22.A N ILE 14.A O no hydrogen 2.803 N/A TYR 22.A OH GLU 147.A O no hydrogen 2.745 N/A LYS 23.A N ALA 151.A O no hydrogen 2.898 N/A LYS 23.A NZ ASP 152.A OD1 no hydrogen 2.492 N/A VAL 24.A N VAL 12.A O no hydrogen 2.928 N/A PHE 25.A N ARG 115.A O no hydrogen 2.895 N/A GLY 26.A N GLU 10.A O no hydrogen 2.883 N/A ASN 28.A N THR 8.A O no hydrogen 2.801 N/A ASN 28.A ND2 ASP 308.A OD1 no hydrogen 2.900 N/A GLY 29.A N GLY 26.A O no hydrogen 2.886 N/A GLN 30.A N PHE 27.A O no hydrogen 3.037 N/A GLN 30.A NE2 PRO 32.A O no hydrogen 2.886 N/A VAL 31.A N PHE 312.A O no hydrogen 2.968 N/A GLY 33.A N TRP 118.A O no hydrogen 2.807 N/A LEU 35.A N PHE 307.A O no hydrogen 2.909 N/A ILE 36.A N PRO 120.A O no hydrogen 3.130 N/A HIS 37.A N GLY 305.A O no hydrogen 2.857 N/A HIS 37.A NE2 ASP 124.A OD1 no hydrogen 2.682 N/A VAL 38.A N ILE 122.A O no hydrogen 2.933 N/A GLN 39.A N ASP 42.A OD2 no hydrogen 2.868 N/A GLU 40.A N ASP 124.A O no hydrogen 2.914 N/A GLY 41.A N ALA 94.A O no hydrogen 2.857 N/A ASP 42.A N GLN 39.A O no hydrogen 2.876 N/A ASP 43.A N ALA 1.A O no hydrogen 2.915 N/A VAL 44.A N PHE 92.A O no hydrogen 2.866 N/A ILE 45.A N ARG 3.A O no hydrogen 2.809 N/A VAL 46.A N TYR 90.A O no hydrogen 2.917 N/A ASN 47.A N PHE 5.A O no hydrogen 2.881 N/A ASN 47.A ND2 GLU 4.A OE2 no hydrogen 2.823 N/A ASN 47.A ND2 ASP 6.A OD1 no hydrogen 2.850 N/A VAL 48.A N TYR 88.A O no hydrogen 2.773 N/A THR 49.A N MET 7.A O no hydrogen 2.984 N/A THR 49.A OG1 SER 87.A OG no hydrogen 2.737 N/A ASN 50.A N ASP 86.A O no hydrogen 2.850 N/A ASN 50.A ND2 LEU 54.A O no hydrogen 2.810 N/A ASN 50.A ND2 ILE 82.A O no hydrogen 2.969 N/A ASN 51.A N ILE 9.A O no hydrogen 2.822 N/A ASN 51.A ND2 GLU 10.A OE2 no hydrogen 2.874 N/A THR 52.A N ASN 50.A OD1 no hydrogen 2.916 N/A THR 52.A OG1 ASN 50.A OD1 no hydrogen 2.851 N/A THR 52.A OG1 HIS 56.A NE2 no hydrogen 2.861 N/A SER 53.A N GLU 11.A OE2 no hydrogen 2.802 N/A SER 53.A OG GLU 11.A OE2 no hydrogen 2.599 N/A LEU 54.A N THR 52.A OG1 no hydrogen 3.251 N/A HIS 56.A N ILE 82.A O no hydrogen 3.048 N/A HIS 56.A NE2 THR 52.A OG1 no hydrogen 2.861 N/A THR 57.A OG1 GLY 73.A O no hydrogen 2.694 N/A ILE 58.A N TYR 90.A OH no hydrogen 3.002 N/A HIS 59.A N HIS 103.A O no hydrogen 2.868 N/A HIS 59.A ND1 ASP 72.A O no hydrogen 2.860 N/A HIS 61.A N TRP 101.A O no hydrogen 2.772 N/A VAL 63.A N TRP 60.A O no hydrogen 3.145 N/A THR 68.A N GLN 65.A O no hydrogen 2.890 N/A THR 68.A OG1 GLN 65.A OE1 no hydrogen 2.642 N/A SER 71.A N THR 68.A O no hydrogen 2.857 N/A SER 71.A OG LYS 91.A O no hydrogen 3.341 N/A ASP 72.A N TRP 69.A O no hydrogen 2.942 N/A VAL 74.A N THR 78.A OG1 no hydrogen 3.043 N/A GLY 76.A N GLN 79.A O no hydrogen 2.925 N/A VAL 77.A N VAL 74.A O no hydrogen 3.102 N/A THR 78.A N VAL 74.A O no hydrogen 2.816 N/A THR 78.A OG1 VAL 74.A O no hydrogen 3.530 N/A GLN 79.A N VAL 74.A O no hydrogen 3.253 N/A GLN 79.A NE2 GLN 80.A O no hydrogen 2.890 N/A ILE 82.A N HIS 56.A O no hydrogen 2.696 N/A GLY 85.A N ASN 50.A O no hydrogen 2.757 N/A ASP 86.A N GLU 83.A O no hydrogen 2.899 N/A SER 87.A OG THR 49.A OG1 no hydrogen 2.737 N/A TYR 88.A N VAL 48.A O no hydrogen 2.873 N/A TYR 88.A OH ARG 70.A O no hydrogen 3.135 N/A THR 89.A OG1 ASN 47.A OD1 no hydrogen 2.702 N/A TYR 90.A N VAL 46.A O no hydrogen 2.838 N/A TYR 90.A OH GLN 79.A OE1 no hydrogen 2.708 N/A LYS 91.A N SER 71.A OG no hydrogen 3.130 N/A PHE 92.A N VAL 44.A O no hydrogen 3.111 N/A LYS 93.A NZ GLY 41.A O no hydrogen 3.229 N/A LYS 93.A NZ ASP 43.A OD1 no hydrogen 3.213 N/A ALA 94.A N ASP 42.A O no hydrogen 2.739 N/A ARG 96.A NH1 ILE 97.A O no hydrogen 2.811 N/A ARG 96.A NH1 ASP 215.A O no hydrogen 2.806 N/A ARG 96.A NH2 ASP 215.A O no hydrogen 2.854 N/A GLY 98.A N VAL 123.A O no hydrogen 2.973 N/A THR 99.A OG1 ASP 237.A OD1 no hydrogen 2.639 N/A THR 99.A OG1 ASP 237.A OD2 no hydrogen 3.059 N/A LEU 100.A N LEU 121.A O no hydrogen 2.760 N/A TRP 101.A N HIS 61.A O no hydrogen 3.272 N/A TYR 102.A N GLY 119.A O no hydrogen 2.873 N/A TYR 102.A OH PRO 34.A O no hydrogen 2.659 N/A HIS 103.A N HIS 59.A O no hydrogen 2.962 N/A HIS 103.A ND1 CYS 104.A O no hydrogen 2.799 N/A CYS 104.A N MET 117.A O no hydrogen 3.072 N/A CYS 104.A SG HIS 56.A ND1 no hydrogen 3.806 N/A CYS 104.A SG THR 57.A O no hydrogen 3.611 N/A CYS 104.A SG VAL 106.A O no hydrogen 3.550 N/A CYS 104.A SG HIS 111.A ND1 no hydrogen 3.809 N/A HIS 105.A N THR 57.A OG1 no hydrogen 3.127 N/A HIS 105.A ND1 HIS 105.A O no hydrogen 3.048 N/A ASN 109.A ND2 GLY 157.A O no hydrogen 3.296 N/A ASN 109.A ND2 GLY 158.A O no hydrogen 3.328 N/A GLU 110.A N ASN 107.A O no hydrogen 2.945 N/A HIS 111.A N ASN 107.A O no hydrogen 2.816 N/A VAL 112.A N VAL 108.A O no hydrogen 2.855 N/A GLY 113.A N VAL 108.A O no hydrogen 3.119 N/A VAL 114.A N GLU 110.A O no hydrogen 2.795 N/A ARG 115.A N HIS 111.A O no hydrogen 3.202 N/A ARG 115.A NE GLU 110.A OE2 no hydrogen 2.840 N/A ARG 115.A NH1 LYS 23.A O no hydrogen 2.907 N/A ARG 115.A NH1 VAL 150.A O no hydrogen 3.016 N/A ARG 115.A NH2 GLU 110.A OE2 no hydrogen 3.383 N/A ARG 115.A NH2 VAL 150.A O no hydrogen 2.901 N/A ARG 115.A NH2 GLU 156.A O no hydrogen 3.043 N/A MET 117.A N HIS 111.A O no hydrogen 3.249 N/A TRP 118.A N GLY 116.A O no hydrogen 2.872 N/A GLY 119.A N TYR 102.A O no hydrogen 2.991 N/A LEU 121.A N LEU 100.A O no hydrogen 2.968 N/A ILE 122.A N ILE 36.A O no hydrogen 2.832 N/A VAL 123.A N GLY 98.A O no hydrogen 3.007 N/A ASP 124.A N VAL 38.A O no hydrogen 2.861 N/A LYS 126.A N GLU 40.A OE1 no hydrogen 2.673 N/A LEU 129.A N GLU 132.A OE1 no hydrogen 2.997 N/A LYS 133.A N PRO 130.A O no hydrogen 2.980 N/A ARG 134.A N ILE 131.A O no hydrogen 2.906 N/A ARG 134.A NH1 GLU 241.A OE2 no hydrogen 2.752 N/A ARG 134.A NH2 GLU 241.A OE1 no hydrogen 2.974 N/A ARG 134.A NH2 GLU 241.A OE2 no hydrogen 3.514 N/A VAL 135.A N GLU 132.A O no hydrogen 3.361 N/A THR 136.A N VAL 187.A O no hydrogen 2.744 N/A THR 136.A OG1 ASP 186.A OD1 no hydrogen 2.702 N/A THR 136.A OG1 VAL 187.A O no hydrogen 3.342 N/A LYS 137.A N VAL 187.A O no hydrogen 3.274 N/A VAL 139.A N LYS 189.A O no hydrogen 2.881 N/A ILE 140.A N PHE 295.A O no hydrogen 2.879 N/A MET 141.A N ARG 191.A O no hydrogen 2.851 N/A MET 142.A N ASN 170.A OD1 no hydrogen 2.857 N/A MET 143.A N PHE 193.A O no hydrogen 2.928 N/A SER 144.A N SER 168.A O no hydrogen 3.267 N/A SER 144.A OG SER 168.A OG no hydrogen 3.357 N/A TRP 146.A N TYR 166.A O no hydrogen 2.886 N/A TRP 146.A NE1 SER 168.A OG no hydrogen 2.798 N/A GLU 147.A N TYR 22.A OH no hydrogen 3.183 N/A SER 148.A N ASP 165.A OD1 no hydrogen 2.834 N/A SER 148.A OG ASP 165.A OD1 no hydrogen 3.422 N/A SER 148.A OG ASP 165.A OD2 no hydrogen 2.614 N/A VAL 150.A N GLU 147.A O no hydrogen 3.037 N/A ALA 151.A N SER 148.A O no hydrogen 3.173 N/A LYS 153.A N VAL 150.A O no hydrogen 3.265 N/A TYR 154.A OH VAL 24.A O no hydrogen 2.625 N/A GLY 155.A N GLU 110.A OE2 no hydrogen 2.797 N/A GLY 158.A N GLU 147.A OE1 no hydrogen 2.777 N/A GLY 158.A N GLU 147.A OE2 no hydrogen 3.284 N/A THR 159.A N ASN 162.A OD1 no hydrogen 2.848 N/A THR 159.A OG1 ASN 162.A OD1 no hydrogen 2.598 N/A MET 161.A N THR 159.A OG1 no hydrogen 3.212 N/A ASN 162.A N THR 159.A O no hydrogen 2.984 N/A ASP 165.A N TRP 146.A O no hydrogen 2.972 N/A TYR 166.A N TRP 146.A O no hydrogen 3.187 N/A SER 168.A N SER 144.A O no hydrogen 3.044 N/A VAL 169.A N LYS 172.A O no hydrogen 3.078 N/A ASN 170.A N MET 142.A O no hydrogen 2.803 N/A ASN 170.A ND2 ILE 140.A O no hydrogen 2.906 N/A ASN 170.A ND2 PHE 294.A O no hydrogen 2.851 N/A LYS 172.A N VAL 169.A O no hydrogen 3.102 N/A LYS 172.A NZ.A GLY 311.A O no hydrogen 2.926 N/A LYS 172.A NZ.B GLY 311.A O no hydrogen 2.660 N/A SER 173.A N VAL 16.A O no hydrogen 2.833 N/A PHE 174.A N GLY 267.A O no hydrogen 2.838 N/A LEU 176.A N SER 173.A O no hydrogen 2.890 N/A THR 177.A OG1 ILE 269.A O no hydrogen 2.767 N/A GLN 178.A NE2 ASP 289.A O no hydrogen 3.091 N/A LEU 180.A N VAL 271.A O no hydrogen 2.861 N/A ARG 181.A NE GLU 273.A OE1 no hydrogen 2.947 N/A VAL 182.A N GLU 273.A O no hydrogen 2.963 N/A LYS 183.A N ASP 186.A OD2 no hydrogen 2.840 N/A GLY 185.A N ALA 242.A O no hydrogen 2.812 N/A ASP 186.A N LYS 183.A O no hydrogen 2.965 N/A VAL 187.A N THR 136.A OG1 no hydrogen 3.035 N/A VAL 188.A N ILE 240.A O no hydrogen 2.888 N/A LYS 189.A N LYS 137.A O no hydrogen 2.805 N/A LYS 189.A NZ GLU 132.A OE2 no hydrogen 2.832 N/A LYS 189.A NZ ASP 237.A OD2 no hydrogen 2.716 N/A ILE 190.A N VAL 238.A O no hydrogen 2.953 N/A ARG 191.A N VAL 139.A O no hydrogen 2.749 N/A ARG 191.A NE ASP 138.A OD1 no hydrogen 2.833 N/A ARG 191.A NE ASP 138.A OD2 no hydrogen 3.403 N/A ARG 191.A NH1 THR 99.A OG1 no hydrogen 2.952 N/A ARG 191.A NH2 ASP 138.A OD2 no hydrogen 2.851 N/A PHE 192.A N TYR 236.A O no hydrogen 2.811 N/A PHE 193.A N MET 141.A O no hydrogen 2.826 N/A GLY 194.A N GLU 234.A O no hydrogen 2.951 N/A ALA 195.A N MET 143.A O no hydrogen 3.042 N/A GLY 196.A N MET 143.A O no hydrogen 3.100 N/A HIS 200.A N VAL 230.A O no hydrogen 2.899 N/A HIS 200.A ND1 ASP 252.A OD2 no hydrogen 2.777 N/A ALA 201.A N ASP 252.A OD1 no hydrogen 2.873 N/A MET 202.A N VAL 228.A O no hydrogen 2.842 N/A HIS 203.A N HIS 251.A O no hydrogen 2.812 N/A HIS 203.A ND1 ASP 226.A O no hydrogen 2.748 N/A SER 204.A N ASP 226.A O no hydrogen 3.265 N/A SER 204.A OG HIS 207.A O no hydrogen 3.008 N/A HIS 205.A N ILE 249.A O no hydrogen 2.934 N/A HIS 205.A NE2 HIS 251.A NE2 no hydrogen 3.171 N/A HIS 207.A ND1 HIS 205.A O no hydrogen 2.855 N/A HIS 207.A NE2 TYR 274.A OH no hydrogen 2.673 N/A MET 209.A N ALA 225.A O no hydrogen 2.721 N/A LEU 210.A N ILE 239.A O no hydrogen 2.922 N/A VAL 211.A N TYR 223.A O no hydrogen 2.771 N/A THR 212.A N ASP 237.A O no hydrogen 2.903 N/A THR 212.A OG1 HIS 213.A ND1 no hydrogen 2.712 N/A THR 212.A OG1 ASP 237.A O no hydrogen 3.308 N/A HIS 213.A N ASP 237.A O no hydrogen 3.309 N/A HIS 213.A ND1 THR 212.A OG1 no hydrogen 2.712 N/A LYS 214.A N LEU 217.A O no hydrogen 2.984 N/A LYS 214.A NZ ASP 215.A OD1 no hydrogen 2.845 N/A LYS 214.A NZ ASP 215.A OD2 no hydrogen 2.994 N/A LYS 214.A NZ GLU 234.A OE2 no hydrogen 2.704 N/A ASP 215.A N ARG 235.A O no hydrogen 2.814 N/A LEU 217.A N LYS 214.A O no hydrogen 3.029 N/A LEU 219.A N THR 212.A O no hydrogen 2.863 N/A TYR 223.A N VAL 211.A O no hydrogen 3.295 N/A ALA 225.A N MET 209.A O no hydrogen 2.839 N/A THR 227.A OG1 ASP 226.A OD1 no hydrogen 2.813 N/A VAL 228.A N MET 202.A O no hydrogen 2.846 N/A VAL 230.A N HIS 200.A O no hydrogen 2.755 N/A SER 231.A N GLU 234.A OE1 no hydrogen 2.942 N/A SER 231.A OG.A GLU 234.A OE1 no hydrogen 2.878 N/A GLY 233.A N GLY 194.A O no hydrogen 2.891 N/A GLU 234.A N SER 231.A O no hydrogen 3.055 N/A ARG 235.A N ASP 215.A OD1 no hydrogen 3.016 N/A ARG 235.A NE THR 99.A O no hydrogen 2.885 N/A ARG 235.A NH1 GLY 233.A O no hydrogen 2.841 N/A ARG 235.A NH2 THR 99.A O no hydrogen 3.176 N/A TYR 236.A N PHE 192.A O no hydrogen 3.023 N/A TYR 236.A OH GLU 234.A OE2 no hydrogen 2.699 N/A ASP 237.A N HIS 213.A O no hydrogen 2.949 N/A VAL 238.A N ILE 190.A O no hydrogen 2.833 N/A ILE 239.A N LEU 210.A O no hydrogen 2.870 N/A ILE 240.A N VAL 188.A O no hydrogen 2.810 N/A ALA 242.A N ASP 186.A O no hydrogen 2.810 N/A ASP 243.A N GLU 241.A O no hydrogen 2.925 N/A ASN 244.A N TYR 274.A OH no hydrogen 2.945 N/A ASN 244.A ND2 GLY 206.A O no hydrogen 2.959 N/A ARG 247.A NH1 PRO 278.A O no hydrogen 3.075 N/A ARG 247.A NH1 ASP 280.A OD2 no hydrogen 3.278 N/A ARG 247.A NH2 ASP 280.A OD2 no hydrogen 2.735 N/A PHE 248.A N ILE 272.A O no hydrogen 2.863 N/A PHE 250.A N THR 270.A O no hydrogen 2.894 N/A HIS 251.A N HIS 203.A O no hydrogen 2.944 N/A HIS 251.A ND1 ASP 252.A O no hydrogen 2.826 N/A HIS 251.A NE2 HIS 205.A NE2 no hydrogen 3.171 N/A ASP 252.A N PRO 268.A O no hydrogen 3.048 N/A HIS 253.A N ALA 201.A O no hydrogen 2.673 N/A HIS 253.A ND1 HIS 253.A O no hydrogen 2.840 N/A VAL 254.A N ASP 252.A OD1 no hydrogen 3.000 N/A HIS 257.A N VAL 254.A O no hydrogen 2.892 N/A HIS 257.A ND1 ASP 252.A OD2 no hydrogen 2.618 N/A VAL 258.A N ASP 255.A O no hydrogen 3.372 N/A THR 259.A OG1 THR 256.A O no hydrogen 2.670 N/A ALA 260.A N LYS 263.A O no hydrogen 2.606 N/A GLY 261.A N ASP 165.A O no hydrogen 2.965 N/A LYS 263.A N ALA 260.A O no hydrogen 2.963 N/A HIS 264.A ND1 VAL 258.A O no hydrogen 2.689 N/A GLY 267.A N SER 173.A OG no hydrogen 2.906 N/A ILE 269.A N GLY 267.A O no hydrogen 2.916 N/A THR 270.A N PHE 250.A O no hydrogen 2.883 N/A THR 270.A OG1 GLN 178.A O no hydrogen 2.615 N/A ILE 272.A N PHE 248.A O no hydrogen 2.704 N/A GLU 273.A N LEU 180.A O no hydrogen 2.939 N/A TYR 274.A N GLY 246.A O no hydrogen 3.231 N/A TYR 274.A OH HIS 207.A NE2 no hydrogen 2.673 N/A ASP 275.A N VAL 182.A O no hydrogen 2.783 N/A VAL 277.A N TYR 274.A O no hydrogen 3.150 N/A TYR 283.A N ASP 280.A O no hydrogen 3.122 N/A TYR 283.A OH GLU 273.A OE2 no hydrogen 2.574 N/A TRP 285.A NE1 PRO 175.A O no hydrogen 3.194 N/A LYS 286.A N TYR 283.A O no hydrogen 3.076 N/A LYS 288.A N TRP 285.A O no hydrogen 3.119 N/A LYS 288.A NZ PRO 175.A O no hydrogen 2.775 N/A LYS 288.A NZ THR 177.A O no hydrogen 2.896 N/A ASP 291.A N GLN 178.A OE1 no hydrogen 2.972 N/A ASN 293.A N ASP 291.A OD1 no hydrogen 2.810 N/A ASN 293.A ND2 SER 299.A OG no hydrogen 2.901 N/A PHE 294.A N ASP 291.A O no hydrogen 3.294 N/A TYR 296.A N ASN 293.A O no hydrogen 2.870 N/A TYR 296.A OH GLY 33.A O no hydrogen 2.636 N/A SER 297.A OG ASP 138.A O no hydrogen 2.585 N/A GLU 298.A N ASN 293.A OD1 no hydrogen 2.880 N/A SER 299.A N ASN 293.A OD1 no hydrogen 3.038 N/A LEU 300.A N TYR 296.A O no hydrogen 2.872 N/A LYS 301.A N GLU 298.A O no hydrogen 2.941 N/A GLN 302.A N SER 299.A O no hydrogen 2.964 N/A TYR 304.A OH ASP 124.A OD2 no hydrogen 2.760 N/A GLY 305.A N HIS 37.A O no hydrogen 2.811 N/A PHE 307.A N LEU 35.A O no hydrogen 2.774 N/A HIS 309.A N GLN 30.A OE1 no hydrogen 2.830 N/A HIS 309.A NE2 ASP 291.A OD2 no hydrogen 2.796 N/A PHE 312.A N HIS 309.A O no hydrogen 2.982 N/A LYS 313.A N ASP 310.A O no hydrogen 3.104 N/A GLY 314.A N GLY 29.A O no hydrogen 2.989 N/A GLU 315.A N THR 13.A O no hydrogen 2.854 N/A