Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3w4q_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 5.A N SER 2.A OG no hydrogen 2.931 N/A LEU 6.A N SER 2.A O no hydrogen 2.888 N/A GLU 7.A N PHE 3.A O no hydrogen 2.992 N/A ARG 8.A N ALA 4.A O no hydrogen 3.100 N/A ALA 9.A N ALA 5.A O no hydrogen 2.996 N/A ALA 10.A N LEU 6.A O no hydrogen 2.890 N/A ARG 13.A N THR 233.A O no hydrogen 2.898 N/A ARG 13.A NH1 GLU 33.A OE1 no hydrogen 3.037 N/A ARG 13.A NH1 ARG 34.A O no hydrogen 2.964 N/A ARG 13.A NH2 ARG 34.A O no hydrogen 3.004 N/A LEU 14.A N GLU 7.A OE2 no hydrogen 2.896 N/A GLY 15.A N TYR 231.A O no hydrogen 2.736 N/A VAL 16.A N HIS 29.A O no hydrogen 2.808 N/A CYS 17.A N ALA 229.A O no hydrogen 2.978 N/A ALA 18.A N ALA 27.A O no hydrogen 2.901 N/A ILE 19.A N VAL 227.A O no hydrogen 2.817 N/A ASP 20.A N ARG 25.A O no hydrogen 2.852 N/A THR 21.A N PRO 225.A O no hydrogen 3.046 N/A THR 21.A OG1 PRO 225.A O no hydrogen 2.680 N/A ALA 22.A N ASP 20.A OD1.A no hydrogen 3.070 N/A ALA 22.A N ASP 20.A OD1.B no hydrogen 2.920 N/A THR 23.A OG1 ASP 20.A OD2.A no hydrogen 3.056 N/A GLY 24.A N ASP 20.A O no hydrogen 2.849 N/A ARG 25.A N THR 23.A OG1 no hydrogen 3.061 N/A ALA 27.A N ALA 18.A O no hydrogen 2.909 N/A HIS 29.A N VAL 16.A O no hydrogen 2.953 N/A HIS 29.A NE2 GLU 7.A OE1 no hydrogen 2.781 N/A ARG 30.A NE GLU 7.A OE2 no hydrogen 2.772 N/A ARG 30.A NH1 GLU 33.A OE2 no hydrogen 2.887 N/A ARG 30.A NH2 GLU 7.A OE1 no hydrogen 3.353 N/A GLU 33.A N ARG 30.A O no hydrogen 3.084 N/A ARG 34.A NH1 THR 128.A O no hydrogen 2.961 N/A ARG 34.A NH1 THR 149.A OG1 no hydrogen 2.916 N/A ARG 34.A NH2 THR 128.A O no hydrogen 2.920 N/A PHE 35.A N THR 150.A O no hydrogen 2.833 N/A PHE 37.A N ASP 148.A O no hydrogen 3.093 N/A CYS 38.A SG PRO 36.A O no hydrogen 3.947 N/A SER 39.A OG SER 99.A OG no hydrogen 3.205 N/A THR 40.A N PHE 37.A O no hydrogen 3.131 N/A THR 40.A OG1 PHE 37.A O no hydrogen 2.750 N/A THR 40.A OG1 TYR 231.A OH no hydrogen 2.864 N/A PHE 41.A N CYS 38.A O no hydrogen 3.263 N/A LYS 42.A N SER 39.A O no hydrogen 2.975 N/A LYS 42.A NZ SER 39.A OG no hydrogen 2.738 N/A LYS 42.A NZ SER 99.A O no hydrogen 2.885 N/A LYS 42.A NZ ASN 101.A OD1 no hydrogen 2.718 N/A LYS 42.A NZ GLU 135.A OE2 no hydrogen 3.362 N/A ALA 43.A N THR 40.A O no hydrogen 3.318 N/A LEU 45.A N PHE 41.A O no hydrogen 2.910 N/A GLY 46.A N LYS 42.A O no hydrogen 2.950 N/A ALA 47.A N ALA 43.A O no hydrogen 3.087 N/A ALA 48.A N MET 44.A O no hydrogen 2.842 N/A VAL 49.A N LEU 45.A O no hydrogen 2.980 N/A LEU 50.A N GLY 46.A O no hydrogen 2.909 N/A ALA 51.A N ALA 47.A O no hydrogen 2.790 N/A GLN 52.A N ALA 48.A O no hydrogen 2.987 N/A GLN 52.A NE2.A ILE 111.A O no hydrogen 3.121 N/A SER 53.A N VAL 49.A O no hydrogen 2.971 N/A SER 53.A OG LEU 50.A O no hydrogen 2.631 N/A VAL 54.A N LEU 50.A O no hydrogen 3.261 N/A VAL 54.A N ALA 51.A O no hydrogen 3.116 N/A HIS 56.A N GLN 52.A O no hydrogen 3.245 N/A LEU 59.A N HIS 56.A O no hydrogen 2.874 N/A GLN 61.A N GLY 58.A O no hydrogen 3.142 N/A GLN 61.A NE2 GLN 61.A O no hydrogen 3.084 N/A GLN 62.A N LEU 59.A O no hydrogen 3.036 N/A ARG 63.A NH1 THR 84.A O no hydrogen 2.934 N/A VAL 64.A N MET 86.A O no hydrogen 2.787 N/A TYR 66.A OH THR 78.A O no hydrogen 2.629 N/A GLY 67.A N ASP 70.A OD2 no hydrogen 2.820 N/A ASP 70.A N GLY 67.A O no hydrogen 3.001 N/A LEU 71.A N ARG 68.A O no hydrogen 3.134 N/A VAL 72.A N THR 102.A OG1 no hydrogen 2.890 N/A TYR 74.A OH TYR 98.A O no hydrogen 2.700 N/A SER 75.A OG VAL 72.A O no hydrogen 2.691 N/A SER 75.A OG THR 102.A OG1 no hydrogen 2.585 N/A VAL 77.A N ASP 100.A OD2 no hydrogen 2.824 N/A THR 78.A N ASP 100.A OD2 no hydrogen 2.885 N/A THR 78.A OG1 ASP 100.A OD1 no hydrogen 2.871 N/A THR 78.A OG1 ASP 100.A OD2 no hydrogen 3.208 N/A GLU 79.A N SER 75.A O no hydrogen 3.046 N/A ARG 80.A N VAL 77.A O no hydrogen 2.947 N/A HIS 81.A N THR 78.A O no hydrogen 3.031 N/A THR 84.A OG1 GLY 85.A O no hydrogen 2.648 N/A GLY 85.A N HIS 81.A O no hydrogen 2.846 N/A MET 86.A N VAL 64.A O no hydrogen 3.013 N/A THR 87.A N GLU 90.A OE1 no hydrogen 2.912 N/A VAL 88.A N GLN 62.A O no hydrogen 2.880 N/A ALA 89.A N LEU 60.A O no hydrogen 2.975 N/A GLU 90.A N THR 87.A OG1 no hydrogen 3.057 N/A LEU 91.A N THR 87.A O no hydrogen 2.895 N/A CYS 92.A N VAL 88.A O no hydrogen 2.981 N/A CYS 92.A SG.A VAL 88.A O no hydrogen 3.540 N/A ALA 93.A N ALA 89.A O no hydrogen 2.990 N/A ALA 94.A N GLU 90.A O no hydrogen 2.952 N/A THR 95.A N LEU 91.A O no hydrogen 2.895 N/A THR 95.A OG1 ASP 100.A O no hydrogen 2.895 N/A ILE 96.A N CYS 92.A O no hydrogen 2.990 N/A GLN 97.A N ALA 93.A O no hydrogen 2.828 N/A GLN 97.A NE2.A GLY 182.A O no hydrogen 2.980 N/A GLN 97.A NE2.B GLU 178.A O no hydrogen 3.512 N/A GLN 97.A NE2.B TRP 179.A O no hydrogen 3.217 N/A TYR 98.A N ALA 94.A O no hydrogen 3.080 N/A SER 99.A OG SER 39.A OG no hydrogen 3.205 N/A ASP 100.A N ALA 94.A O no hydrogen 3.170 N/A ASN 101.A N TYR 74.A O no hydrogen 2.909 N/A ASN 101.A ND2 ASN 73.A O no hydrogen 2.822 N/A THR 102.A N SER 75.A OG no hydrogen 3.374 N/A THR 102.A OG1 SER 75.A OG no hydrogen 2.585 N/A ALA 103.A N ASP 100.A OD1 no hydrogen 2.924 N/A ASN 105.A N ASN 101.A O no hydrogen 3.245 N/A ASN 105.A ND2 GLU 135.A O no hydrogen 3.026 N/A GLU 106.A N THR 102.A O no hydrogen 2.882 N/A LEU 107.A N ALA 103.A O no hydrogen 2.950 N/A MET 108.A N ALA 104.A O no hydrogen 2.871 N/A LYS 109.A N ASN 105.A O no hydrogen 2.888 N/A LYS 109.A NZ GLU 106.A OE2 no hydrogen 2.815 N/A ARG 110.A N GLU 106.A O no hydrogen 3.203 N/A ARG 110.A NE.A GLN 62.A OE1 no hydrogen 2.690 N/A ARG 110.A NH1.A ARG 110.A O no hydrogen 2.858 N/A ARG 110.A NH1.B GLN 62.A OE1 no hydrogen 3.263 N/A ARG 110.A NH2.A GLN 62.A OE1 no hydrogen 2.970 N/A ILE 111.A N LEU 107.A O no hydrogen 3.092 N/A ILE 111.A N MET 108.A O no hydrogen 3.269 N/A GLY 112.A N MET 108.A O no hydrogen 3.084 N/A GLY 113.A N MET 108.A O no hydrogen 2.822 N/A ALA 116.A N GLY 113.A O no hydrogen 2.898 N/A VAL 117.A N GLY 113.A O no hydrogen 3.301 N/A THR 118.A N PRO 114.A O no hydrogen 3.046 N/A THR 118.A OG1 PRO 114.A O no hydrogen 3.173 N/A THR 118.A OG1 LEU 131.A O no hydrogen 3.184 N/A ALA 119.A N ALA 115.A O no hydrogen 2.905 N/A TYR 120.A N ALA 116.A O no hydrogen 2.969 N/A ALA 121.A N VAL 117.A O no hydrogen 2.994 N/A ARG 122.A N THR 118.A O no hydrogen 3.017 N/A ARG 122.A NH1 ASP 126.A O no hydrogen 2.829 N/A ARG 122.A NH1 PHE 129.A O no hydrogen 2.807 N/A ARG 122.A NH2 PHE 129.A O no hydrogen 3.061 N/A SER 123.A N ALA 119.A O no hydrogen 3.064 N/A SER 123.A OG TYR 120.A O no hydrogen 2.686 N/A ILE 124.A N TYR 120.A O no hydrogen 3.298 N/A ILE 124.A N ALA 121.A O no hydrogen 3.092 N/A GLY 125.A N ARG 122.A O no hydrogen 3.128 N/A ASP 126.A N ALA 121.A O no hydrogen 3.027 N/A THR 128.A N ASP 126.A OD1 no hydrogen 2.898 N/A PHE 129.A N ASP 126.A OD1 no hydrogen 2.871 N/A ARG 130.A N THR 149.A O no hydrogen 3.125 N/A ARG 130.A NE ASP 132.A OD2 no hydrogen 2.919 N/A ARG 130.A NH2 ASP 132.A OD1 no hydrogen 3.001 N/A ARG 130.A NH2 ASP 132.A OD2 no hydrogen 3.472 N/A LEU 131.A N THR 118.A OG1 no hydrogen 2.934 N/A ASP 132.A N ASP 148.A OD1 no hydrogen 2.728 N/A ARG 133.A N ASP 148.A OD1 no hydrogen 3.065 N/A ARG 133.A NE ASP 148.A OD2 no hydrogen 2.746 N/A ARG 133.A NH1 THR 140.A OG1 no hydrogen 2.878 N/A ARG 133.A NH2 THR 140.A OG1 no hydrogen 3.071 N/A ARG 133.A NH2 ASP 148.A OD2 no hydrogen 2.826 N/A GLU 135.A N ASN 105.A OD1 no hydrogen 2.877 N/A LEU 138.A N TRP 134.A O no hydrogen 2.996 N/A ASN 139.A N THR 136.A O no hydrogen 3.000 N/A THR 140.A N GLU 137.A O no hydrogen 3.128 N/A THR 140.A OG1 GLU 137.A O no hydrogen 3.257 N/A ASP 145.A N LEU 142.A O no hydrogen 3.087 N/A ARG 147.A N ASP 145.A OD1 no hydrogen 2.968 N/A ARG 147.A NE ASP 145.A OD1 no hydrogen 3.236 N/A ARG 147.A NE ASP 145.A OD2 no hydrogen 3.036 N/A ARG 147.A NH2 ASP 145.A OD2 no hydrogen 2.841 N/A ASP 148.A N ASP 132.A OD2 no hydrogen 2.990 N/A THR 149.A OG1 LEU 146.A O no hydrogen 2.700 N/A THR 150.A N PHE 35.A O no hydrogen 3.140 N/A ALA 153.A N ALA 31.A O no hydrogen 2.904 N/A ALA 154.A N THR 151.A OG1 no hydrogen 2.954 N/A MET 155.A N THR 151.A O no hydrogen 3.093 N/A ALA 156.A N PRO 152.A O no hydrogen 2.953 N/A ALA 157.A N ALA 153.A O no hydrogen 3.007 N/A ASN 158.A N ALA 154.A O no hydrogen 3.031 N/A ASN 158.A ND2 ASP 126.A OD2 no hydrogen 2.664 N/A LEU 159.A N MET 155.A O no hydrogen 2.975 N/A ARG 160.A N ALA 156.A O no hydrogen 2.975 N/A VAL 161.A N.A ALA 157.A O no hydrogen 3.132 N/A VAL 161.A N.B ALA 157.A O no hydrogen 3.117 N/A LEU 162.A N ASN 158.A O no hydrogen 2.895 N/A VAL 163.A N LEU 159.A O no hydrogen 2.851 N/A LEU 164.A N ARG 160.A O no hydrogen 2.823 N/A ALA 167.A N VAL 161.A O.A no hydrogen 3.387 N/A ALA 167.A N VAL 161.A O.B no hydrogen 3.176 N/A ARG 173.A N PRO 169.A O no hydrogen 2.857 N/A ARG 173.A NE.B LEU 168.A O no hydrogen 3.306 N/A ARG 173.A NH1.A GLY 165.A O no hydrogen 3.028 N/A ARG 173.A NH2.B LEU 168.A O no hydrogen 2.756 N/A ALA 174.A N PRO 170.A O no hydrogen 2.935 N/A GLN 175.A N ALA 171.A O no hydrogen 3.174 N/A LEU 176.A N GLN 172.A O no hydrogen 2.928 N/A ILE 177.A N ARG 173.A O no hydrogen 2.999 N/A GLU 178.A N ALA 174.A O no hydrogen 2.918 N/A TRP 179.A N GLN 175.A O no hydrogen 2.974 N/A LEU 180.A N LEU 176.A O no hydrogen 2.982 N/A ARG 181.A N ILE 177.A O no hydrogen 2.869 N/A GLY 182.A N GLU 178.A O no hydrogen 3.119 N/A GLY 182.A N TRP 179.A O no hydrogen 3.146 N/A ASN 183.A N LEU 180.A O no hydrogen 3.271 N/A ASN 183.A ND2 ASP 202.A OD1 no hydrogen 3.048 N/A ASN 183.A ND2 ASP 202.A OD2 no hydrogen 3.008 N/A LYS 184.A N GLN 97.A O no hydrogen 2.880 N/A VAL 185.A N ASN 183.A OD1 no hydrogen 2.972 N/A ARG 189.A N GLY 186.A O no hydrogen 3.147 N/A ARG 189.A NE ASP 243.A OD1 no hydrogen 2.728 N/A ARG 189.A NH1 GLY 205.A O no hydrogen 2.855 N/A ARG 189.A NH1 THR 206.A OG1 no hydrogen 3.135 N/A ARG 189.A NH1 ASN 213.A O no hydrogen 3.093 N/A ARG 189.A NH2 THR 206.A OG1 no hydrogen 2.954 N/A ARG 189.A NH2 ASP 243.A OD1 no hydrogen 3.176 N/A ILE 190.A N ASP 214.A OD2 no hydrogen 2.980 N/A ARG 191.A NE ASP 202.A OD1 no hydrogen 2.901 N/A ARG 191.A NH2 ARG 181.A O no hydrogen 3.295 N/A ARG 191.A NH2 ASP 202.A OD1 no hydrogen 3.025 N/A ALA 192.A N ARG 189.A O no hydrogen 2.971 N/A GLY 193.A N ILE 190.A O no hydrogen 2.915 N/A GLY 197.A N.A THR 196.A OG1.B no hydrogen 2.961 N/A TRP 198.A N PRO 195.A O.A no hydrogen 3.153 N/A TRP 198.A N PRO 195.A O.B no hydrogen 3.429 N/A ARG 199.A N TRP 219.A O no hydrogen 2.940 N/A GLY 201.A N VAL 217.A O no hydrogen 2.997 N/A ASP 202.A N LEU 180.A O no hydrogen 3.106 N/A LYS 203.A N VAL 215.A O no hydrogen 2.844 N/A LYS 203.A NZ SER 99.A OG no hydrogen 2.839 N/A LYS 203.A NZ THR 204.A O no hydrogen 2.787 N/A GLY 205.A N ASN 213.A O no hydrogen 2.978 N/A GLY 207.A N THR 211.A O no hydrogen 3.005 N/A ASP 208.A N ASN 139.A O no hydrogen 2.955 N/A TYR 209.A N ALA 237.A O no hydrogen 3.100 N/A THR 211.A N GLY 207.A O no hydrogen 3.155 N/A THR 211.A N ASP 208.A O no hydrogen 3.144 N/A THR 211.A OG1 ASP 208.A O no hydrogen 2.718 N/A THR 211.A OG1 THR 233.A OG1 no hydrogen 2.737 N/A THR 212.A N TYR 232.A O no hydrogen 2.843 N/A THR 212.A OG1 GLY 210.A O no hydrogen 2.868 N/A ASN 213.A N GLY 205.A O no hydrogen 2.845 N/A ASN 213.A ND2 PRO 36.A O no hydrogen 3.027 N/A ASN 213.A ND2 PHE 37.A O no hydrogen 3.097 N/A ASP 214.A N VAL 230.A O no hydrogen 2.872 N/A VAL 215.A N LYS 203.A O no hydrogen 3.078 N/A GLY 216.A N LEU 228.A O no hydrogen 2.822 N/A VAL 217.A N GLY 201.A O no hydrogen 2.829 N/A LEU 218.A N ILE 226.A O no hydrogen 2.774 N/A TRP 219.A N ARG 199.A O no hydrogen 2.736 N/A ILE 226.A N LEU 218.A O no hydrogen 2.866 N/A VAL 227.A N ILE 19.A O no hydrogen 2.953 N/A LEU 228.A N GLY 216.A O no hydrogen 2.901 N/A ALA 229.A N CYS 17.A O no hydrogen 2.871 N/A VAL 230.A N ASP 214.A O no hydrogen 2.904 N/A TYR 231.A N GLY 15.A O no hydrogen 2.888 N/A TYR 231.A OH THR 40.A OG1 no hydrogen 2.864 N/A TYR 232.A N ASN 213.A OD1 no hydrogen 3.139 N/A TYR 232.A OH GLY 11.A O no hydrogen 2.736 N/A THR 233.A N ARG 13.A O no hydrogen 3.032 N/A THR 233.A OG1 THR 211.A OG1 no hydrogen 2.737 N/A GLN 234.A N TYR 209.A O no hydrogen 2.957 N/A GLN 234.A NE2 GLY 210.A O no hydrogen 2.964 N/A GLN 234.A NE2 LYS 240.A O no hydrogen 2.763 N/A ALA 239.A N ARG 236.A O no hydrogen 3.108 N/A LYS 242.A N THR 212.A OG1 no hydrogen 3.030 N/A LYS 242.A NZ ALA 10.A O no hydrogen 2.868 N/A VAL 245.A N LYS 242.A O no hydrogen 3.069 N/A ALA 247.A N ASP 243.A O no hydrogen 3.130 N/A ALA 248.A N ASP 244.A O no hydrogen 2.895 N/A ALA 249.A N VAL 245.A O no hydrogen 2.904 N/A THR 250.A N ILE 246.A O no hydrogen 2.916 N/A THR 250.A OG1 ILE 246.A O no hydrogen 2.861 N/A ARG 251.A N ALA 247.A O no hydrogen 2.959 N/A ARG 251.A NH2 ALA 192.A O no hydrogen 3.009 N/A ILE 252.A N ALA 248.A O no hydrogen 2.987 N/A ALA 253.A N ALA 249.A O no hydrogen 2.910 N/A SER 254.A N THR 250.A O no hydrogen 2.963 N/A SER 254.A OG.A THR 250.A O no hydrogen 3.027 N/A SER 254.A OG.A ARG 251.A O no hydrogen 3.189 N/A SER 254.A OG.B THR 250.A O no hydrogen 2.859 N/A ALA 255.A N ARG 251.A O no hydrogen 3.003 N/A THR 256.A N ILE 252.A O no hydrogen 2.892 N/A THR 256.A OG1 ILE 252.A O no hydrogen 3.275 N/A LEU 257.A N ALA 253.A O no hydrogen 3.118 N/A ALA 258.A N ALA 255.A O no hydrogen 3.159 N/A