Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3k2u_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 1.A N HIS 135.A O no hydrogen 2.956 N/A ILE 1.A N ASP 188.A OD1 no hydrogen 3.497 N/A ILE 1.A N ASP 188.A OD2 no hydrogen 2.666 N/A ILE 2.A N ASP 183.A O no hydrogen 3.096 N/A SER 7.A N LEU 145.A O no hydrogen 2.928 N/A SER 7.A OG GLU 147.A OE1 no hydrogen 2.589 N/A SER 11.A N LEU 8.A O no hydrogen 3.126 N/A SER 11.A OG LEU 8.A O no hydrogen 2.359 N/A HIS 12.A NE2 GLU 147.A OE1 no hydrogen 3.139 N/A LEU 15.A N HIS 12.A O no hydrogen 3.118 N/A ALA 16.A N GLY 27.A O no hydrogen 2.754 N/A ALA 17.A N VAL 54.A O no hydrogen 3.097 N/A ILE 18.A N CYS 25.A O no hydrogen 2.778 N/A TYR 19.A N SER 52.A O no hydrogen 2.911 N/A TYR 19.A OH GLN 57.A OE1 no hydrogen 2.578 N/A ILE 20.A N SER 23.A O no hydrogen 3.033 N/A GLY 21.A N SER 50.A O no hydrogen 3.122 N/A SER 23.A N ILE 20.A O no hydrogen 2.788 N/A CYS 25.A N ILE 18.A O no hydrogen 2.925 N/A CYS 25.A SG PHE 24.A O no hydrogen 3.052 N/A ALA 26.A N SER 189.A O no hydrogen 2.860 N/A GLY 27.A N ALA 16.A O no hydrogen 2.807 N/A SER 28.A N VAL 36.A O no hydrogen 2.787 N/A LEU 29.A N TRP 14.A O no hydrogen 2.987 N/A VAL 30.A N TRP 34.A O no hydrogen 3.121 N/A THR 32.A OG1 ALA 104.A O no hydrogen 2.854 N/A CYS 33.A N HIS 31.A ND1 no hydrogen 2.890 N/A TRP 34.A N HIS 31.A O no hydrogen 2.792 N/A VAL 35.A N ILE 94.A O no hydrogen 2.948 N/A VAL 36.A N SER 28.A O no hydrogen 2.864 N/A SER 37.A N VAL 92.A O no hydrogen 3.104 N/A SER 37.A OG ALA 26.A O no hydrogen 2.759 N/A HIS 40.A N ASP 90.A OD1 no hydrogen 2.660 N/A CYS 41.A N ALA 38.A O no hydrogen 3.061 N/A PHE 42.A N ALA 39.A O no hydrogen 3.126 N/A SER 43.A N HIS 40.A O no hydrogen 3.519 N/A SER 43.A OG HIS 40.A O no hydrogen 3.013 N/A SER 50.A N PRO 47D.A O no hydrogen 2.825 N/A SER 50.A OG PRO 47D.A O no hydrogen 2.505 N/A VAL 51.A N ARG 48.A O no hydrogen 3.238 N/A SER 52.A N TYR 19.A O no hydrogen 2.990 N/A VAL 53.A N PHE 70.A O no hydrogen 2.570 N/A VAL 54.A N ALA 17.A O no hydrogen 2.784 N/A LEU 55.A N GLN 68.A O no hydrogen 3.015 N/A HIS 58.A NE2 SER 7.A O no hydrogen 3.210 N/A PHE 60.A N SER 143.A O no hydrogen 2.882 N/A ASN 61.A N GLN 57.A OE1 no hydrogen 2.907 N/A ARG 62.A N PHE 59.A O no hydrogen 3.173 N/A THR 64.A N THR 67.A OG1 no hydrogen 3.089 N/A THR 67.A OG1 THR 64.A O no hydrogen 3.103 N/A GLN 68.A N LEU 55.A O no hydrogen 3.098 N/A GLN 68.A NE2 THR 105.A O no hydrogen 3.247 N/A PHE 70.A N VAL 53.A O no hydrogen 2.722 N/A GLU 73.A N ARG 95.A O no hydrogen 2.770 N/A TYR 75.A OH PRO 46C.A O no hydrogen 2.540 N/A ILE 76.A N LEU 93.A O no hydrogen 2.499 N/A TYR 78.A N LEU 91.A O no hydrogen 3.077 N/A TYR 81.A N TYR 78.A O no hydrogen 2.966 N/A TYR 81.A OH PRO 86A.A O no hydrogen 2.642 N/A PHE 84.A N SER 82.A OG no hydrogen 3.379 N/A SER 87.A N ASN 85.A OD1 no hydrogen 3.324 N/A SER 87.A OG SER 208.A OG no hydrogen 3.407 N/A ASP 88.A N ASN 85.A O no hydrogen 2.945 N/A HIS 89.A ND1 TYR 224.A OH no hydrogen 2.760 N/A LEU 91.A N HIS 89.A O no hydrogen 2.778 N/A VAL 92.A N SER 37.A O no hydrogen 3.135 N/A LEU 93.A N ILE 76.A O no hydrogen 2.732 N/A ILE 94.A N VAL 35.A O no hydrogen 2.849 N/A ARG 95.A N LYS 74.A O no hydrogen 2.829 N/A LEU 96.A N CYS 33.A O no hydrogen 3.194 N/A LYS 97.A N GLY 71.A O no hydrogen 2.916 N/A LYS 99.A N ARG 102C.A O no hydrogen 2.702 N/A ALA 104.A N THR 32.A O no hydrogen 2.865 N/A THR 105.A N GLN 68.A OE1 no hydrogen 3.307 N/A THR 105.A OG1 GLN 68.A OE1 no hydrogen 3.172 N/A SER 107.A N VAL 110.A O no hydrogen 2.899 N/A PHE 109.A N SER 107.A OG no hydrogen 2.619 N/A VAL 110.A N SER 107.A OG no hydrogen 2.950 N/A GLN 111.A N PRO 13.A O no hydrogen 2.913 N/A GLN 111.A NE2 SER 107.A O no hydrogen 3.268 N/A GLN 111.A NE2 VAL 110.A O no hydrogen 3.450 N/A ILE 113.A N LEU 29.A O no hydrogen 2.927 N/A CYS 114.A N ALA 201.A O no hydrogen 3.329 N/A GLY 119.A N ALA 222.A O no hydrogen 3.133 N/A SER 120.A N GLU 117.A O no hydrogen 2.884 N/A SER 120.A OG GLU 117.A O no hydrogen 2.449 N/A PHE 122.A N TYR 204.A OH no hydrogen 3.313 N/A GLY 125.A N LEU 152.A O no hydrogen 2.751 N/A HIS 126.A N PRO 123.A O no hydrogen 3.047 N/A HIS 126.A NE2 GLU 196.A O no hydrogen 3.141 N/A CYS 128.A N VAL 150.A O no hydrogen 2.789 N/A CYS 128.A SG HIS 126.A O no hydrogen 3.960 N/A GLN 129.A N ALA 194.A O no hydrogen 2.858 N/A GLN 129.A NE2 GLU 147.A OE2 no hydrogen 2.909 N/A ILE 130.A N ALA 148.A O no hydrogen 2.912 N/A GLY 132.A N ARG 146.A O no hydrogen 3.049 N/A TRP 133.A NE1 HIS 58.A O no hydrogen 2.880 N/A GLY 134.A N ASP 188.A OD1 no hydrogen 2.696 N/A HIS 135.A N GLN 186.A O no hydrogen 2.749 N/A SER 142.A N TRP 133.A O no hydrogen 2.710 N/A SER 142.A OG SER 144.A O no hydrogen 3.211 N/A LEU 145.A N HIS 58.A O no hydrogen 2.732 N/A GLU 147.A N SER 5.A O no hydrogen 3.060 N/A ALA 148.A N ILE 130.A O no hydrogen 2.946 N/A VAL 150.A N CYS 128.A O no hydrogen 2.722 N/A LEU 152.A N HIS 126.A O no hydrogen 2.940 N/A VAL 153.A N CYS 174.A O no hydrogen 3.046 N/A LYS 157.A N ALA 154.A O no hydrogen 2.776 N/A CYS 158.A N ALA 154.A O no hydrogen 2.838 N/A SER 159.A N ASP 155.A O no hydrogen 2.777 N/A SER 159.A OG ASP 155.A O no hydrogen 3.160 N/A SER 160.A N LYS 157.A O no hydrogen 3.266 N/A SER 160.A OG GLU 162B.A OE2 no hydrogen 2.554 N/A VAL 163.A N SER 160.A O no hydrogen 2.753 N/A TYR 164.A N SER 160.A O no hydrogen 3.282 N/A TYR 164.A OH PRO 215.A O no hydrogen 2.678 N/A GLY 165.A N SER 160.A O no hydrogen 2.981 N/A ASP 167.A N TYR 164.A O no hydrogen 3.151 N/A ILE 168.A N GLY 165.A O no hydrogen 3.256 N/A SER 169.A OG ASP 88.A OD1 no hydrogen 2.643 N/A ASN 171.A N SER 169.A OG no hydrogen 3.346 N/A ASN 171.A ND2 ASP 88.A OD1 no hydrogen 3.096 N/A MET 172.A N SER 169.A O no hydrogen 2.868 N/A LEU 173.A N TYR 218.A O no hydrogen 3.034 N/A ALA 175.A N GLY 216.A O no hydrogen 2.994 N/A TYR 177.A OH LEU 149.A O no hydrogen 2.603 N/A SER 182.A OG GLY 3.A O no hydrogen 2.585 N/A ASP 183.A N ILE 2.A O no hydrogen 3.399 N/A ALA 184.A N ASP 183.A OD1 no hydrogen 2.621 N/A CYS 185.A N ASP 188.A OD2 no hydrogen 3.082 N/A ASP 188.A N CYS 185.A O no hydrogen 3.055 N/A SER 189.A OG HIS 40.A NE2 no hydrogen 3.019 N/A GLY 190.A N ILE 207.A O no hydrogen 2.923 N/A GLY 191.A N ASP 188.A O no hydrogen 2.857 N/A LEU 193.A N GLY 205.A O no hydrogen 2.749 N/A ALA 194.A N GLN 129.A O no hydrogen 3.141 N/A CYS 195.A N TYR 202.A O no hydrogen 3.186 N/A LYS 197.A N VAL 200.A O no hydrogen 2.980 N/A VAL 200.A N LYS 197.A O no hydrogen 3.197 N/A TYR 202.A N CYS 195.A O no hydrogen 3.095 N/A LEU 203.A N CYS 114.A O no hydrogen 2.668 N/A TYR 204.A N LEU 193.A O no hydrogen 3.177 N/A TYR 204.A N TYR 202.A O no hydrogen 2.962 N/A GLY 205.A N LEU 193.A O no hydrogen 3.144 N/A ILE 206.A N THR 219.A O no hydrogen 3.191 N/A ILE 207.A N GLY 191.A O no hydrogen 2.621 N/A SER 208.A N VAL 217.A O no hydrogen 3.406 N/A SER 208.A OG SER 87.A OG no hydrogen 3.407 N/A SER 208.A OG ASP 90.A OD2 no hydrogen 2.674 N/A TRP 209.A N VAL 217.A O no hydrogen 3.376 N/A LYS 214.A NZ VAL 163.A O no hydrogen 2.596 N/A LYS 214.A NZ GLU 162B.A O no hydrogen 3.436 N/A VAL 217.A N TRP 209.A O no hydrogen 2.901 N/A TYR 218.A N LEU 173.A O no hydrogen 2.717 N/A THR 219.A N ILE 206.A O no hydrogen 2.784 N/A THR 219.A OG1 ASP 90.A O no hydrogen 2.936 N/A ARG 220.A N ASN 171.A O no hydrogen 2.951 N/A ARG 220.A NE PRO 170.A O no hydrogen 2.995 N/A ARG 220.A NH2 ASP 155.A OD1 no hydrogen 3.162 N/A ARG 220.A NH2 MET 172.A O no hydrogen 3.237 N/A ASN 223.A N ARG 220.A O no hydrogen 2.883 N/A ASN 223.A ND2 ASN 171.A OD1 no hydrogen 3.596 N/A TYR 224.A N VAL 221.A O no hydrogen 2.872 N/A TYR 224.A OH HIS 89.A ND1 no hydrogen 2.760 N/A TRP 227.A NE1 THR 79.A OG1 no hydrogen 2.981 N/A ILE 228.A N TYR 224.A O no hydrogen 2.905 N/A ASN 229.A N VAL 225.A O no hydrogen 2.955 N/A ASP 230.A N ASP 226.A O no hydrogen 3.025 N/A ARG 231.A N TRP 227.A O no hydrogen 3.173 N/A ILE 232.A N ILE 228.A O no hydrogen 3.258 N/A ILE 232.A N ASN 229.A O no hydrogen 3.237 N/A ARG 233.A NH1 ASP 230.A OD2 no hydrogen 3.526 N/A GLY 176A.A N PRO 151.A O no hydrogen 2.811 N/A SER 45B.A N PHE 42.A O no hydrogen 2.865 N/A CYS 103D.A N THR 32.A OG1 no hydrogen 2.962 N/A CYS 103D.A SG LEU 96.A O no hydrogen 3.643 N/A