Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1hxh_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 3.A NH2 GLU 233.A OE1 no hydrogen 3.552 N/A LEU 4.A N GLU 29.A O no hydrogen 2.659 N/A GLN 5.A N ASN 2.A O no hydrogen 3.074 N/A LYS 7.A N LEU 4.A O no hydrogen 2.957 N/A LYS 7.A NZ ASP 232.A OD1 no hydrogen 2.759 N/A VAL 8.A N ASN 82.A OD1 no hydrogen 2.903 N/A ALA 9.A N LYS 32.A O no hydrogen 2.851 N/A LEU 10.A N VAL 83.A O no hydrogen 3.053 N/A VAL 11.A N ALA 34.A O no hydrogen 2.927 N/A THR 12.A N VAL 85.A O no hydrogen 3.053 N/A THR 12.A OG1 VAL 85.A O no hydrogen 3.409 N/A GLY 14.A N SER 36.A O no hydrogen 2.837 N/A ALA 15.A N ASP 37.A OD2 no hydrogen 2.979 N/A LEU 20.A N SER 16.A O no hydrogen 3.159 N/A GLU 21.A N GLY 17.A O no hydrogen 3.078 N/A VAL 22.A N VAL 18.A O no hydrogen 2.786 N/A VAL 23.A N GLY 19.A O no hydrogen 2.904 N/A LYS 24.A N LEU 20.A O no hydrogen 2.968 N/A LYS 24.A NZ GLU 21.A OE1 no hydrogen 3.342 N/A LYS 24.A NZ GLU 21.A OE2 no hydrogen 2.828 N/A LEU 25.A N GLU 21.A O no hydrogen 2.944 N/A LEU 26.A N VAL 22.A O no hydrogen 2.909 N/A LEU 27.A N VAL 23.A O no hydrogen 2.982 N/A GLY 28.A N LYS 24.A O no hydrogen 2.907 N/A GLU 29.A N LEU 25.A O no hydrogen 3.156 N/A GLU 29.A N LEU 26.A O no hydrogen 3.093 N/A GLY 30.A N LEU 27.A O no hydrogen 2.959 N/A ALA 31.A N LEU 26.A O no hydrogen 3.138 N/A LYS 32.A N LYS 7.A O no hydrogen 2.917 N/A VAL 33.A N ARG 53.A O no hydrogen 2.863 N/A ALA 34.A N ALA 9.A O no hydrogen 2.830 N/A PHE 35.A N MET 55.A O no hydrogen 2.874 N/A SER 36.A N VAL 11.A O no hydrogen 3.098 N/A SER 36.A OG HIS 59.A ND1 no hydrogen 3.387 N/A ASN 39.A N ASP 37.A OD1 no hydrogen 2.736 N/A ALA 42.A N ASN 39.A OD1 no hydrogen 2.934 N/A GLY 43.A N ASN 39.A O no hydrogen 2.904 N/A GLN 44.A N GLU 40.A O no hydrogen 2.874 N/A GLN 44.A NE2 GLN 44.A O no hydrogen 3.320 N/A GLN 45.A N ALA 41.A O no hydrogen 3.396 N/A LEU 46.A N.A ALA 42.A O no hydrogen 2.934 N/A LEU 46.A N.B ALA 42.A O no hydrogen 2.936 N/A ALA 47.A N GLY 43.A O no hydrogen 2.975 N/A ALA 48.A N GLN 44.A O no hydrogen 3.074 N/A GLU 49.A N GLN 45.A O no hydrogen 3.129 N/A LEU 50.A N LEU 46.A O.A no hydrogen 2.792 N/A LEU 50.A N LEU 46.A O.B no hydrogen 2.937 N/A GLY 51.A N ALA 47.A O no hydrogen 3.277 N/A ARG 53.A NE.A GLY 30.A O no hydrogen 3.324 N/A ARG 53.A NE.A ALA 31.A O no hydrogen 3.501 N/A ARG 53.A NH1.B LEU 27.A O no hydrogen 2.789 N/A ARG 53.A NH1.B ALA 31.A O no hydrogen 2.849 N/A ARG 53.A NH2.A GLY 30.A O no hydrogen 2.948 N/A ARG 53.A NH2.B LEU 27.A O no hydrogen 3.514 N/A SER 54.A N GLY 51.A O no hydrogen 2.973 N/A SER 54.A OG GLY 51.A O no hydrogen 2.893 N/A MET 55.A N VAL 33.A O no hydrogen 3.047 N/A VAL 57.A N PHE 35.A O no hydrogen 2.942 N/A ARG 58.A NE GLU 40.A OE2 no hydrogen 2.778 N/A ARG 58.A NH2 GLU 40.A OE1 no hydrogen 2.787 N/A ARG 58.A NH2 GLU 40.A OE2 no hydrogen 3.483 N/A ASP 60.A N ASP 66.A OD2 no hydrogen 2.723 N/A SER 62.A N ASP 60.A OD2 no hydrogen 3.017 N/A SER 62.A OG ASP 60.A OD1 no hydrogen 3.522 N/A SER 62.A OG ASP 60.A OD2 no hydrogen 2.696 N/A SER 63.A N ASP 60.A O no hydrogen 3.047 N/A ASP 66.A N SER 63.A OG no hydrogen 2.977 N/A TRP 67.A N SER 63.A O no hydrogen 3.008 N/A TRP 67.A NE1 VAL 61.A O no hydrogen 2.782 N/A THR 68.A N GLU 64.A O.A no hydrogen 3.165 N/A THR 68.A N GLU 64.A O.B no hydrogen 2.805 N/A THR 68.A OG1 GLU 64.A O.A no hydrogen 2.837 N/A THR 68.A OG1 GLU 64.A O.B no hydrogen 3.043 N/A LEU 69.A N ALA 65.A O no hydrogen 3.120 N/A VAL 70.A N ASP 66.A O no hydrogen 2.872 N/A MET 71.A N TRP 67.A O no hydrogen 2.831 N/A ALA 72.A N THR 68.A O no hydrogen 3.160 N/A ALA 73.A N LEU 69.A O no hydrogen 2.893 N/A VAL 74.A N VAL 70.A O no hydrogen 2.806 N/A GLN 75.A N MET 71.A O no hydrogen 3.148 N/A GLN 75.A NE2 MET 71.A O no hydrogen 3.204 N/A ARG 76.A N ALA 72.A O no hydrogen 2.945 N/A ARG 77.A N ALA 73.A O no hydrogen 3.169 N/A ARG 77.A NH2 GLU 52.A O no hydrogen 3.249 N/A ARG 77.A NH2 SER 54.A O no hydrogen 2.950 N/A LEU 78.A N VAL 74.A O no hydrogen 2.818 N/A GLY 79.A N GLN 75.A O no hydrogen 2.909 N/A LEU 81.A N GLN 75.A OE1 no hydrogen 2.910 N/A ASN 82.A N VAL 8.A O no hydrogen 2.912 N/A ASN 82.A ND2 GLY 6.A O no hydrogen 3.186 N/A VAL 83.A N VAL 8.A O no hydrogen 3.092 N/A LEU 84.A N SER 132.A O no hydrogen 2.937 N/A VAL 85.A N LEU 10.A O no hydrogen 2.858 N/A ASN 86.A N ILE 134.A O no hydrogen 2.848 N/A ASN 86.A ND2 ASN 135.A OD1 no hydrogen 2.881 N/A ASN 87.A N THR 12.A OG1 no hydrogen 3.034 N/A ASN 87.A ND2 THR 12.A O no hydrogen 3.048 N/A ALA 88.A N THR 12.A OG1 no hydrogen 2.977 N/A ILE 90.A N ASN 111.A OD1 no hydrogen 2.786 N/A GLY 94.A N GLN 147.A O no hydrogen 2.736 N/A THR 98.A N ASP 95.A OD1 no hydrogen 2.726 N/A THR 98.A OG1 ASP 95.A OD1 no hydrogen 3.144 N/A GLY 99.A N ASP 95.A O no hydrogen 2.781 N/A PHE 104.A N ARG 100.A O no hydrogen 3.051 N/A SER 105.A N LEU 101.A O no hydrogen 2.857 N/A SER 105.A OG.A LEU 101.A O no hydrogen 3.182 N/A ARG 106.A N GLU 102.A O no hydrogen 3.026 N/A LEU 107.A N ASP 103.A O no hydrogen 2.908 N/A LEU 108.A N PHE 104.A O no hydrogen 2.968 N/A LYS 109.A N SER 105.A O no hydrogen 3.009 N/A ILE 110.A N ARG 106.A O no hydrogen 2.917 N/A ASN 111.A N LEU 107.A O no hydrogen 2.790 N/A ASN 111.A ND2 ILE 90.A O no hydrogen 3.032 N/A ASN 111.A ND2 SER 154.A OG no hydrogen 3.052 N/A THR 112.A N LEU 108.A O no hydrogen 2.992 N/A THR 112.A OG1 SER 154.A O no hydrogen 2.967 N/A GLU 113.A N LEU 108.A O no hydrogen 2.908 N/A SER 114.A OG ILE 110.A O no hydrogen 2.533 N/A PHE 116.A N THR 112.A O no hydrogen 3.081 N/A ILE 117.A N GLU 113.A O no hydrogen 2.997 N/A GLY 118.A N SER 114.A O no hydrogen 2.821 N/A CYS 119.A N VAL 115.A O no hydrogen 2.831 N/A CYS 119.A SG VAL 115.A O no hydrogen 3.380 N/A CYS 119.A SG ASN 135.A OD1 no hydrogen 3.739 N/A GLN 120.A N PHE 116.A O no hydrogen 2.894 N/A GLN 121.A N ILE 117.A O no hydrogen 2.857 N/A GLN 121.A NE2 GLU 64.A O.A no hydrogen 3.296 N/A GLN 121.A NE2 GLU 64.A O.B no hydrogen 3.494 N/A GLN 121.A NE2 THR 68.A OG1 no hydrogen 3.274 N/A GLY 122.A N GLY 118.A O no hydrogen 2.755 N/A ILE 123.A N CYS 119.A O no hydrogen 2.882 N/A ALA 124.A N GLN 120.A O no hydrogen 3.304 N/A ALA 125.A N GLN 121.A O no hydrogen 2.985 N/A MET 126.A N GLY 122.A O no hydrogen 2.926 N/A MET 126.A N ILE 123.A O no hydrogen 3.253 N/A LYS 127.A NZ TYR 174.A OH no hydrogen 3.089 N/A GLY 130.A N.A MET 126.A O no hydrogen 2.676 N/A GLY 130.A N.B MET 126.A O no hydrogen 2.756 N/A GLY 131.A N ALA 175.A O no hydrogen 2.948 N/A SER 132.A N ASN 82.A O no hydrogen 2.948 N/A SER 132.A OG LEU 229.A O no hydrogen 2.711 N/A ILE 133.A N ARG 177.A O no hydrogen 2.841 N/A ILE 134.A N LEU 84.A O no hydrogen 2.825 N/A ASN 135.A N ASN 179.A O no hydrogen 2.835 N/A ASN 135.A ND2 THR 162.A OG1 no hydrogen 2.860 N/A MET 136.A N ASN 86.A O no hydrogen 2.930 N/A ALA 137.A N ILE 181.A O no hydrogen 2.721 N/A SER 138.A OG SER 140.A OG no hydrogen 2.860 N/A VAL 139.A N PRO 183.A O no hydrogen 2.768 N/A SER 140.A N SER 138.A OG no hydrogen 2.989 N/A SER 140.A OG SER 138.A OG no hydrogen 2.860 N/A SER 141.A N SER 138.A O no hydrogen 3.015 N/A SER 141.A OG SER 138.A O no hydrogen 2.976 N/A SER 141.A OG HIS 182.A ND1 no hydrogen 2.940 N/A TRP 142.A N VAL 139.A O no hydrogen 3.137 N/A LEU 143.A N VAL 139.A O no hydrogen 2.893 N/A GLN 147.A N GLN 147.A OE1.A no hydrogen 2.838 N/A TYR 148.A N ILE 145.A O.A no hydrogen 3.224 N/A TYR 148.A N ILE 145.A O.B no hydrogen 2.965 N/A ALA 149.A N GLY 94.A O no hydrogen 3.269 N/A SER 152.A N TYR 148.A O no hydrogen 2.927 N/A SER 152.A OG SER 140.A O no hydrogen 2.880 N/A SER 152.A OG TYR 148.A O no hydrogen 3.196 N/A ALA 153.A N ALA 149.A O no hydrogen 3.085 N/A SER 154.A N GLY 150.A O no hydrogen 2.907 N/A SER 154.A OG TYR 151.A O no hydrogen 2.799 N/A LYS 155.A N TYR 151.A O no hydrogen 3.012 N/A LYS 155.A NZ MET 136.A O no hydrogen 2.810 N/A ALA 156.A N SER 152.A O no hydrogen 2.860 N/A ALA 157.A N ALA 153.A O no hydrogen 2.989 N/A VAL 158.A N SER 154.A O no hydrogen 3.099 N/A SER 159.A N LYS 155.A O no hydrogen 3.032 N/A SER 159.A OG.A GLU 241.A OE2 no hydrogen 2.619 N/A SER 159.A OG.B LYS 155.A O no hydrogen 3.244 N/A SER 159.A OG.B GLU 241.A OE2 no hydrogen 3.557 N/A ALA 160.A N ALA 156.A O no hydrogen 3.078 N/A LEU 161.A N ALA 157.A O no hydrogen 2.934 N/A THR 162.A N VAL 158.A O no hydrogen 2.939 N/A THR 162.A OG1 VAL 158.A O no hydrogen 2.857 N/A ARG 163.A N SER 159.A O no hydrogen 3.115 N/A ALA 164.A N ALA 160.A O no hydrogen 3.040 N/A ALA 165.A N LEU 161.A O no hydrogen 2.887 N/A ALA 166.A N THR 162.A O no hydrogen 2.916 N/A LEU 167.A N ARG 163.A O no hydrogen 2.921 N/A SER 168.A N ALA 164.A O no hydrogen 2.955 N/A SER 168.A OG ALA 164.A O no hydrogen 3.446 N/A CYS 169.A N ALA 165.A O no hydrogen 2.974 N/A CYS 169.A SG ALA 165.A O no hydrogen 3.323 N/A ARG 170.A N ALA 166.A O no hydrogen 2.981 N/A LYS 171.A N LEU 167.A O no hydrogen 2.887 N/A GLN 172.A N SER 168.A O no hydrogen 2.891 N/A GLY 173.A N ARG 170.A O no hydrogen 3.189 N/A TYR 174.A N CYS 169.A O no hydrogen 2.902 N/A ARG 177.A N GLY 131.A O no hydrogen 3.058 N/A ARG 177.A NH2 SER 234.A OG no hydrogen 3.272 N/A VAL 178.A N SER 238.A OG no hydrogen 3.191 N/A ASN 179.A N ILE 133.A O no hydrogen 3.133 N/A ASN 179.A ND2 MET 237.A O no hydrogen 2.995 N/A SER 180.A N SER 240.A O no hydrogen 2.945 N/A SER 180.A OG HIS 182.A NE2 no hydrogen 2.715 N/A ILE 181.A N ASN 135.A O no hydrogen 3.050 N/A HIS 182.A N LEU 242.A O no hydrogen 2.881 N/A HIS 182.A ND1 SER 138.A O no hydrogen 3.069 N/A HIS 182.A ND1 SER 141.A OG no hydrogen 2.940 N/A HIS 182.A NE2 SER 180.A OG no hydrogen 2.715 N/A GLY 185.A N ARG 215.A O no hydrogen 2.823 N/A TYR 187.A N TYR 217.A O no hydrogen 2.858 N/A TYR 187.A OH GLN 192.A OE1 no hydrogen 2.512 N/A GLN 192.A N THR 188.A O no hydrogen 2.766 N/A GLN 192.A NE2 GLN 192.A O no hydrogen 2.888 N/A GLN 192.A NE2 VAL 199.A O no hydrogen 2.710 N/A ALA 193.A N PRO 189.A O no hydrogen 2.687 N/A SER 194.A N MET 190.A O no hydrogen 2.892 N/A SER 194.A OG MET 191.A O no hydrogen 2.622 N/A LEU 195.A N GLN 192.A O no hydrogen 3.347 N/A VAL 199.A N PRO 196.A O no hydrogen 3.113 N/A SER 200.A OG GLU 202.A OE1 no hydrogen 3.159 N/A MET 203.A N SER 200.A O no hydrogen 2.994 N/A VAL 204.A N LYS 201.A O no hydrogen 3.236 N/A LEU 205.A N LYS 201.A O no hydrogen 2.767 N/A HIS 206.A N ALA 216.A O no hydrogen 2.921 N/A ASP 207.A N ASN 211.A O no hydrogen 3.090 N/A LYS 209.A N ASP 207.A OD1 no hydrogen 2.950 N/A LEU 210.A N ASP 207.A OD1 no hydrogen 2.918 N/A ASN 211.A N ASP 207.A O no hydrogen 2.875 N/A GLY 214.A N ASN 211.A O no hydrogen 3.009 N/A ARG 215.A NE ASP 184.A OD1 no hydrogen 3.333 N/A ARG 215.A NE ASP 184.A OD2 no hydrogen 2.820 N/A ARG 215.A NH2 ASP 184.A OD1 no hydrogen 2.860 N/A ALA 216.A N VAL 204.A O no hydrogen 3.160 N/A TYR 217.A N GLY 185.A O no hydrogen 2.895 N/A ARG 221.A N MET 218.A O no hydrogen 2.888 N/A ARG 221.A NE GLU 220.A OE1 no hydrogen 2.734 N/A ARG 221.A NH2 GLU 220.A OE1 no hydrogen 3.023 N/A ARG 221.A NH2 GLU 220.A OE2 no hydrogen 2.668 N/A ALA 223.A N PRO 219.A O no hydrogen 2.911 N/A GLN 224.A N GLU 220.A O no hydrogen 3.044 N/A LEU 225.A N ILE 222.A O no hydrogen 2.953 N/A VAL 226.A N ILE 222.A O no hydrogen 3.355 N/A LEU 227.A N ALA 223.A O no hydrogen 2.918 N/A PHE 228.A N GLN 224.A O no hydrogen 3.039 N/A LEU 229.A N LEU 225.A O no hydrogen 3.002 N/A ALA 230.A N VAL 226.A O no hydrogen 2.835 N/A SER 231.A N LEU 227.A O no hydrogen 3.092 N/A SER 231.A N PHE 228.A O no hydrogen 3.147 N/A SER 231.A OG.A PHE 228.A O no hydrogen 2.832 N/A SER 231.A OG.A GLU 233.A OE1 no hydrogen 3.370 N/A SER 231.A OG.B LEU 227.A O no hydrogen 2.891 N/A SER 234.A N SER 231.A O no hydrogen 3.325 N/A SER 234.A OG PHE 228.A O no hydrogen 2.993 N/A SER 234.A OG LEU 229.A O no hydrogen 3.179 N/A SER 234.A OG SER 231.A O no hydrogen 3.069 N/A SER 235.A N ASP 232.A O no hydrogen 3.217 N/A SER 235.A OG ASP 232.A O no hydrogen 3.391 N/A MET 237.A N SER 234.A O no hydrogen 2.933 N/A GLY 239.A N VAL 178.A O no hydrogen 2.722 N/A SER 240.A N ASN 179.A OD1 no hydrogen 3.050 N/A SER 240.A OG.A ASN 179.A OD1 no hydrogen 2.856 N/A LEU 242.A N SER 180.A O no hydrogen 2.778 N/A HIS 243.A NE2 GLU 241.A OE1 no hydrogen 2.727 N/A ALA 244.A N HIS 182.A O no hydrogen 2.986 N/A ASN 246.A ND2 TYR 217.A OH no hydrogen 3.013 N/A ILE 248.A N ASP 245.A OD2 no hydrogen 3.208 N/A MET 251.A N ILE 248.A O no hydrogen 2.948 N/A