Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6cac_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 2.A N HIS 2.A ND1 no hydrogen 2.982 N/A GLN 8.A N PHE 15.A O no hydrogen 2.757 N/A PHE 10.A N LEU 13.A O no hydrogen 2.977 N/A LEU 13.A N PHE 10.A O no hydrogen 2.963 N/A VAL 14.A N THR 26.A O no hydrogen 3.035 N/A PHE 15.A N GLN 8.A O no hydrogen 2.899 N/A ARG 16.A N GLN 24.A O no hydrogen 3.018 N/A ARG 16.A NE ASP 7.A OD1 no hydrogen 2.877 N/A ARG 16.A NH2 ASP 7.A OD1 no hydrogen 2.914 N/A GLN 17.A NE2 ALA 19.A O no hydrogen 3.256 N/A GLN 17.A NE2 PRO 20.A O no hydrogen 3.128 N/A LEU 18.A N VAL 22.A O no hydrogen 2.816 N/A ALA 19.A N VAL 22.A O no hydrogen 3.185 N/A VAL 22.A N ALA 19.A O no hydrogen 3.169 N/A TRP 23.A N ILE 44.A O no hydrogen 2.916 N/A GLN 24.A N ARG 16.A O no hydrogen 2.793 N/A HIS 25.A N GLY 42.A O no hydrogen 2.981 N/A HIS 25.A NE2 ASP 55.A O no hydrogen 2.982 N/A THR 26.A N VAL 14.A O no hydrogen 2.740 N/A THR 26.A OG1 ASN 41.A OD1 no hydrogen 2.729 N/A SER 27.A N SER 40.A O no hydrogen 3.106 N/A LEU 29.A N VAL 37.A O no hydrogen 2.788 N/A MET 31.A N GLY 35.A O no hydrogen 2.893 N/A PHE 34.A N MET 31.A O no hydrogen 3.029 N/A GLY 35.A N MET 31.A O no hydrogen 2.842 N/A VAL 37.A N LEU 29.A O no hydrogen 2.929 N/A SER 40.A N SER 27.A O no hydrogen 2.855 N/A SER 40.A OG ASP 89.A OD2 no hydrogen 3.455 N/A ASN 41.A N SER 214.A O no hydrogen 2.781 N/A ASN 41.A ND2 MET 213.A O no hydrogen 2.984 N/A GLY 42.A N HIS 25.A O no hydrogen 2.939 N/A LEU 43.A N VAL 54.A O no hydrogen 2.882 N/A ILE 44.A N TRP 23.A O no hydrogen 2.841 N/A VAL 45.A N LEU 52.A O no hydrogen 2.788 N/A ARG 46.A N ASN 21.A O no hydrogen 2.868 N/A ARG 46.A NE ASN 21.A OD1 no hydrogen 2.843 N/A ARG 46.A NH2 PRO 20.A O no hydrogen 2.890 N/A ARG 46.A NH2 ASN 21.A OD1 no hydrogen 3.311 N/A ASP 47.A N ARG 50.A O no hydrogen 2.807 N/A ARG 50.A N ASP 47.A O no hydrogen 3.307 N/A ARG 50.A NE ASP 47.A OD2 no hydrogen 2.994 N/A ARG 50.A NH1 ASN 141.A O no hydrogen 3.069 N/A ARG 50.A NH2 ASP 47.A OD2 no hydrogen 2.827 N/A ARG 50.A NH2 ASN 141.A O no hydrogen 2.793 N/A VAL 51.A N PRO 77.A O no hydrogen 2.862 N/A LEU 52.A N VAL 45.A O no hydrogen 2.799 N/A VAL 53.A N LEU 80.A O no hydrogen 3.070 N/A VAL 54.A N LEU 43.A O no hydrogen 2.843 N/A ASP 55.A N VAL 82.A O no hydrogen 2.843 N/A THR 56.A N LYS 90.A O no hydrogen 2.926 N/A THR 56.A OG1 ALA 57.A O no hydrogen 2.762 N/A ALA 57.A N THR 63.A OG1 no hydrogen 3.027 N/A TRP 58.A N SER 27.A OG no hydrogen 3.380 N/A TRP 58.A NE1 ALA 38.A O no hydrogen 2.970 N/A THR 59.A OG1 GLN 62.A OE1 no hydrogen 3.101 N/A GLN 62.A N THR 59.A OG1 no hydrogen 3.150 N/A GLN 62.A NE2 ASP 12.A OD2 no hydrogen 3.433 N/A GLN 62.A NE2 TYR 28.A O no hydrogen 2.847 N/A THR 63.A N THR 59.A O no hydrogen 2.974 N/A THR 63.A OG1 THR 59.A O no hydrogen 2.781 N/A ALA 64.A N ASP 60.A O no hydrogen 2.855 N/A GLN 65.A N ASP 61.A O no hydrogen 3.096 N/A ILE 66.A N GLN 62.A O no hydrogen 3.008 N/A LEU 67.A N THR 63.A O no hydrogen 3.149 N/A ASN 68.A N ALA 64.A O no hydrogen 3.005 N/A TRP 69.A N GLN 65.A O no hydrogen 2.929 N/A ILE 70.A N ILE 66.A O no hydrogen 2.907 N/A LYS 71.A N LEU 67.A O no hydrogen 2.986 N/A LYS 71.A NZ ASN 75.A OD1 no hydrogen 2.821 N/A GLN 72.A N ASN 68.A O no hydrogen 3.052 N/A GLN 72.A NE2 GLU 73.A OE2 no hydrogen 2.819 N/A GLU 73.A N TRP 69.A O no hydrogen 2.795 N/A ILE 74.A N ILE 70.A O no hydrogen 2.817 N/A ASN 75.A N ILE 70.A O no hydrogen 2.896 N/A ALA 79.A N VAL 51.A O no hydrogen 2.874 N/A ALA 81.A N ALA 103.A O no hydrogen 2.976 N/A VAL 82.A N VAL 53.A O no hydrogen 2.881 N/A VAL 83.A N TYR 105.A O no hydrogen 3.017 N/A THR 84.A N ASP 55.A OD1 no hydrogen 2.738 N/A THR 84.A OG1 ASP 55.A OD1 no hydrogen 2.951 N/A THR 84.A OG1 ASP 55.A OD2 no hydrogen 3.048 N/A HIS 85.A NE2 HIS 87.A ND1 no hydrogen 3.115 N/A ALA 86.A N ASP 157.A OD2 no hydrogen 2.924 N/A HIS 87.A N HIS 85.A O no hydrogen 3.056 N/A HIS 87.A NE2 ASP 188.A OD2 no hydrogen 2.797 N/A GLN 88.A NE2.A TRP 58.A O no hydrogen 3.069 N/A GLN 88.A NE2.B TRP 58.A O no hydrogen 2.852 N/A LYS 90.A N HIS 87.A O no hydrogen 3.031 N/A LYS 90.A NZ ASP 55.A OD2 no hydrogen 2.879 N/A LYS 90.A NZ SER 214.A OG no hydrogen 2.786 N/A MET 91.A N HIS 87.A O no hydrogen 2.935 N/A GLY 92.A N GLN 88.A O no hydrogen 2.837 N/A GLY 93.A N THR 56.A OG1 no hydrogen 2.994 N/A MET 94.A N MET 91.A O no hydrogen 3.439 N/A ALA 96.A N ASP 60.A OD1 no hydrogen 3.332 N/A ALA 96.A N GLY 93.A O no hydrogen 3.146 N/A LEU 97.A N GLY 93.A O no hydrogen 3.338 N/A HIS 98.A N MET 94.A O no hydrogen 3.014 N/A HIS 98.A NE2 THR 104.A OG1 no hydrogen 2.701 N/A ALA 99.A N ASP 95.A O no hydrogen 2.900 N/A ALA 100.A N ALA 96.A O no hydrogen 3.200 N/A ALA 100.A N LEU 97.A O no hydrogen 3.122 N/A GLY 101.A N HIS 98.A O no hydrogen 3.087 N/A ILE 102.A N LEU 97.A O no hydrogen 3.083 N/A THR 104.A N GLN 123.A OE1 no hydrogen 3.147 N/A THR 104.A OG1 HIS 98.A NE2 no hydrogen 2.701 N/A TYR 105.A N ALA 81.A O no hydrogen 2.900 N/A ALA 106.A N HIS 124.A O no hydrogen 3.196 N/A ASN 107.A ND2 ASP 157.A O no hydrogen 3.072 N/A ALA 108.A N LEU 126.A O no hydrogen 2.892 N/A LEU 109.A N ASN 107.A OD1 no hydrogen 3.183 N/A SER 110.A OG ASP 157.A OD2 no hydrogen 2.617 N/A ASN 111.A N ASN 107.A O no hydrogen 3.095 N/A ASN 111.A ND2 HIS 124.A O no hydrogen 3.074 N/A ASN 111.A ND2 SER 125.A OG no hydrogen 2.895 N/A GLN 112.A N ALA 108.A O no hydrogen 2.950 N/A LEU 113.A N LEU 109.A O no hydrogen 2.851 N/A ALA 114.A N SER 110.A O no hydrogen 2.857 N/A GLN 116.A NE2 GLN 112.A O no hydrogen 3.299 N/A GLU 117.A N LEU 113.A O no hydrogen 3.039 N/A GLU 117.A N ALA 114.A O no hydrogen 3.024 N/A GLY 118.A N PRO 115.A O no hydrogen 3.228 N/A MET 119.A N ALA 114.A O no hydrogen 2.798 N/A ALA 122.A N ASN 111.A OD1 no hydrogen 2.818 N/A GLN 123.A N THR 104.A OG1 no hydrogen 2.867 N/A HIS 124.A N THR 104.A O no hydrogen 2.914 N/A HIS 124.A ND1 THR 104.A O no hydrogen 2.935 N/A LEU 126.A N ALA 106.A O no hydrogen 2.780 N/A THR 127.A N THR 138.A OG1 no hydrogen 3.220 N/A ALA 129.A N TRP 133.A O no hydrogen 2.920 N/A GLY 132.A N ALA 129.A O no hydrogen 2.938 N/A TRP 133.A N ASN 131.A OD1 no hydrogen 3.182 N/A VAL 134.A N VAL 147.A O no hydrogen 3.135 N/A GLU 135.A N THR 127.A O no hydrogen 2.832 N/A THR 138.A N GLU 135.A O no hydrogen 2.934 N/A THR 138.A OG1 GLU 135.A O no hydrogen 2.816 N/A ALA 139.A N PRO 136.A O no hydrogen 3.072 N/A LEU 145.A N PHE 142.A O no hydrogen 2.984 N/A LYS 146.A N GLY 162.A O no hydrogen 2.870 N/A PHE 148.A N THR 160.A O no hydrogen 2.913 N/A TYR 149.A N GLY 132.A O no hydrogen 2.760 N/A TYR 149.A OH SER 156.A O no hydrogen 2.633 N/A GLY 153.A N THR 155.A O no hydrogen 2.999 N/A THR 155.A N ASN 158.A OD1 no hydrogen 3.173 N/A THR 155.A OG1 ASP 157.A OD1 no hydrogen 2.753 N/A ASN 158.A ND2 GLY 151.A O no hydrogen 3.016 N/A ASN 158.A ND2 ASN 158.A O no hydrogen 2.780 N/A ILE 159.A N THR 84.A O no hydrogen 2.928 N/A THR 160.A N PHE 148.A O no hydrogen 2.825 N/A THR 160.A OG1 PHE 148.A O no hydrogen 2.866 N/A VAL 161.A N PHE 170.A O no hydrogen 3.027 N/A GLY 162.A N LYS 146.A O no hydrogen 2.870 N/A ILE 163.A N ILE 168.A O no hydrogen 3.058 N/A ASP 164.A N PRO 144.A O no hydrogen 2.839 N/A THR 166.A N ILE 163.A O no hydrogen 3.213 N/A THR 166.A OG1 ILE 163.A O no hydrogen 2.752 N/A ILE 168.A N THR 166.A OG1 no hydrogen 2.998 N/A ALA 169.A N MET 210.A O no hydrogen 3.103 N/A PHE 170.A N VAL 161.A O no hydrogen 2.752 N/A GLY 171.A N VAL 212.A O no hydrogen 2.863 N/A CYS 173.A SG ASP 89.A OD2 no hydrogen 3.563 N/A CYS 173.A SG SER 214.A OG no hydrogen 3.139 N/A CYS 173.A SG HIS 215.A NE2 no hydrogen 3.683 N/A LEU 174.A N GLY 171.A O no hydrogen 3.190 N/A LYS 176.A N THR 227.A OG1 no hydrogen 2.968 N/A LYS 176.A NZ SER 182.A O no hydrogen 3.096 N/A ASP 177.A N SER 216.A OG no hydrogen 3.133 N/A SER 178.A N ASP 219.A OD2 no hydrogen 2.806 N/A SER 178.A OG ASP 219.A OD2 no hydrogen 2.816 N/A LYS 179.A N ASP 177.A OD1 no hydrogen 2.956 N/A ALA 180.A N ASP 177.A O no hydrogen 3.233 N/A GLY 184.A N SER 182.A OG no hydrogen 3.120 N/A ALA 189.A N LEU 186.A O no hydrogen 3.153 N/A ASP 190.A N GLY 153.A O no hydrogen 2.856 N/A HIS 193.A N ASP 190.A OD1 no hydrogen 3.035 N/A HIS 193.A ND1 ASP 190.A OD2 no hydrogen 2.760 N/A TYR 194.A N ASP 190.A O no hydrogen 2.987 N/A TYR 194.A OH LEU 174.A O no hydrogen 2.737 N/A SER 197.A N HIS 193.A O no hydrogen 3.015 N/A SER 197.A OG PRO 150.A O no hydrogen 3.352 N/A SER 197.A OG PRO 152.A O no hydrogen 2.710 N/A SER 197.A OG HIS 193.A O no hydrogen 3.112 N/A ALA 198.A N TYR 194.A O no hydrogen 2.930 N/A ARG 199.A N ALA 195.A O no hydrogen 3.045 N/A ARG 199.A NH1 ASP 232.A OD1 no hydrogen 3.002 N/A ARG 199.A NH2 ASP 232.A OD2 no hydrogen 2.817 N/A ALA 200.A N ALA 196.A O no hydrogen 2.801 N/A PHE 201.A N SER 197.A O no hydrogen 3.039 N/A GLY 202.A N ALA 198.A O no hydrogen 3.251 N/A ALA 203.A N ARG 199.A O no hydrogen 3.014 N/A ALA 204.A N ALA 200.A O no hydrogen 2.902 N/A ALA 204.A N PHE 201.A O no hydrogen 3.223 N/A PHE 205.A N PHE 201.A O no hydrogen 3.309 N/A MET 210.A N ASP 167.A O no hydrogen 2.910 N/A ILE 211.A N ASP 219.A O no hydrogen 2.807 N/A VAL 212.A N ALA 169.A O no hydrogen 2.939 N/A SER 214.A N GLY 172.A O no hydrogen 3.026 N/A HIS 215.A ND1 PRO 39.A O no hydrogen 2.939 N/A ASP 219.A N ILE 211.A O no hydrogen 2.881 N/A SER 220.A N ASP 219.A OD1 no hydrogen 2.804 N/A ARG 221.A NH1 PHE 205.A O no hydrogen 2.817 N/A ARG 221.A NH1 ALA 208.A O no hydrogen 2.821 N/A ARG 221.A NH2 GLY 202.A O no hydrogen 2.853 N/A ALA 222.A N SER 220.A OG no hydrogen 3.121 N/A ALA 223.A N SER 220.A O no hydrogen 3.135 N/A ILE 224.A N ARG 221.A O no hydrogen 2.934 N/A THR 225.A N ARG 221.A O no hydrogen 3.475 N/A HIS 226.A N ALA 222.A O no hydrogen 2.866 N/A THR 227.A N ALA 223.A O no hydrogen 2.942 N/A THR 227.A OG1 ALA 223.A O no hydrogen 2.761 N/A ALA 228.A N ILE 224.A O no hydrogen 2.956 N/A ARG 229.A N THR 225.A O no hydrogen 2.899 N/A MET 230.A N HIS 226.A O no hydrogen 2.949 N/A ALA 231.A N THR 227.A O no hydrogen 2.828 N/A ASP 232.A N ALA 228.A O no hydrogen 2.839 N/A LYS 233.A N MET 230.A O no hydrogen 3.291 N/A LYS 233.A NZ ARG 229.A O no hydrogen 3.427 N/A LEU 234.A N ALA 231.A O no hydrogen 3.050 N/A