Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3wp5_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 3.A NE2 THR 176.A OG1 no hydrogen 2.738 N/A CYS 6.A N GLN 3.A O no hydrogen 3.016 N/A SER 7.A N SER 4.A O no hydrogen 2.921 N/A SER 8.A N SER 4.A O no hydrogen 3.226 N/A ALA 9.A N PHE 5.A O no hydrogen 2.937 N/A HIS 11.A ND1 SER 49.A OG no hydrogen 2.666 N/A HIS 11.A NE2 ASP 217.A OD1 no hydrogen 2.624 N/A SER 12.A N ASP 47.A OD2 no hydrogen 2.932 N/A SER 12.A OG ASP 47.A OD2 no hydrogen 2.904 N/A GLN 14.A N SER 46.A OG no hydrogen 3.009 N/A VAL 16.A N PHE 44.A O no hydrogen 2.937 N/A VAL 18.A N ALA 42.A O no hydrogen 2.931 N/A ASN 21.A ND2 ALA 35.A O no hydrogen 3.389 N/A LYS 22.A N LEU 33.A O no hydrogen 3.030 N/A LYS 22.A NZ VAL 23.A O no hydrogen 3.031 N/A GLY 24.A N TYR 31.A O no hydrogen 3.011 N/A ILE 26.A N VAL 29.A O no hydrogen 2.927 N/A VAL 29.A N ILE 26.A O no hydrogen 3.030 N/A GLY 30.A N GLY 65.A O no hydrogen 2.889 N/A TYR 31.A N GLY 24.A O no hydrogen 2.863 N/A GLU 32.A N ARG 63.A O no hydrogen 2.921 N/A LEU 33.A N LYS 22.A O no hydrogen 2.966 N/A TRP 34.A N LEU 61.A O no hydrogen 2.975 N/A ALA 35.A N ASN 21.A OD1 no hydrogen 2.893 N/A ASP 36.A N ASP 59.A O no hydrogen 3.030 N/A SER 37.A OG ASP 36.A OD1 no hydrogen 2.915 N/A ASN 39.A N GLN 55.A O no hydrogen 2.946 N/A ASN 39.A ND2 GLN 55.A OE1 no hydrogen 3.350 N/A ASN 40.A ND2 SER 37.A O no hydrogen 2.834 N/A SER 41.A N THR 53.A O no hydrogen 2.890 N/A SER 41.A OG THR 53.A OG1 no hydrogen 2.513 N/A ALA 42.A N VAL 18.A O no hydrogen 2.966 N/A THR 43.A N SER 51.A O no hydrogen 2.923 N/A PHE 44.A N VAL 16.A O no hydrogen 2.920 N/A TYR 45.A N SER 49.A O no hydrogen 2.925 N/A SER 46.A N GLN 14.A O no hydrogen 2.802 N/A GLY 48.A N TYR 45.A O no hydrogen 2.984 N/A SER 49.A N ASP 47.A OD1 no hydrogen 2.926 N/A SER 49.A OG HIS 11.A ND1 no hydrogen 2.666 N/A SER 49.A OG ASP 47.A OD1 no hydrogen 2.601 N/A SER 49.A OG ASP 47.A OD2 no hydrogen 3.480 N/A PHE 50.A N PHE 218.A O no hydrogen 3.074 N/A SER 51.A N THR 43.A O no hydrogen 2.908 N/A CYS 52.A N ALA 216.A O no hydrogen 2.869 N/A THR 53.A N SER 41.A O no hydrogen 3.001 N/A THR 53.A OG1 SER 41.A OG no hydrogen 2.513 N/A PHE 54.A N GLY 214.A O no hydrogen 2.942 N/A GLN 55.A N ASN 40.A OD1 no hydrogen 2.935 N/A ASN 56.A N SER 213.A OG no hydrogen 2.934 N/A ALA 57.A N ALA 212.A O no hydrogen 2.925 N/A GLY 58.A N ASP 36.A OD1 no hydrogen 2.997 N/A GLY 58.A N SER 37.A OG no hydrogen 3.195 N/A ASP 59.A N ASP 36.A OD1 no hydrogen 2.902 N/A TYR 60.A N ALA 205.A O no hydrogen 2.847 N/A TYR 60.A OH SER 41.A O no hydrogen 2.731 N/A LEU 61.A N TRP 34.A O no hydrogen 2.805 N/A CYS 62.A N GLY 203.A O no hydrogen 2.913 N/A CYS 62.A SG GLY 203.A O no hydrogen 3.379 N/A ARG 63.A N GLU 32.A O no hydrogen 3.036 N/A ARG 63.A NE GLU 198.A OE2 no hydrogen 3.114 N/A ARG 63.A NH2 GLU 198.A OE1 no hydrogen 2.847 N/A ARG 63.A NH2 GLU 198.A OE2 no hydrogen 3.478 N/A SER 64.A N VAL 201.A O no hydrogen 2.993 N/A SER 64.A OG GLY 30.A O no hydrogen 3.388 N/A GLY 65.A N GLY 30.A O no hydrogen 2.765 N/A LEU 66.A N ALA 199.A O no hydrogen 2.857 N/A PHE 68.A N HIS 197.A O no hydrogen 2.834 N/A SER 70.A N LEU 196.A O no hydrogen 3.247 N/A THR 71.A N ASP 69.A OD1 no hydrogen 3.295 N/A THR 71.A OG1 ASP 69.A OD1 no hydrogen 2.621 N/A THR 71.A OG1 ASP 69.A OD2 no hydrogen 3.527 N/A THR 73.A N GLN 76.A OE1 no hydrogen 2.871 N/A THR 73.A OG1 SER 75.A OG no hydrogen 3.225 N/A THR 73.A OG1 GLN 76.A OE1 no hydrogen 3.425 N/A SER 75.A OG THR 73.A OG1 no hydrogen 3.225 N/A GLN 76.A N THR 73.A OG1 no hydrogen 3.406 N/A ILE 77.A N THR 73.A O no hydrogen 3.006 N/A GLY 78.A N PRO 74.A O no hydrogen 2.978 N/A ARG 79.A NH1 ASP 184.A OD1 no hydrogen 3.082 N/A ARG 79.A NH1 ASP 184.A OD2 no hydrogen 3.355 N/A ARG 79.A NH2 ASP 184.A OD2 no hydrogen 2.845 N/A MET 80.A N SER 180.A OG no hydrogen 2.872 N/A LYS 81.A N TYR 224.A O no hydrogen 2.985 N/A LYS 81.A NZ GLY 226.A O no hydrogen 2.793 N/A LYS 81.A NZ ASP 227.A OXT no hydrogen 3.095 N/A ALA 82.A N ILE 177.A O no hydrogen 2.900 N/A ASP 83.A N LYS 222.A O no hydrogen 2.852 N/A PHE 84.A N GLY 175.A O no hydrogen 2.921 N/A LYS 85.A N TYR 220.A O no hydrogen 2.889 N/A LYS 85.A NZ CYS 6.A O no hydrogen 2.695 N/A LEU 86.A N ASP 173.A O no hydrogen 2.803 N/A VAL 87.A N ASP 217.A O no hydrogen 2.750 N/A LYS 88.A NZ ASN 117.A OD1 no hydrogen 2.866 N/A LYS 88.A NZ TRP 118.A O no hydrogen 2.861 N/A SER 92.A N SER 213.A O no hydrogen 2.794 N/A TYR 96.A N GLY 206.A O no hydrogen 3.068 N/A SER 97.A OG GLU 204.A O no hydrogen 2.629 N/A TYR 98.A N GLU 204.A O no hydrogen 3.140 N/A VAL 99.A N ASN 117.A O no hydrogen 2.866 N/A GLY 100.A N LEU 202.A O no hydrogen 3.059 N/A VAL 101.A N ILE 114.A O no hydrogen 2.856 N/A TYR 102.A N LYS 200.A O no hydrogen 2.842 N/A GLY 103.A N TYR 112.A O no hydrogen 3.042 N/A THR 105.A N VAL 110.A O no hydrogen 2.835 N/A THR 105.A OG1 PRO 108.A O no hydrogen 2.823 N/A ARG 106.A N LYS 195.A O no hydrogen 2.836 N/A ARG 106.A NE ASP 156.A OD1 no hydrogen 2.793 N/A ARG 106.A NH1 SER 70.A OG no hydrogen 3.095 N/A ARG 106.A NH2 ASP 156.A OD1 no hydrogen 2.997 N/A VAL 110.A N THR 105.A O no hydrogen 3.080 N/A ALA 111.A N ASN 162.A O no hydrogen 2.988 N/A TYR 112.A N GLY 103.A O no hydrogen 2.854 N/A TYR 112.A OH GLU 198.A O no hydrogen 2.784 N/A TYR 113.A N TYR 164.A O no hydrogen 2.884 N/A ILE 114.A N VAL 101.A O no hydrogen 2.815 N/A VAL 115.A N SER 166.A O no hydrogen 2.773 N/A ASP 116.A N VAL 99.A O no hydrogen 2.830 N/A ASN 117.A N VAL 99.A O no hydrogen 3.157 N/A ASN 117.A ND2 ARG 172.A O no hydrogen 2.940 N/A TRP 118.A N ASN 117.A OD1 no hydrogen 2.846 N/A LEU 119.A N SER 97.A OG no hydrogen 2.772 N/A SER 120.A OG PHE 122.A O no hydrogen 2.744 N/A VAL 128.A N GLY 125.A O no hydrogen 3.188 N/A GLY 129.A N ASP 126.A O no hydrogen 3.509 N/A LYS 131.A N GLU 147.A O no hydrogen 3.046 N/A LYS 132.A NZ ASP 126.A OD1 no hydrogen 2.851 N/A HIS 133.A N VAL 145.A O no hydrogen 2.836 N/A PHE 136.A N TYR 143.A O no hydrogen 2.863 N/A THR 137.A OG1 GLN 142.A OE1 no hydrogen 2.704 N/A ILE 138.A N ALA 141.A O no hydrogen 2.862 N/A ALA 141.A N ILE 138.A O no hydrogen 3.129 N/A TYR 143.A N PHE 136.A O no hydrogen 2.880 N/A TYR 143.A OH ASP 116.A OD1 no hydrogen 2.527 N/A TYR 143.A OH ASP 116.A OD2 no hydrogen 3.408 N/A THR 144.A N ILE 167.A O no hydrogen 2.824 N/A VAL 145.A N GLY 134.A O no hydrogen 2.887 N/A TYR 146.A N PHE 165.A O no hydrogen 2.927 N/A TYR 146.A OH ASP 126.A OD1 no hydrogen 2.767 N/A GLU 147.A N LYS 131.A O no hydrogen 2.905 N/A ASN 148.A N GLN 163.A O no hydrogen 2.910 N/A ASN 148.A ND2 GLN 163.A OE1 no hydrogen 2.916 N/A THR 149.A OG1 ASN 162.A OD1 no hydrogen 3.099 N/A ARG 150.A N PHE 161.A O no hydrogen 2.883 N/A THR 151.A OG1 THR 160.A OG1 no hydrogen 2.745 N/A GLY 152.A N THR 159.A O no hydrogen 2.899 N/A SER 154.A OG GLY 157.A O no hydrogen 2.639 N/A ASP 156.A N SER 154.A OG no hydrogen 2.885 N/A GLY 157.A N SER 154.A O no hydrogen 3.207 N/A THR 159.A N GLY 152.A O no hydrogen 3.119 N/A THR 160.A OG1 THR 151.A OG1 no hydrogen 2.745 N/A PHE 161.A N ARG 150.A O no hydrogen 2.894 N/A GLN 163.A N ASN 148.A O no hydrogen 2.842 N/A TYR 164.A N ALA 111.A O no hydrogen 3.003 N/A TYR 164.A OH THR 192.A O no hydrogen 2.649 N/A PHE 165.A N TYR 146.A O no hydrogen 2.921 N/A SER 166.A N TYR 113.A O no hydrogen 2.939 N/A SER 166.A OG HIS 182.A ND1 no hydrogen 2.858 N/A ILE 167.A N THR 144.A O no hydrogen 2.805 N/A ARG 168.A N VAL 115.A O no hydrogen 2.815 N/A ARG 168.A NE GLN 170.A O no hydrogen 3.024 N/A ARG 168.A NH1 TYR 143.A OH no hydrogen 2.923 N/A GLN 169.A N GLN 142.A O no hydrogen 2.970 N/A GLN 169.A NE2 SER 135.A OG no hydrogen 2.971 N/A GLN 169.A NE2 THR 144.A OG1 no hydrogen 2.937 N/A ARG 172.A N ASP 116.A O no hydrogen 2.888 N/A ARG 172.A NE ASP 116.A OD2 no hydrogen 2.799 N/A ARG 172.A NH1 THR 176.A O no hydrogen 3.287 N/A ARG 172.A NH2 ASP 116.A OD2 no hydrogen 2.806 N/A ARG 172.A NH2 THR 176.A O no hydrogen 3.016 N/A CYS 174.A SG PHE 84.A O no hydrogen 3.502 N/A GLY 175.A N PHE 84.A O no hydrogen 3.024 N/A THR 176.A OG1 ASP 83.A OD1 no hydrogen 2.678 N/A ILE 177.A N ALA 82.A O no hydrogen 2.761 N/A ASP 178.A N ASP 139.A OD2 no hydrogen 2.989 N/A ILE 179.A N MET 80.A O no hydrogen 3.044 N/A SER 180.A N MET 80.A O no hydrogen 3.353 N/A ALA 181.A N ASP 178.A OD1 no hydrogen 2.973 N/A HIS 182.A N ASP 178.A O no hydrogen 3.456 N/A HIS 182.A ND1 SER 166.A OG no hydrogen 2.858 N/A PHE 183.A N ILE 179.A O no hydrogen 3.156 N/A ASP 184.A N SER 180.A O no hydrogen 2.853 N/A GLN 185.A N ALA 181.A O no hydrogen 3.083 N/A GLN 185.A NE2 GLN 185.A O no hydrogen 3.143 N/A TRP 186.A N HIS 182.A O no hydrogen 2.858 N/A TRP 186.A NE1 SER 166.A OG no hydrogen 2.902 N/A GLU 187.A N PHE 183.A O no hydrogen 3.026 N/A LYS 188.A N ASP 184.A O no hydrogen 3.417 N/A LEU 189.A N TRP 186.A O no hydrogen 2.940 N/A GLY 190.A N GLU 187.A O no hydrogen 3.181 N/A MET 191.A N TRP 186.A O no hydrogen 2.949 N/A GLY 194.A N THR 105.A OG1 no hydrogen 3.118 N/A LYS 195.A N ARG 106.A O no hydrogen 2.805 N/A LEU 196.A N LYS 72.A O no hydrogen 2.831 N/A HIS 197.A N TRP 104.A O no hydrogen 2.842 N/A GLU 198.A N TRP 104.A O no hydrogen 3.326 N/A ALA 199.A N LEU 66.A O no hydrogen 3.051 N/A LYS 200.A N TYR 102.A O no hydrogen 2.918 N/A VAL 201.A N SER 64.A O no hydrogen 2.888 N/A LEU 202.A N GLY 100.A O no hydrogen 2.813 N/A GLY 203.A N CYS 62.A O no hydrogen 2.876 N/A GLU 204.A N TYR 98.A O no hydrogen 2.880 N/A ALA 205.A N TYR 60.A O no hydrogen 2.931 N/A GLY 206.A N TYR 96.A O no hydrogen 2.975 N/A ASN 207.A N GLY 58.A O no hydrogen 2.843 N/A ASN 207.A ND2 ASN 93.A O no hydrogen 2.833 N/A ASN 209.A N ASN 207.A OD1 no hydrogen 2.772 N/A GLY 210.A N ASN 207.A O no hydrogen 2.833 N/A ALA 212.A N ALA 57.A O no hydrogen 2.992 N/A SER 213.A N SER 92.A O no hydrogen 2.951 N/A GLY 214.A N PHE 54.A O no hydrogen 2.882 N/A THR 215.A N ASN 90.A O no hydrogen 3.059 N/A THR 215.A OG1 GLN 89.A OE1 no hydrogen 2.871 N/A ALA 216.A N CYS 52.A O no hydrogen 3.022 N/A ASP 217.A N VAL 87.A O no hydrogen 2.985 N/A PHE 218.A N PHE 50.A O no hydrogen 2.822 N/A LYS 222.A N ASP 83.A O no hydrogen 2.908 N/A TYR 224.A N LYS 81.A O no hydrogen 2.932 N/A TYR 224.A OH ASP 83.A OD1 no hydrogen 2.756 N/A GLY 226.A N ARG 79.A O no hydrogen 2.916 N/A