Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3q5y_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 6.A N ILE 25.A O no hydrogen 3.092 N/A GLN 7.A NE2 TYR 90.A O no hydrogen 2.898 N/A SER 8.A N THR 23.A O no hydrogen 2.904 N/A ARG 10.A NH1 GLU 155.A OE1 no hydrogen 3.544 N/A ARG 10.A NH1 GLU 155.A OE2 no hydrogen 2.865 N/A ARG 10.A NH2 GLU 155.A OE1 no hydrogen 3.028 N/A ILE 12.A N ARG 109.A O no hydrogen 2.862 N/A LYS 14.A N THR 111.A O no hydrogen 2.846 N/A LYS 14.A NZ ARG 19.A O no hydrogen 2.925 N/A LYS 16.A N LEU 113A.A O no hydrogen 2.843 N/A GLY 17.A N LEU 82.A O no hydrogen 2.785 N/A GLY 18.A N GLU 15.A O no hydrogen 2.958 N/A ARG 19.A NH2 ASN 78.A OD1 no hydrogen 3.181 N/A SER 20.A N MET 79.A O no hydrogen 3.015 N/A LEU 22.A N MET 77.A O no hydrogen 2.908 N/A THR 23.A N SER 8.A O no hydrogen 2.828 N/A CYS 24.A N SER 75.A O no hydrogen 2.834 N/A ILE 25.A N VAL 6.A O no hydrogen 2.856 N/A ILE 27.A N SER 94.A OG no hydrogen 3.245 N/A HIS 30.A N ILE 27.A O no hydrogen 2.848 N/A HIS 30.A ND1 SER 94.A OG no hydrogen 2.870 N/A SER 31.A N LEU 96.A O no hydrogen 3.369 N/A SER 31.A OG GLU 52.A OE2.B no hydrogen 3.061 N/A SER 31.A OG LEU 96.A O no hydrogen 3.238 N/A ASN 32.A N SER 95.A O no hydrogen 3.252 N/A ASN 32.A ND2 SER 95.A OG no hydrogen 3.048 N/A VAL 33.A N HIS 50.A O no hydrogen 2.815 N/A VAL 34.A N ALA 93.A O no hydrogen 2.860 N/A TRP 35.A N ILE 48.A O no hydrogen 2.993 N/A TRP 35.A NE1 SER 75.A OG no hydrogen 2.926 N/A TYR 36.A N PHE 91.A O no hydrogen 2.788 N/A GLN 37.A N LYS 45.A O no hydrogen 2.854 N/A GLN 37.A NE2 TYR 90.A OH no hydrogen 2.950 N/A GLN 38.A N MET 89.A O no hydrogen 2.822 N/A GLN 38.A NE2 LYS 42.A O no hydrogen 2.831 N/A LYS 42.A N THR 39.A O no hydrogen 2.918 N/A GLU 43.A N GLU 43.A OE1 no hydrogen 2.745 N/A LYS 45.A N GLN 37.A O no hydrogen 2.791 N/A LYS 45.A NZ.B PHE 60.A O no hydrogen 3.160 N/A LEU 47.A N TRP 35.A O no hydrogen 2.845 N/A GLN 49.A N ASP 57.A O no hydrogen 2.942 N/A GLN 49.A NE2 ASN 32.A OD1 no hydrogen 2.889 N/A HIS 50.A N VAL 33.A O no hydrogen 2.934 N/A TYR 51.A N VAL 54.A O no hydrogen 3.011 N/A GLU 52.A N.A SER 31.A O no hydrogen 3.111 N/A GLU 52.A N.B SER 31.A O no hydrogen 3.141 N/A LYS 53.A N GLN 69.A OE1 no hydrogen 2.701 N/A LYS 53.A NZ ASP 71.A OD1 no hydrogen 2.773 N/A VAL 54.A N TYR 51.A O no hydrogen 3.055 N/A ARG 56.A N GLN 49.A O no hydrogen 2.871 N/A ARG 56.A NE TYR 51.A O no hydrogen 3.449 N/A ARG 56.A NE VAL 54.A O no hydrogen 3.303 N/A ARG 56.A NH2 TYR 51.A O no hydrogen 2.864 N/A ASP 57.A N GLN 49.A OE1 no hydrogen 3.211 N/A GLY 59.A N LEU 47.A O no hydrogen 2.802 N/A LEU 61.A N GLY 59.A O no hydrogen 3.090 N/A ARG 64.A NH1 SER 80.A O no hydrogen 3.332 N/A ARG 64.A NH1 ASP 86.A OD2 no hydrogen 2.818 N/A ARG 64.A NH2 ASP 86.A OD1 no hydrogen 2.991 N/A ARG 64.A NH2 ASP 86.A OD2 no hydrogen 3.405 N/A PHE 65.A N PRO 62.A O no hydrogen 2.919 N/A SER 66.A N ASN 78.A O no hydrogen 2.921 N/A GLN 68.A N GLU 76.A O no hydrogen 3.040 N/A GLN 69.A NE2 SER 31.A O no hydrogen 2.991 N/A GLN 69.A NE2 TYR 73.A O no hydrogen 3.153 N/A PHE 70.A N HIS 74.A O no hydrogen 2.867 N/A TYR 73.A N PHE 70.A O no hydrogen 2.788 N/A TYR 73.A OH GLU 52.A OE1.B no hydrogen 2.852 N/A HIS 74.A N ASP 72.A OD1 no hydrogen 2.993 N/A HIS 74.A ND1 ASP 72.A OD1 no hydrogen 2.611 N/A HIS 74.A NE2 GLU 76.A OE2 no hydrogen 2.796 N/A SER 75.A N CYS 24.A O no hydrogen 2.927 N/A SER 75.A OG GLN 68.A O no hydrogen 3.466 N/A GLU 76.A N GLN 68.A O no hydrogen 2.941 N/A MET 77.A N LEU 22.A O no hydrogen 2.857 N/A ASN 78.A N SER 66.A O no hydrogen 2.779 N/A MET 79.A N SER 20.A O no hydrogen 2.863 N/A SER 80.A N ARG 64.A O no hydrogen 2.983 N/A SER 80.A OG ARG 64.A O no hydrogen 2.857 N/A LEU 82.A N GLY 18.A O no hydrogen 3.006 N/A GLU 83.A N ASP 86.A OD2 no hydrogen 2.773 N/A ASP 86.A N GLU 83.A O no hydrogen 2.901 N/A SER 87.A N LEU 84.A O no hydrogen 2.989 N/A SER 87.A OG LEU 84.A O no hydrogen 2.956 N/A ALA 88.A N LEU 110.A O no hydrogen 2.976 N/A MET 89.A N GLN 38.A O no hydrogen 2.972 N/A TYR 90.A N THR 108.A O no hydrogen 2.884 N/A TYR 90.A OH ASP 86.A O no hydrogen 2.682 N/A PHE 91.A N TYR 36.A O no hydrogen 2.976 N/A CYS 92.A N GLN 7.A OE1 no hydrogen 3.141 N/A ALA 93.A N VAL 34.A O no hydrogen 2.901 N/A SER 94.A N TYR 103.A O no hydrogen 2.970 N/A SER 94.A OG HIS 30.A ND1 no hydrogen 2.870 N/A SER 95.A N ASN 32.A O no hydrogen 2.959 N/A SER 95.A OG ARG 97.A O no hydrogen 3.033 N/A ARG 97.A N ASP 100.A OD2 no hydrogen 3.124 N/A ASP 100.A N ARG 97.A O no hydrogen 3.145 N/A GLN 102.A N GLN 102.A OE1 no hydrogen 2.661 N/A GLN 102.A NE2 TYR 36.A OH no hydrogen 3.262 N/A TYR 103.A N SER 94.A O no hydrogen 2.795 N/A GLY 105.A N CYS 92.A O no hydrogen 2.814 N/A GLY 107.A N GLN 7.A OE1 no hydrogen 2.993 N/A THR 108.A N TYR 90.A O no hydrogen 2.924 N/A THR 108.A OG1 PRO 9.A O no hydrogen 2.531 N/A ARG 109.A N ARG 10.A O no hydrogen 2.932 N/A ARG 109.A NH1 ASP 152.A OD2 no hydrogen 3.566 N/A LEU 110.A N ALA 88.A O no hydrogen 2.978 N/A THR 111.A N ILE 12.A O no hydrogen 2.926 N/A THR 111.A OG1 HIS 153.A NE2 no hydrogen 2.846 N/A VAL 112.A N SER 87.A OG no hydrogen 2.742 N/A ARG 117.A N ASP 115.A OD1 no hydrogen 2.811 N/A ASN 118.A N ASP 115.A O no hydrogen 3.133 N/A VAL 119.A N LEU 116.A O no hydrogen 3.047 N/A THR 120.A N PHE 150.A O no hydrogen 2.873 N/A THR 120.A OG1 ASN 118.A O no hydrogen 2.922 N/A LYS 123.A N ARG 147.A O no hydrogen 2.915 N/A SER 125.A N LEU 145.A O no hydrogen 2.937 N/A PHE 127.A N VAL 143.A O no hydrogen 2.801 N/A LYS 131.A NZ SER 240.A OG no hydrogen 2.753 N/A GLU 133.A N SER 130.A OG no hydrogen 3.098 N/A ILE 134.A N SER 130.A O no hydrogen 3.264 N/A ALA 135.A N LYS 131.A O no hydrogen 2.934 N/A ASN 136.A N ALA 132.A O no hydrogen 2.947 N/A LYS 137.A N GLU 133.A O no hydrogen 2.844 N/A GLN 138.A N ILE 134.A O no hydrogen 3.152 N/A ALA 140.A N VAL 191.A O no hydrogen 2.853 N/A THR 141.A N GLU 133.A OE1 no hydrogen 2.817 N/A THR 141.A OG1 GLU 133.A OE1 no hydrogen 3.540 N/A THR 141.A OG1 GLU 133.A OE2 no hydrogen 2.667 N/A LEU 142.A N LEU 189.A O no hydrogen 2.820 N/A VAL 143.A N PHE 127.A O no hydrogen 3.195 N/A CYS 144.A N SER 187.A O no hydrogen 2.796 N/A CYS 144.A SG SER 125.A O no hydrogen 3.917 N/A LEU 145.A N SER 125.A O no hydrogen 2.948 N/A ALA 146.A N LEU 185.A O no hydrogen 2.842 N/A ARG 147.A N LYS 123.A O no hydrogen 3.108 N/A ARG 147.A NE GLU 178.A OE1 no hydrogen 2.681 N/A ARG 147.A NE GLU 178.A OE2 no hydrogen 3.278 N/A ARG 147.A NH2 GLU 178.A OE1 no hydrogen 3.375 N/A ARG 147.A NH2 GLU 178.A OE2 no hydrogen 2.800 N/A GLY 148.A N TYR 183.A O no hydrogen 2.930 N/A PHE 150.A N THR 120.A O no hydrogen 2.891 N/A HIS 153.A N PRO 151.A O no hydrogen 2.837 N/A HIS 153.A ND1 HIS 210.A O no hydrogen 3.029 N/A HIS 153.A NE2 THR 111.A OG1 no hydrogen 2.846 N/A GLU 155.A N GLN 208.A O no hydrogen 2.955 N/A SER 157.A N GLN 206.A O no hydrogen 2.852 N/A SER 157.A OG GLN 206.A O no hydrogen 3.547 N/A TRP 158.A NE1 SER 187.A OG no hydrogen 2.794 N/A TRP 159.A N ARG 204.A O no hydrogen 2.878 N/A TRP 159.A NE1 SER 157.A OG no hydrogen 2.822 N/A VAL 160.A N LYS 163.A O no hydrogen 2.859 N/A ASN 161.A N HIS 202.A O no hydrogen 2.884 N/A ASN 161.A ND2 ASN 201.A OD1 no hydrogen 2.985 N/A LYS 163.A N VAL 160.A O no hydrogen 3.081 N/A VAL 165.A N TRP 158.A O no hydrogen 2.977 N/A VAL 169.A N HIS 166.A O no hydrogen 3.061 N/A SER 170.A N ARG 188.A O no hydrogen 2.927 N/A THR 171.A OG1 SER 187.A OG no hydrogen 2.671 N/A ASP 172.A N SER 186.A O no hydrogen 2.991 N/A TYR 176.A N SER 184.A O no hydrogen 3.044 N/A LYS 177.A NZ ASN 180.A O no hydrogen 3.196 N/A GLU 178.A N SER 182.A O no hydrogen 2.709 N/A SER 179.A N SER 182.A O no hydrogen 3.425 N/A SER 182.A N SER 179.A O no hydrogen 3.480 N/A SER 182.A OG GLU 178.A OE2 no hydrogen 2.515 N/A TYR 183.A N PHE 149.A O no hydrogen 2.855 N/A SER 184.A N TYR 176.A O no hydrogen 2.911 N/A LEU 185.A N ALA 146.A O no hydrogen 2.773 N/A SER 186.A N ASP 172.A OD2 no hydrogen 2.952 N/A SER 186.A OG ASP 172.A OD1 no hydrogen 3.337 N/A SER 186.A OG ASP 172.A OD2 no hydrogen 2.735 N/A SER 187.A N CYS 144.A O no hydrogen 2.944 N/A SER 187.A OG SER 170.A O no hydrogen 3.382 N/A SER 187.A OG THR 171.A OG1 no hydrogen 2.671 N/A ARG 188.A N SER 170.A O no hydrogen 2.893 N/A ARG 188.A NH1 ASP 172.A OD1 no hydrogen 2.851 N/A ARG 188.A NH2 SER 186.A OG no hydrogen 3.064 N/A LEU 189.A N LEU 142.A O no hydrogen 2.880 N/A ARG 190.A N GLY 168.A O no hydrogen 2.884 N/A VAL 191.A N ALA 140.A O no hydrogen 2.897 N/A SER 192.A OG THR 194.A OG1 no hydrogen 3.108 N/A ALA 193.A N GLN 138.A O no hydrogen 3.110 N/A THR 194.A OG1 SER 192.A OG no hydrogen 3.108 N/A PHE 195.A N SER 192.A OG no hydrogen 2.936 N/A TRP 196.A N SER 192.A O no hydrogen 3.117 N/A HIS 197.A N ALA 193.A O no hydrogen 2.988 N/A ARG 200.A N ASN 198.A OD1 no hydrogen 2.917 N/A ASN 201.A N ASN 198.A O no hydrogen 3.071 N/A ASN 201.A ND2 PHE 195.A O no hydrogen 2.869 N/A HIS 202.A N ASN 161.A OD1 no hydrogen 2.823 N/A HIS 202.A NE2 GLU 233.A OE2 no hydrogen 2.951 N/A PHE 203.A N ALA 234.A O no hydrogen 2.847 N/A ARG 204.A N TRP 159.A O no hydrogen 2.925 N/A ARG 204.A NE GLU 233.A OE1 no hydrogen 3.074 N/A ARG 204.A NH2 GLU 233.A OE1 no hydrogen 2.733 N/A CYS 205.A N ALA 232.A O no hydrogen 2.907 N/A GLN 206.A N SER 157.A O no hydrogen 2.780 N/A VAL 207.A N ILE 230.A O no hydrogen 2.795 N/A GLN 208.A N GLU 155.A O no hydrogen 2.876 N/A GLN 208.A NE2 ASN 229.A OD1 no hydrogen 2.952 N/A PHE 209.A N GLN 228.A O no hydrogen 2.930 N/A HIS 210.A N HIS 153.A O no hydrogen 2.892 N/A HIS 210.A NE2 GLU 155.A OE1 no hydrogen 2.816 N/A GLY 211.A N THR 227.A OG1 no hydrogen 3.076 N/A LEU 212.A N PRO 225.A O no hydrogen 2.956 N/A SER 213.A N ASP 216.A OD2 no hydrogen 2.792 N/A SER 213.A OG GLU 215.A OE1 no hydrogen 3.496 N/A SER 213.A OG ASP 216.A OD2 no hydrogen 3.024 N/A ASP 216.A N SER 213.A O no hydrogen 3.022 N/A ASP 216.A N SER 213.A OG no hydrogen 3.075 N/A LYS 217.A NZ GLU 215.A O no hydrogen 3.555 N/A TRP 218.A NE1 SER 222.A O no hydrogen 2.931 N/A LYS 224.A NZ SER 213.A O no hydrogen 3.005 N/A LYS 224.A NZ ASP 216.A O no hydrogen 2.715 N/A VAL 226.A N LYS 224.A O no hydrogen 2.817 N/A GLN 228.A N PHE 209.A O no hydrogen 2.979 N/A GLN 228.A NE2 VAL 226.A O no hydrogen 2.909 N/A ILE 230.A N VAL 207.A O no hydrogen 2.890 N/A ALA 232.A N CYS 205.A O no hydrogen 3.047 N/A ALA 234.A N PHE 203.A O no hydrogen 2.880 N/A GLY 236.A N ASN 201.A O no hydrogen 2.872 N/A ARG 237.A N TRP 196.A O no hydrogen 3.041 N/A LEU 113A.A N LYS 14.A O no hydrogen 2.847 N/A