Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4gvo_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 2.A N GLY 41.A O no hydrogen 2.920 N/A ILE 4.A N LYS 43.A O no hydrogen 2.784 N/A THR 5.A N ASP 64.A OD2 no hydrogen 2.898 N/A VAL 6.A N LYS 45.A O no hydrogen 2.786 N/A GLY 7.A N ILE 65.A O no hydrogen 2.792 N/A THR 8.A N LYS 47.A O no hydrogen 3.168 N/A THR 8.A OG1 ALA 67.A O no hydrogen 2.725 N/A GLY 9.A N THR 8.A OG1 no hydrogen 2.871 N/A GLN 11.A NE2.A THR 10.A OG1 no hydrogen 3.034 N/A PHE 12.A N CYS 16.A O no hydrogen 3.134 N/A ASN 14.A ND2 TRP 226.A O no hydrogen 2.953 N/A VAL 15.A N PHE 12.A O no hydrogen 2.888 N/A CYS 16.A N PHE 12.A O no hydrogen 2.904 N/A PHE 17.A N THR 25.A O no hydrogen 3.068 N/A ASP 19.A N LYS 23.A O no hydrogen 2.849 N/A ASN 21.A N ASP 19.A OD1 no hydrogen 2.761 N/A GLY 22.A N ASP 19.A O no hydrogen 3.026 N/A LYS 23.A N ASP 19.A OD1 no hydrogen 2.964 N/A THR 25.A N PHE 17.A O no hydrogen 2.818 N/A THR 25.A OG1 GLU 30.A OE2 no hydrogen 2.634 N/A GLY 26.A N THR 25.A OG1 no hydrogen 2.829 N/A TYR 27.A N ASN 14.A O no hydrogen 2.861 N/A TYR 27.A OH TYR 87.A O no hydrogen 2.718 N/A ASP 28.A N VAL 15.A O no hydrogen 3.036 N/A GLU 30.A N GLY 26.A O no hydrogen 2.822 N/A LEU 31.A N TYR 27.A O no hydrogen 2.891 N/A VAL 32.A N ASP 28.A O no hydrogen 3.012 N/A LYS 33.A N VAL 29.A O no hydrogen 3.007 N/A LYS 33.A NZ.B GLU 30.A OE1 no hydrogen 3.240 N/A LYS 33.A NZ.B GLU 30.A OE2 no hydrogen 3.092 N/A GLU 34.A N GLU 30.A O no hydrogen 2.974 N/A ILE 35.A N LEU 31.A O no hydrogen 2.915 N/A ASP 36.A N VAL 32.A O no hydrogen 2.876 N/A LYS 37.A N LYS 33.A O no hydrogen 3.110 N/A LYS 37.A NZ.A GLU 34.A OE1 no hydrogen 2.759 N/A LYS 37.A NZ.B GLU 34.A OE1 no hydrogen 3.057 N/A ARG 38.A N GLU 34.A O no hydrogen 3.373 N/A ARG 38.A N ILE 35.A O no hydrogen 2.988 N/A ARG 38.A NE GLU 34.A OE2 no hydrogen 2.961 N/A ARG 38.A NH1 SER 212.A OG.A no hydrogen 3.211 N/A ARG 38.A NH1 ASP 216.A OD2 no hydrogen 2.938 N/A ARG 38.A NH2 GLU 34.A OE2 no hydrogen 2.968 N/A ARG 38.A NH2 ASP 216.A OD2 no hydrogen 2.828 N/A LEU 39.A N ASP 36.A O no hydrogen 3.021 N/A TYR 42.A N LEU 39.A O no hydrogen 3.118 N/A LYS 43.A N GLN 2.A O no hydrogen 2.862 N/A LYS 43.A NZ THR 3.A OG1 no hydrogen 2.976 N/A PHE 44.A N ASP 36.A OD2 no hydrogen 3.107 N/A LYS 45.A N ILE 4.A O no hydrogen 2.884 N/A LYS 47.A N VAL 6.A O no hydrogen 2.872 N/A LYS 47.A NZ.B LYS 62.A O no hydrogen 2.930 N/A MET 49.A N THR 8.A O no hydrogen 3.034 N/A ASN 53.A N ASP 50.A O no hydrogen 2.916 N/A LEU 54.A N PHE 51.A O no hydrogen 3.076 N/A SER 57.A N ASN 53.A O no hydrogen 2.876 N/A LEU 58.A N LEU 54.A O no hydrogen 2.926 N/A GLY 59.A N LEU 55.A O no hydrogen 2.856 N/A ALA 60.A N VAL 56.A O no hydrogen 2.995 N/A GLY 61.A N LEU 58.A O no hydrogen 3.039 N/A LYS 62.A N SER 57.A O no hydrogen 2.873 N/A ASP 64.A N THR 5.A O no hydrogen 2.792 N/A ILE 65.A N THR 5.A O no hydrogen 3.234 N/A VAL 66.A N MET 194.A O no hydrogen 2.808 N/A ALA 67.A N GLY 7.A O no hydrogen 2.999 N/A HIS 68.A ND1 HIS 68.A O no hydrogen 2.757 N/A GLN 69.A N ASP 28.A OD2 no hydrogen 2.859 N/A GLN 69.A NE2 ASP 28.A OD1 no hydrogen 2.760 N/A LYS 72.A N LYS 190.A O no hydrogen 3.111 N/A LYS 72.A NZ.A TYR 192.A OH no hydrogen 3.560 N/A LYS 74.A NZ.A GLU 75.A OE2 no hydrogen 2.656 N/A GLU 75.A N GLU 75.A OE1 no hydrogen 2.712 N/A ARG 76.A N SER 73.A OG no hydrogen 3.089 N/A ARG 76.A NH1 GLU 71.A O no hydrogen 2.932 N/A ARG 76.A NH2 THR 119.A O no hydrogen 3.414 N/A GLU 77.A N SER 73.A O no hydrogen 2.945 N/A LYS 78.A N LYS 74.A O no hydrogen 3.072 N/A LYS 78.A NZ.A GLU 75.A O no hydrogen 2.780 N/A LYS 79.A N ARG 76.A O no hydrogen 3.026 N/A PHE 80.A N ARG 76.A O no hydrogen 2.821 N/A LEU 81.A N LEU 195.A O no hydrogen 2.873 N/A ASN 83.A N PHE 193.A O no hydrogen 3.391 N/A ASN 83.A ND2 VAL 85.A O no hydrogen 2.940 N/A ASN 83.A ND2 ASP 207.A OD1 no hydrogen 2.831 N/A ASP 84.A N ASP 207.A OD2 no hydrogen 2.983 N/A VAL 85.A N ASP 207.A OD1 no hydrogen 3.018 N/A TYR 87.A N VAL 191.A O no hydrogen 2.880 N/A TYR 87.A OH ASP 28.A OD2 no hydrogen 2.597 N/A ASN 88.A ND2 GLN 69.A OE1 no hydrogen 2.797 N/A PHE 90.A N ALA 189.A O no hydrogen 3.146 N/A LEU 92.A N SER 187.A O no hydrogen 2.880 N/A GLN 93.A N SER 163.A O no hydrogen 2.949 N/A GLN 93.A NE2 GLY 183.A O no hydrogen 2.899 N/A THR 95.A N THR 161.A O no hydrogen 2.853 N/A THR 95.A OG1 GLN 93.A O no hydrogen 3.182 N/A VAL 96.A N LYS 180.A O no hydrogen 2.913 N/A ASP 98.A N LYS 178.A O no hydrogen 2.932 N/A ASN 100.A N LEU 97.A O no hydrogen 2.900 N/A ASN 100.A ND2 ASP 159.A O no hydrogen 3.698 N/A SER 102.A N ASN 100.A OD1 no hydrogen 2.940 N/A SER 102.A OG ASN 100.A OD1 no hydrogen 2.710 N/A ASN 104.A N ASP 108.A OD2 no hydrogen 2.788 N/A SER 105.A N ASP 108.A OD2 no hydrogen 3.086 N/A THR 106.A OG1 GLN 133.A OE1 no hydrogen 2.750 N/A LYS 107.A N SER 105.A OG no hydrogen 2.956 N/A ASP 108.A N SER 105.A O no hydrogen 2.943 N/A LEU 109.A N THR 106.A O no hydrogen 3.055 N/A ALA 110.A N LYS 107.A O no hydrogen 3.292 N/A GLY 111.A N ASN 136.A O no hydrogen 2.847 N/A LYS 112.A N LEU 109.A O no hydrogen 2.876 N/A ARG 113.A N ASP 159.A OD2 no hydrogen 2.972 N/A ARG 113.A NH1 GLN 152.A OE1 no hydrogen 2.775 N/A ARG 113.A NH1 ARG 157.A O no hydrogen 2.886 N/A ARG 113.A NH2 GLN 152.A OE1 no hydrogen 3.139 N/A VAL 114.A N GLU 138.A O no hydrogen 2.824 N/A ILE 115.A N ALA 160.A O no hydrogen 2.946 N/A THR 116.A N ALA 140.A O no hydrogen 2.953 N/A SER 117.A N THR 116.A OG1 no hydrogen 2.803 N/A SER 117.A OG.B SER 120.A OG no hydrogen 2.908 N/A SER 117.A OG.C GLU 142.A OE2 no hydrogen 2.795 N/A THR 119.A OG1 ALA 118.A O no hydrogen 2.573 N/A SER 120.A N SER 117.A O no hydrogen 3.104 N/A SER 120.A OG SER 117.A O no hydrogen 2.735 N/A SER 120.A OG SER 117.A OG.B no hydrogen 2.908 N/A ASN 121.A ND2 GLU 71.A OE1 no hydrogen 2.808 N/A ALA 123.A N SER 120.A OG no hydrogen 3.125 N/A LEU 124.A N SER 120.A O no hydrogen 3.337 N/A VAL 125.A N ASN 121.A O no hydrogen 2.927 N/A LEU 126.A N GLY 122.A O no hydrogen 2.941 N/A LYS 127.A N ALA 123.A O no hydrogen 2.924 N/A LYS 128.A N LEU 124.A O no hydrogen 2.945 N/A LYS 128.A NZ GLU 75.A OE2 no hydrogen 2.764 N/A ILE 129.A N VAL 125.A O no hydrogen 3.170 N/A ASN 130.A N LEU 126.A O no hydrogen 2.894 N/A ASN 130.A ND2 PHE 137.A O no hydrogen 2.862 N/A GLU 131.A N LYS 127.A O no hydrogen 3.051 N/A GLU 132.A N LYS 128.A O no hydrogen 2.986 N/A GLN 133.A N ILE 129.A O no hydrogen 3.007 N/A GLN 133.A N ASN 130.A O no hydrogen 3.039 N/A GLN 133.A NE2 THR 106.A O no hydrogen 3.083 N/A GLN 133.A NE2 ASN 136.A OD1 no hydrogen 3.059 N/A GLY 134.A N GLU 131.A O no hydrogen 3.002 N/A ASN 135.A N ASN 130.A O no hydrogen 2.816 N/A PHE 137.A N ASN 130.A OD1 no hydrogen 3.069 N/A GLU 138.A N LYS 112.A O no hydrogen 3.043 N/A ALA 140.A N VAL 114.A O no hydrogen 2.811 N/A GLU 142.A N THR 116.A O no hydrogen 2.843 N/A GLY 143.A N ASN 147.A O no hydrogen 2.906 N/A ASN 147.A N GLN 144.A O no hydrogen 2.908 N/A ASP 148.A N GLY 145.A O no hydrogen 2.939 N/A THR 149.A N GLU 142.A OE1 no hydrogen 2.938 N/A THR 149.A OG1 GLU 142.A OE1 no hydrogen 3.047 N/A ASN 151.A N ASP 148.A OD1 no hydrogen 2.947 N/A ASN 151.A ND2 GLY 145.A O no hydrogen 3.519 N/A ASN 151.A ND2 ASP 148.A OD1 no hydrogen 2.878 N/A GLN 152.A N ASP 148.A O no hydrogen 2.955 N/A GLN 152.A NE2 ASN 147.A O no hydrogen 2.800 N/A LEU 153.A N THR 149.A O no hydrogen 2.922 N/A LYS 154.A N ALA 150.A O no hydrogen 2.895 N/A THR 155.A N ASN 151.A O no hydrogen 3.164 N/A THR 155.A OG1 ASN 151.A O no hydrogen 3.418 N/A THR 155.A OG1 GLN 152.A O no hydrogen 3.359 N/A GLY 156.A N LEU 153.A O no hydrogen 3.137 N/A ARG 157.A N THR 155.A OG1 no hydrogen 3.282 N/A ARG 157.A NH1.A ASN 147.A OD1 no hydrogen 2.899 N/A ARG 157.A NH1.B ASN 147.A OD1 no hydrogen 3.536 N/A ALA 158.A N GLN 152.A O no hydrogen 3.019 N/A ASP 159.A N ARG 113.A O no hydrogen 2.760 N/A THR 161.A N THR 95.A O no hydrogen 2.776 N/A THR 161.A OG1 ILE 115.A O no hydrogen 2.701 N/A ILE 162.A N THR 161.A OG1 no hydrogen 2.755 N/A SER 163.A N GLN 93.A O no hydrogen 3.034 N/A THR 164.A OG1 PRO 91.A O no hydrogen 2.654 N/A ALA 167.A N THR 164.A O no hydrogen 3.064 N/A VAL 168.A N THR 164.A O no hydrogen 3.118 N/A ASP 169.A N PRO 165.A O no hydrogen 2.847 N/A PHE 170.A N PHE 166.A O no hydrogen 3.222 N/A GLN 171.A N ALA 167.A O no hydrogen 3.052 N/A GLN 171.A NE2 GLU 179.A OE2 no hydrogen 2.862 N/A ASN 172.A N VAL 168.A O no hydrogen 2.980 N/A ASN 172.A ND2 GLU 179.A O no hydrogen 2.834 N/A LYS 173.A N PHE 170.A O no hydrogen 3.152 N/A SER 175.A N ASN 172.A O no hydrogen 3.482 N/A SER 175.A OG ILE 177.A O no hydrogen 3.194 N/A ILE 177.A N SER 175.A OG no hydrogen 3.011 N/A LYS 178.A NZ ASN 172.A O no hydrogen 2.728 N/A LYS 178.A NZ SER 175.A O no hydrogen 3.069 N/A GLU 179.A N ASN 172.A OD1 no hydrogen 2.934 N/A LYS 180.A N VAL 96.A O no hydrogen 2.835 N/A LYS 180.A NZ ASP 98.A O no hydrogen 2.829 N/A LYS 180.A NZ ASN 101.A OD1 no hydrogen 2.791 N/A VAL 182.A N LEU 94.A O no hydrogen 2.910 N/A LEU 186.A N LEU 92.A O no hydrogen 2.815 N/A LYS 190.A NZ TYR 236.A O no hydrogen 2.865 N/A VAL 191.A N ASN 88.A O no hydrogen 2.943 N/A TYR 192.A N MET 70.A O no hydrogen 3.047 N/A PHE 193.A N ASN 83.A OD1 no hydrogen 2.852 N/A MET 194.A N VAL 66.A O no hydrogen 3.188 N/A LEU 195.A N LEU 81.A O no hydrogen 2.758 N/A GLY 196.A N GLU 199.A OE1 no hydrogen 2.962 N/A LYS 197.A NZ GLU 77.A O no hydrogen 2.859 N/A LYS 197.A NZ PHE 80.A O no hydrogen 2.760 N/A GLU 199.A N GLY 196.A O no hydrogen 2.991 N/A SER 203.A N GLU 199.A O no hydrogen 2.981 N/A LYS 204.A N THR 200.A O no hydrogen 3.027 N/A LYS 205.A N LYS 201.A O no hydrogen 3.048 N/A VAL 206.A N LEU 202.A O no hydrogen 2.865 N/A ASP 207.A N SER 203.A O no hydrogen 2.953 N/A GLU 208.A N LYS 204.A O no hydrogen 2.948 N/A ALA 209.A N LYS 205.A O no hydrogen 2.949 N/A LEU 210.A N VAL 206.A O no hydrogen 2.810 N/A GLN 211.A N ASP 207.A O no hydrogen 2.850 N/A GLN 211.A NE2 GLN 211.A O no hydrogen 3.567 N/A GLN 211.A NE2 ASP 215.A OD1 no hydrogen 2.955 N/A SER 212.A N GLU 208.A O no hydrogen 3.095 N/A SER 212.A OG.A ALA 209.A O no hydrogen 2.783 N/A SER 212.A OG.B GLU 208.A O no hydrogen 3.168 N/A ILE 213.A N ALA 209.A O no hydrogen 3.001 N/A ILE 214.A N LEU 210.A O no hydrogen 2.900 N/A ASP 215.A N GLN 211.A O no hydrogen 2.872 N/A ASP 216.A N SER 212.A O no hydrogen 3.098 N/A GLY 217.A N ILE 214.A O no hydrogen 3.117 N/A THR 218.A N ASP 216.A OD1 no hydrogen 2.991 N/A THR 218.A OG1 ASP 216.A OD1 no hydrogen 2.528 N/A LEU 219.A N ILE 213.A O no hydrogen 3.057 N/A LYS 220.A NZ GLU 224.A OE1.A no hydrogen 2.548 N/A LYS 220.A NZ GLU 224.A OE1.B no hydrogen 3.128 N/A LYS 220.A NZ SER 232.A OG no hydrogen 2.827 N/A LYS 221.A N GLY 217.A O no hydrogen 3.244 N/A LEU 222.A N THR 218.A O no hydrogen 2.894 N/A SER 223.A N LEU 219.A O no hydrogen 2.879 N/A SER 223.A OG LEU 219.A O no hydrogen 2.921 N/A SER 223.A OG LYS 220.A O no hydrogen 3.073 N/A SER 223.A OG SER 232.A OG no hydrogen 2.820 N/A SER 223.A OG LYS 233.A O no hydrogen 3.568 N/A SER 223.A OG TYR 236.A OH no hydrogen 3.376 N/A GLU 224.A N LYS 220.A O no hydrogen 2.983 N/A LYS 225.A N LYS 221.A O no hydrogen 3.028 N/A TRP 226.A N LEU 222.A O no hydrogen 3.129 N/A LEU 227.A N SER 223.A O no hydrogen 2.806 N/A GLY 228.A N GLU 224.A O no hydrogen 3.163 N/A TYR 231.A N GLY 228.A O no hydrogen 2.921 N/A TYR 231.A OH ASP 169.A OD2 no hydrogen 2.500 N/A SER 232.A N ALA 229.A O no hydrogen 3.328 N/A SER 232.A OG LYS 220.A O no hydrogen 3.015 N/A SER 232.A OG SER 223.A OG no hydrogen 2.820 N/A LYS 233.A N TYR 236.A OH no hydrogen 3.151 N/A LYS 233.A NZ ASN 89.A OD1 no hydrogen 2.570 N/A TYR 236.A OH TYR 231.A O no hydrogen 2.845 N/A