Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1qxy_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N VAL 170.A O no hydrogen 2.982 N/A MET 1.A N GLU 176.A OE1 no hydrogen 2.729 N/A VAL 3.A N GLY 196.A O no hydrogen 2.774 N/A LYS 4.A N GLU 8.A OE1 no hydrogen 2.785 N/A THR 5.A N GLU 8.A OE1 no hydrogen 3.099 N/A GLU 8.A N THR 5.A OG1 no hydrogen 3.026 N/A LEU 9.A N THR 5.A O no hydrogen 3.086 N/A GLN 10.A N GLU 6.A O no hydrogen 2.874 N/A GLN 10.A NE2 GLU 6.A OE2 no hydrogen 2.974 N/A ALA 11.A N GLU 7.A O no hydrogen 2.991 N/A LEU 12.A N GLU 8.A O no hydrogen 2.931 N/A LYS 13.A N LEU 9.A O no hydrogen 2.897 N/A GLU 14.A N GLN 10.A O no hydrogen 2.896 N/A ILE 15.A N ALA 11.A O no hydrogen 3.177 N/A GLY 16.A N LEU 12.A O no hydrogen 2.954 N/A TYR 17.A N LYS 13.A O no hydrogen 2.937 N/A ILE 18.A N GLU 14.A O no hydrogen 3.068 N/A CYS 19.A N ILE 15.A O no hydrogen 2.961 N/A CYS 19.A SG ILE 15.A O no hydrogen 3.507 N/A CYS 19.A SG ALA 103.A O no hydrogen 3.894 N/A ALA 20.A N GLY 16.A O no hydrogen 2.908 N/A LYS 21.A N TYR 17.A O no hydrogen 2.850 N/A VAL 22.A N ILE 18.A O no hydrogen 2.956 N/A ARG 23.A N CYS 19.A O no hydrogen 2.856 N/A ARG 23.A NH1 THR 105.A OG1 no hydrogen 2.805 N/A ARG 23.A NH1 THR 247.A O no hydrogen 2.865 N/A ARG 23.A NH2 ASN 24.A OD1 no hydrogen 2.857 N/A ASN 24.A N ALA 20.A O no hydrogen 2.860 N/A THR 25.A N LYS 21.A O no hydrogen 2.949 N/A THR 25.A OG1 LYS 21.A O no hydrogen 2.730 N/A MET 26.A N VAL 22.A O no hydrogen 2.884 N/A GLN 27.A N ARG 23.A O no hydrogen 2.918 N/A ALA 28.A N ASN 24.A O no hydrogen 2.960 N/A ALA 29.A N THR 25.A O no hydrogen 3.123 N/A ALA 29.A N MET 26.A O no hydrogen 3.123 N/A THR 30.A N GLN 27.A O no hydrogen 3.043 N/A THR 30.A OG1 MET 26.A O no hydrogen 2.821 N/A LYS 31.A NZ PRO 32.A O no hydrogen 2.755 N/A GLY 33.A N ILE 84.A O no hydrogen 2.882 N/A ILE 34.A N LYS 31.A O no hydrogen 3.236 N/A THR 35.A N GLU 38.A OE1 no hydrogen 2.917 N/A THR 35.A OG1 GLU 38.A OE1 no hydrogen 3.147 N/A THR 36.A N ARG 82.A O no hydrogen 2.993 N/A THR 36.A OG1 SER 80.A O no hydrogen 3.176 N/A LYS 37.A N SER 80.A O no hydrogen 2.902 N/A GLU 38.A N THR 35.A OG1 no hydrogen 3.098 N/A LEU 39.A N THR 35.A O no hydrogen 3.101 N/A ASP 40.A N THR 36.A O no hydrogen 2.953 N/A ASN 41.A N LYS 37.A O no hydrogen 2.901 N/A ILE 42.A N LEU 39.A O no hydrogen 3.018 N/A LYS 44.A N ASP 40.A O no hydrogen 3.033 N/A GLU 45.A N ASN 41.A O no hydrogen 3.095 N/A LEU 46.A N ILE 42.A O no hydrogen 2.978 N/A PHE 47.A N ALA 43.A O no hydrogen 2.802 N/A GLU 48.A N LYS 44.A O no hydrogen 3.138 N/A GLU 49.A N GLU 45.A O no hydrogen 2.956 N/A TYR 50.A N LEU 46.A O no hydrogen 2.961 N/A GLY 51.A N GLU 48.A O no hydrogen 3.270 N/A ALA 52.A N PHE 47.A O no hydrogen 2.908 N/A ILE 53.A N LEU 97.A O no hydrogen 2.918 N/A SER 54.A OG GLN 65.A O no hydrogen 2.683 N/A ALA 55.A N SER 95.A O no hydrogen 2.960 N/A ILE 57.A N SER 54.A OG no hydrogen 3.055 N/A HIS 58.A N SER 54.A O no hydrogen 2.973 N/A HIS 58.A ND1 ASP 59.A OD2 no hydrogen 2.866 N/A ASP 59.A N ALA 55.A O no hydrogen 2.765 N/A GLU 60.A N PRO 56.A O no hydrogen 3.036 N/A ASN 61.A N ILE 57.A O no hydrogen 3.022 N/A PHE 62.A N PRO 56.A O no hydrogen 3.027 N/A GLY 64.A N PHE 62.A O no hydrogen 2.888 N/A GLN 65.A N ASP 40.A OD2 no hydrogen 2.907 N/A THR 66.A N ASP 40.A OD1 no hydrogen 2.826 N/A THR 66.A OG1 ASP 40.A OD1 no hydrogen 2.833 N/A CYS 67.A N ASP 93.A O no hydrogen 3.190 N/A ILE 68.A N GLY 77.A O no hydrogen 2.995 N/A SER 69.A N ASN 91.A O no hydrogen 2.919 N/A VAL 70.A N GLU 73.A OE1 no hydrogen 3.027 N/A ASN 71.A N LEU 89.A O no hydrogen 2.852 N/A ASN 71.A ND2 ASP 88.A OD1 no hydrogen 2.914 N/A GLU 72.A N GLU 72.A OE1 no hydrogen 2.827 N/A GLU 73.A N VAL 70.A O no hydrogen 2.949 N/A VAL 74.A N PHE 221.A O no hydrogen 2.827 N/A GLY 77.A N SER 69.A OG no hydrogen 2.966 N/A SER 80.A N THR 36.A OG1 no hydrogen 2.861 N/A ARG 82.A N SER 80.A OG no hydrogen 3.056 N/A ARG 82.A NH1 GLU 72.A OE1 no hydrogen 3.055 N/A ARG 82.A NH1 GLU 72.A OE2 no hydrogen 3.534 N/A ARG 82.A NH2 GLU 72.A OE2 no hydrogen 2.868 N/A ILE 84.A N ILE 34.A O no hydrogen 2.801 N/A ARG 85.A N ASP 88.A OD2 no hydrogen 2.830 N/A GLY 87.A N VAL 111.A O no hydrogen 2.741 N/A ASP 88.A N ARG 85.A O no hydrogen 3.017 N/A LEU 89.A N ASN 71.A OD1 no hydrogen 2.877 N/A VAL 90.A N PHE 109.A O no hydrogen 2.948 N/A ASN 91.A N SER 69.A O no hydrogen 2.814 N/A ASN 91.A ND2 SER 108.A OG no hydrogen 2.993 N/A ASN 91.A ND2 GLN 231.A OE1 no hydrogen 2.864 N/A ILE 92.A N ILE 107.A O no hydrogen 2.946 N/A ASP 93.A N CYS 67.A O no hydrogen 2.976 N/A VAL 94.A N THR 105.A O no hydrogen 2.768 N/A ALA 96.A N ALA 103.A O no hydrogen 3.104 N/A LEU 97.A N ILE 53.A O no hydrogen 2.915 N/A LYS 98.A N TYR 101.A O no hydrogen 2.914 N/A LYS 98.A NZ GLU 14.A OE2 no hydrogen 2.780 N/A LYS 98.A NZ TYR 50.A O no hydrogen 2.816 N/A TYR 101.A N LYS 98.A O no hydrogen 3.080 N/A TYR 102.A N GLY 171.A O no hydrogen 2.880 N/A TYR 102.A OH ASP 59.A OD1 no hydrogen 3.125 N/A TYR 102.A OH ASP 59.A OD2 no hydrogen 2.469 N/A ALA 103.A N ALA 96.A O no hydrogen 3.091 N/A ASP 104.A N THR 235.A OG1 no hydrogen 2.956 N/A THR 105.A N VAL 94.A O no hydrogen 2.941 N/A THR 105.A OG1 GLU 233.A O no hydrogen 2.767 N/A GLY 106.A N GLU 233.A O no hydrogen 3.157 N/A ILE 107.A N ILE 92.A O no hydrogen 2.964 N/A SER 108.A N GLN 231.A O no hydrogen 3.003 N/A SER 108.A OG GLN 231.A O no hydrogen 3.486 N/A PHE 109.A N VAL 90.A O no hydrogen 2.927 N/A VAL 111.A N ASP 88.A O no hydrogen 2.836 N/A GLU 113.A N GLU 86.A OE1 no hydrogen 2.873 N/A SER 114.A OG ASP 116.A O no hydrogen 3.375 N/A ASP 116.A N SER 114.A OG no hydrogen 2.928 N/A MET 118.A N ASP 116.A OD1 no hydrogen 2.937 N/A LYS 119.A N ASP 116.A O no hydrogen 3.284 N/A LYS 119.A NZ ASN 71.A OD1 no hydrogen 3.306 N/A LYS 119.A NZ GLY 87.A O no hydrogen 2.736 N/A GLN 120.A NE2 ASP 124.A OD1 no hydrogen 2.801 N/A LYS 121.A N PRO 117.A O no hydrogen 3.046 N/A LYS 121.A NZ ASN 157.A O no hydrogen 2.998 N/A VAL 122.A N MET 118.A O no hydrogen 3.008 N/A CYS 123.A N LYS 119.A O no hydrogen 3.463 N/A CYS 123.A SG SER 108.A O no hydrogen 3.488 N/A CYS 123.A SG LYS 119.A O no hydrogen 3.486 N/A ASP 124.A N GLN 120.A O no hydrogen 2.859 N/A VAL 125.A N LYS 121.A O no hydrogen 2.881 N/A ALA 126.A N VAL 122.A O no hydrogen 2.865 N/A THR 127.A N CYS 123.A O no hydrogen 3.084 N/A THR 127.A OG1 CYS 123.A O no hydrogen 3.319 N/A MET 128.A N ASP 124.A O no hydrogen 3.085 N/A ALA 129.A N VAL 125.A O no hydrogen 2.771 N/A PHE 130.A N ALA 126.A O no hydrogen 2.981 N/A GLU 131.A N THR 127.A O no hydrogen 3.037 N/A ASN 132.A N MET 128.A O no hydrogen 2.835 N/A ASN 132.A ND2 THR 153.A OG1 no hydrogen 2.779 N/A ALA 133.A N ALA 129.A O no hydrogen 2.893 N/A ILE 134.A N PHE 130.A O no hydrogen 3.007 N/A ALA 135.A N GLU 131.A O no hydrogen 3.125 N/A LYS 136.A N ALA 133.A O no hydrogen 3.018 N/A LYS 136.A NZ ASN 132.A O no hydrogen 2.824 N/A VAL 137.A N ILE 134.A O no hydrogen 3.111 N/A LYS 138.A N THR 141.A OG1.A no hydrogen 3.292 N/A GLY 140.A N LEU 193.A O no hydrogen 2.812 N/A THR 141.A N LYS 138.A O no hydrogen 3.136 N/A THR 141.A OG1.A LYS 136.A O no hydrogen 3.536 N/A THR 141.A OG1.A LYS 138.A O no hydrogen 2.675 N/A THR 141.A OG1.B LYS 138.A O no hydrogen 3.427 N/A LEU 143.A N THR 191.A O no hydrogen 2.904 N/A ASN 145.A N LYS 142.A O no hydrogen 2.950 N/A ILE 146.A N LEU 143.A O no hydrogen 2.997 N/A LYS 148.A N SER 144.A O no hydrogen 2.968 N/A ALA 149.A N ASN 145.A O no hydrogen 3.037 N/A VAL 150.A N ILE 146.A O no hydrogen 2.948 N/A HIS 151.A N GLY 147.A O no hydrogen 2.980 N/A ASN 152.A N LYS 148.A O no hydrogen 3.000 N/A THR 153.A N ALA 149.A O no hydrogen 2.985 N/A THR 153.A OG1 ALA 149.A O no hydrogen 2.812 N/A ALA 154.A N VAL 150.A O no hydrogen 3.017 N/A ARG 155.A N HIS 151.A O no hydrogen 2.885 N/A ARG 155.A NH1 ARG 155.A O no hydrogen 2.864 N/A GLN 156.A N ASN 152.A O no hydrogen 2.869 N/A GLN 156.A NE2 ASN 152.A OD1 no hydrogen 2.693 N/A ASN 157.A N ALA 154.A O no hydrogen 2.962 N/A ASN 157.A ND2 THR 153.A O no hydrogen 2.906 N/A ASP 158.A N ARG 155.A O no hydrogen 3.092 N/A LEU 159.A N ALA 154.A O no hydrogen 2.905 N/A LYS 160.A N SER 206.A O no hydrogen 2.949 N/A ILE 162.A N PHE 204.A O no hydrogen 3.082 N/A LYS 163.A N SER 210.A O no hydrogen 2.855 N/A ASN 164.A ND2 VAL 212.A O no hydrogen 2.942 N/A THR 166.A OG1 GLY 167.A O no hydrogen 2.927 N/A THR 166.A OG1 HIS 180.A ND1 no hydrogen 2.983 N/A GLY 167.A N VAL 181.A O no hydrogen 2.901 N/A HIS 168.A N ALA 200.A O no hydrogen 3.063 N/A HIS 168.A ND1 GLY 169.A O no hydrogen 3.001 N/A GLY 169.A N PRO 178.A O no hydrogen 2.874 N/A VAL 170.A N VAL 198.A O no hydrogen 3.243 N/A GLY 171.A N SER 173.A O no hydrogen 3.062 N/A LEU 172.A N GLU 176.A OE1 no hydrogen 3.164 N/A LEU 172.A N GLU 176.A OE2 no hydrogen 3.182 N/A SER 173.A OG HIS 175.A O no hydrogen 3.001 N/A SER 173.A OG GLU 176.A OE2 no hydrogen 2.663 N/A LEU 174.A N ASP 59.A OD1 no hydrogen 3.290 N/A GLU 176.A N GLY 169.A O no hydrogen 3.044 N/A HIS 180.A ND1 THR 166.A OG1 no hydrogen 2.983 N/A VAL 181.A N GLY 167.A O no hydrogen 2.950 N/A ASN 183.A ND2 ILE 162.A O no hydrogen 2.873 N/A LYS 188.A N ASP 186.A OD1 no hydrogen 2.875 N/A ASP 189.A N ASP 186.A O no hydrogen 3.198 N/A THR 191.A N ASP 189.A OD2 no hydrogen 2.945 N/A THR 191.A OG1 ASP 189.A OD2 no hydrogen 2.691 N/A LEU 193.A N THR 141.A O no hydrogen 2.822 N/A GLY 196.A N VAL 238.A O no hydrogen 2.768 N/A MET 197.A N THR 194.A O no hydrogen 2.989 N/A VAL 198.A N MET 1.A O no hydrogen 2.876 N/A LEU 199.A N VAL 236.A O no hydrogen 2.857 N/A ALA 200.A N HIS 168.A O no hydrogen 2.785 N/A ILE 201.A N HIS 234.A O no hydrogen 3.072 N/A ILE 205.A N ALA 230.A O no hydrogen 2.867 N/A SER 206.A N LYS 160.A O no hydrogen 2.842 N/A SER 206.A OG ALA 209.A O no hydrogen 2.668 N/A SER 207.A N PHE 228.A O no hydrogen 2.867 N/A SER 207.A OG PHE 228.A O no hydrogen 3.488 N/A ASN 208.A N SER 206.A OG no hydrogen 3.070 N/A ASN 208.A ND2 ASP 225.A OD2 no hydrogen 2.918 N/A ALA 209.A N SER 227.A OG no hydrogen 2.841 N/A VAL 212.A N ASN 164.A OD1 no hydrogen 2.949 N/A THR 213.A N GLU 222.A O no hydrogen 2.896 N/A THR 213.A OG1 GLU 222.A O no hydrogen 3.511 N/A GLY 215.A N ALA 220.A O no hydrogen 2.887 N/A LYS 216.A N GLU 222.A OE2 no hydrogen 2.944 N/A LYS 216.A NZ GLU 72.A OE2 no hydrogen 2.756 N/A LYS 216.A NZ GLU 73.A OE2 no hydrogen 2.814 N/A LYS 216.A NZ GLU 222.A OE2 no hydrogen 2.731 N/A GLU 218.A N GLU 218.A OE1 no hydrogen 2.809 N/A TRP 219.A N ASN 217.A OD1 no hydrogen 2.884 N/A ALA 220.A N ASN 217.A OD1 no hydrogen 2.848 N/A PHE 221.A N ALA 75.A O no hydrogen 2.888 N/A GLU 222.A N THR 213.A O no hydrogen 2.896 N/A THR 223.A N GLU 72.A O no hydrogen 3.373 N/A THR 223.A OG1 ASP 225.A OD1 no hydrogen 3.154 N/A LYS 226.A N THR 223.A O no hydrogen 3.074 N/A SER 227.A N THR 223.A OG1 no hydrogen 2.860 N/A SER 227.A N ASP 225.A OD1 no hydrogen 3.085 N/A SER 227.A OG ASP 225.A OD1 no hydrogen 2.663 N/A SER 227.A OG ASP 225.A OD2 no hydrogen 3.440 N/A PHE 228.A N SER 207.A OG no hydrogen 2.884 N/A ALA 230.A N ILE 205.A O no hydrogen 2.878 N/A GLN 231.A N SER 108.A OG no hydrogen 2.924 N/A GLN 231.A NE2 ASP 93.A OD1 no hydrogen 3.057 N/A GLN 231.A NE2 GLU 202.A OE1 no hydrogen 2.922 N/A GLN 231.A NE2 GLU 233.A OE1 no hydrogen 3.234 N/A ILE 232.A N PRO 203.A O no hydrogen 3.399 N/A GLU 233.A N GLY 106.A O no hydrogen 2.960 N/A HIS 234.A N ILE 201.A O no hydrogen 3.181 N/A HIS 234.A ND1 THR 247.A OG1 no hydrogen 2.731 N/A THR 235.A N THR 247.A OG1 no hydrogen 3.029 N/A THR 235.A OG1 ASP 104.A O no hydrogen 2.790 N/A VAL 236.A N LEU 199.A O no hydrogen 2.776 N/A ILE 237.A N ILE 244.A O no hydrogen 2.760 N/A VAL 238.A N MET 197.A O no hydrogen 2.836 N/A THR 239.A OG1 GLY 242.A O no hydrogen 2.514 N/A LYS 240.A NZ ASP 241.A OD2 no hydrogen 2.799 N/A ASP 241.A N THR 239.A OG1 no hydrogen 3.083 N/A GLY 242.A N THR 239.A O no hydrogen 3.210 N/A ILE 244.A N ILE 237.A O no hydrogen 2.892 N/A THR 246.A N THR 235.A O no hydrogen 2.921 N/A THR 247.A OG1 HIS 234.A ND1 no hydrogen 2.731 N/A LYS 248.A N LEU 245.A O no hydrogen 3.435 N/A