Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1qx3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 3.A N GLU 227.A O no hydrogen 2.990 N/A TYR 3.A OH ASP 147.A OD1 no hydrogen 2.594 N/A TYR 3.A OH THR 225.A OG1 no hydrogen 3.427 N/A LYS 4.A NZ ASP 6.A OD1 no hydrogen 2.646 N/A TYR 7.A N SER 78.A OG no hydrogen 3.157 N/A GLU 9.A N LYS 76.A O no hydrogen 2.883 N/A CYS 13.A N GLU 50.A O no hydrogen 2.828 N/A ILE 14.A N VAL 81.A O no hydrogen 2.808 N/A ILE 15.A N ARG 52.A O no hydrogen 2.903 N/A ILE 16.A N VAL 83.A O no hydrogen 2.871 N/A ASN 17.A N LYS 54.A O no hydrogen 2.676 N/A ASN 17.A ND2 ASP 34.A OD1 no hydrogen 3.106 N/A ASN 18.A N LEU 85.A O no hydrogen 3.022 N/A ASN 18.A ND2 LEU 57.A O no hydrogen 3.429 N/A ASN 18.A ND2 PHE 94.A O no hydrogen 3.091 N/A LYS 19.A N ASP 56.A OD1 no hydrogen 2.734 N/A LYS 19.A NZ ASP 34.A OD2 no hydrogen 2.660 N/A ASN 20.A N ASP 56.A OD1 no hydrogen 2.817 N/A HIS 22.A N THR 96.A O no hydrogen 2.761 N/A SER 24.A OG HIS 22.A ND1 no hydrogen 2.630 N/A THR 25.A N HIS 22.A O no hydrogen 2.830 N/A THR 25.A OG1 HIS 22.A O no hydrogen 2.732 N/A MET 27.A N THR 25.A OG1 no hydrogen 3.105 N/A ARG 30.A N LYS 19.A O no hydrogen 3.044 N/A ARG 30.A NH1 ASN 18.A O no hydrogen 3.066 N/A ARG 30.A NH1 THR 33.A OG1 no hydrogen 2.956 N/A THR 33.A N ARG 30.A O no hydrogen 3.348 N/A THR 33.A OG1 ASN 17.A OD1 no hydrogen 2.444 N/A VAL 35.A N GLY 32.A O no hydrogen 3.176 N/A ALA 37.A N THR 33.A O no hydrogen 3.136 N/A ALA 38.A N ASP 34.A O no hydrogen 2.975 N/A ASN 39.A N VAL 35.A O no hydrogen 2.901 N/A LEU 40.A N ASP 36.A O no hydrogen 2.711 N/A ARG 41.A N ALA 37.A O no hydrogen 2.903 N/A ARG 41.A NH1 ASN 53.A OD1 no hydrogen 2.723 N/A GLU 42.A N ALA 38.A O no hydrogen 3.181 N/A THR 43.A N ASN 39.A O no hydrogen 2.880 N/A THR 43.A OG1 ASN 39.A O no hydrogen 2.769 N/A PHE 44.A N LEU 40.A O no hydrogen 2.885 N/A ARG 45.A N ARG 41.A O no hydrogen 3.015 N/A ARG 45.A NE GLU 42.A OE1 no hydrogen 2.991 N/A ARG 45.A NH2 GLU 42.A OE2 no hydrogen 2.995 N/A ASN 46.A N GLU 42.A O no hydrogen 3.124 N/A ASN 46.A ND2 GLU 42.A O no hydrogen 3.180 N/A ASN 46.A ND2 GLU 42.A OE2 no hydrogen 2.837 N/A LEU 47.A N PHE 44.A O no hydrogen 3.135 N/A LYS 48.A N ARG 45.A O no hydrogen 3.023 N/A LYS 48.A NZ ASN 46.A O no hydrogen 3.324 N/A TYR 49.A N PHE 44.A O no hydrogen 3.073 N/A TYR 49.A OH SER 79.A OG no hydrogen 2.834 N/A GLU 50.A N GLY 11.A O no hydrogen 2.792 N/A ARG 52.A N CYS 13.A O no hydrogen 3.035 N/A ARG 52.A NE GLU 50.A OE2 no hydrogen 3.389 N/A ARG 52.A NH1 GLU 72.A OE2 no hydrogen 3.117 N/A ARG 52.A NH2 GLU 50.A OE2 no hydrogen 2.936 N/A ASN 53.A ND2 ALA 37.A O no hydrogen 3.677 N/A LYS 54.A N ILE 15.A O no hydrogen 2.857 N/A ASP 56.A N ASN 17.A O no hydrogen 2.882 N/A LEU 57.A N ASN 18.A OD1 no hydrogen 2.775 N/A THR 58.A N GLU 61.A OE1 no hydrogen 2.813 N/A THR 58.A OG1 GLU 60.A OE2 no hydrogen 3.456 N/A THR 58.A OG1 GLU 61.A OE1 no hydrogen 3.090 N/A ARG 59.A N ASN 97.A OD1 no hydrogen 3.139 N/A GLU 61.A N THR 58.A OG1 no hydrogen 3.110 N/A ILE 62.A N THR 58.A O no hydrogen 2.889 N/A VAL 63.A N ARG 59.A O no hydrogen 3.307 N/A GLU 64.A N GLU 60.A O no hydrogen 2.921 N/A LEU 65.A N GLU 61.A O no hydrogen 2.774 N/A MET 66.A N ILE 62.A O no hydrogen 2.976 N/A ARG 67.A N VAL 63.A O no hydrogen 3.022 N/A ASP 68.A N GLU 64.A O no hydrogen 2.940 N/A VAL 69.A N LEU 65.A O no hydrogen 3.050 N/A SER 70.A N MET 66.A O no hydrogen 2.923 N/A SER 70.A OG MET 66.A O no hydrogen 3.358 N/A SER 70.A OG ARG 67.A O no hydrogen 2.716 N/A LYS 71.A N ARG 67.A O no hydrogen 3.137 N/A LYS 71.A N ASP 68.A O no hydrogen 3.275 N/A GLU 72.A N VAL 69.A O no hydrogen 3.161 N/A HIS 74.A N SER 116.A OG no hydrogen 3.044 N/A HIS 74.A NE2 VAL 69.A O no hydrogen 2.830 N/A SER 75.A N ASP 73.A OD1 no hydrogen 2.854 N/A SER 75.A OG ASP 73.A OD1 no hydrogen 2.571 N/A ARG 77.A N HIS 74.A O no hydrogen 3.005 N/A ARG 77.A NE HIS 74.A ND1 no hydrogen 2.902 N/A SER 78.A N GLU 9.A O no hydrogen 2.827 N/A SER 78.A OG GLU 9.A O no hydrogen 3.182 N/A SER 79.A N MET 10.A O no hydrogen 2.887 N/A SER 79.A OG MET 10.A O no hydrogen 3.055 N/A SER 79.A OG TYR 49.A OH no hydrogen 2.834 N/A PHE 80.A N PRO 121.A O no hydrogen 3.122 N/A VAL 81.A N LEU 12.A O no hydrogen 2.855 N/A CYS 82.A N LEU 123.A O no hydrogen 2.948 N/A CYS 82.A SG ILE 14.A O no hydrogen 3.927 N/A VAL 83.A N ILE 14.A O no hydrogen 2.684 N/A LEU 84.A N ILE 125.A O no hydrogen 2.902 N/A LEU 85.A N ILE 16.A O no hydrogen 3.020 N/A SER 86.A N GLN 127.A O no hydrogen 3.227 N/A SER 86.A OG HIS 87.A O no hydrogen 3.006 N/A SER 86.A OG PHE 94.A O no hydrogen 3.043 N/A HIS 87.A NE2 THR 28.A O no hydrogen 2.825 N/A GLU 89.A N ILE 92.A O no hydrogen 3.186 N/A ILE 92.A N GLU 89.A O no hydrogen 2.944 N/A ILE 93.A N VAL 100.A O no hydrogen 2.812 N/A PHE 94.A N HIS 87.A O no hydrogen 2.906 N/A GLY 95.A N GLY 98.A O no hydrogen 2.644 N/A THR 96.A N LEU 57.A O no hydrogen 2.680 N/A THR 96.A OG1 LEU 57.A O no hydrogen 2.547 N/A ASN 97.A ND2 GLU 60.A OE2 no hydrogen 2.721 N/A VAL 100.A N ILE 93.A O no hydrogen 2.681 N/A LEU 102.A N GLY 91.A O no hydrogen 2.913 N/A LYS 103.A NZ ASN 107.A OD1 no hydrogen 2.864 N/A LYS 104.A N ASP 101.A O no hydrogen 3.105 N/A THR 106.A N LEU 102.A O no hydrogen 3.058 N/A THR 106.A OG1 LEU 102.A O no hydrogen 3.309 N/A THR 106.A OG1 LYS 103.A O no hydrogen 3.331 N/A ASN 107.A N LYS 103.A O no hydrogen 2.887 N/A PHE 109.A N THR 106.A O no hydrogen 2.933 N/A ARG 110.A N ASN 107.A O no hydrogen 3.075 N/A ARG 110.A NH2 ASP 112.A OD2 no hydrogen 2.995 N/A GLY 111.A N VAL 144.A O no hydrogen 2.904 N/A ARG 113.A N ARG 110.A O no hydrogen 2.865 N/A CYS 114.A N ARG 110.A O no hydrogen 3.140 N/A CYS 114.A SG SER 70.A O no hydrogen 3.550 N/A CYS 114.A SG SER 116.A OG no hydrogen 3.723 N/A SER 116.A OG GLU 72.A O no hydrogen 3.411 N/A LEU 117.A N CYS 114.A O no hydrogen 3.014 N/A THR 118.A N ARG 115.A O no hydrogen 3.343 N/A THR 118.A OG1 GLY 111.A O no hydrogen 2.695 N/A THR 118.A OG1 CYS 114.A O no hydrogen 3.545 N/A THR 118.A OG1 ARG 115.A O no hydrogen 3.376 N/A LYS 120.A N LEU 117.A O no hydrogen 2.773 N/A LYS 120.A NZ HIS 74.A O no hydrogen 2.832 N/A LYS 120.A NZ SER 75.A O no hydrogen 3.098 N/A LYS 120.A NZ ARG 77.A O no hydrogen 2.970 N/A LYS 120.A NZ SER 116.A O no hydrogen 3.055 N/A LYS 122.A N ASP 147.A O no hydrogen 2.952 N/A LYS 122.A NZ LEU 117.A O no hydrogen 3.020 N/A LYS 122.A NZ LYS 120.A O no hydrogen 2.579 N/A LEU 123.A N PHE 80.A O no hydrogen 2.870 N/A PHE 124.A N LEU 149.A O no hydrogen 2.821 N/A ILE 125.A N CYS 82.A O no hydrogen 2.910 N/A ILE 126.A N ALA 151.A O no hydrogen 2.901 N/A GLN 127.A N LEU 84.A O no hydrogen 2.900 N/A GLN 127.A NE2 SER 160.A OG no hydrogen 2.707 N/A ARG 130.A N TYR 158.A O no hydrogen 2.913 N/A ARG 130.A NH1 THR 154.A O no hydrogen 3.288 N/A ARG 130.A NH2 GLU 90.A OE2 no hydrogen 2.930 N/A GLU 133.A N GLY 157.A O no hydrogen 3.220 N/A GLY 137.A N ASP 135.A OD1 no hydrogen 2.814 N/A ALA 146.A N PRO 143.A O no hydrogen 3.260 N/A ASP 147.A N MET 223.A O no hydrogen 2.890 N/A LEU 149.A N LYS 122.A O no hydrogen 2.821 N/A TYR 150.A N VAL 221.A O no hydrogen 2.723 N/A ALA 151.A N PHE 124.A O no hydrogen 2.824 N/A TYR 152.A N CYS 219.A O no hydrogen 2.912 N/A SER 153.A N ILE 126.A O no hydrogen 2.964 N/A SER 153.A OG ILE 126.A O no hydrogen 3.443 N/A SER 153.A OG SER 160.A OG no hydrogen 2.640 N/A THR 154.A OG1 TYR 158.A O no hydrogen 3.088 N/A GLY 157.A N GLU 90.A OE1 no hydrogen 2.920 N/A TYR 158.A N ALA 155.A O no hydrogen 3.062 N/A TYR 159.A N GLU 133.A O no hydrogen 2.951 N/A SER 160.A OG SER 153.A OG no hydrogen 2.640 N/A TRP 161.A N GLN 216.A OE1 no hydrogen 2.631 N/A ASN 163.A N GLY 167.A O no hydrogen 2.747 N/A LYS 165.A N ASN 163.A OD1 no hydrogen 2.935 N/A LYS 165.A NZ ASP 166.A OD1 no hydrogen 3.125 N/A ASP 166.A N ASN 163.A OD1 no hydrogen 2.829 N/A GLY 167.A N ASN 163.A O no hydrogen 2.661 N/A SER 168.A N ASP 36.A OD1 no hydrogen 3.196 N/A SER 168.A N ASP 36.A OD2 no hydrogen 3.218 N/A SER 168.A OG ASP 36.A OD2 no hydrogen 2.757 N/A TRP 169.A N TRP 161.A O no hydrogen 3.347 N/A ILE 171.A N SER 168.A OG no hydrogen 3.301 N/A GLN 172.A N SER 168.A O no hydrogen 3.039 N/A SER 173.A N TRP 169.A O no hydrogen 3.199 N/A SER 173.A OG TRP 169.A O no hydrogen 2.835 N/A LEU 174.A N PHE 170.A O no hydrogen 2.827 N/A CYS 175.A N ILE 171.A O no hydrogen 3.032 N/A CYS 175.A SG THR 43.A OG1 no hydrogen 3.231 N/A CYS 175.A SG ILE 171.A O no hydrogen 3.480 N/A ALA 176.A N GLN 172.A O no hydrogen 3.137 N/A MET 177.A N SER 173.A O no hydrogen 2.839 N/A LEU 178.A N LEU 174.A O no hydrogen 2.918 N/A LYS 179.A N CYS 175.A O no hydrogen 2.842 N/A GLN 180.A N ALA 176.A O no hydrogen 3.026 N/A TYR 181.A N MET 177.A O no hydrogen 2.746 N/A ALA 182.A N LEU 178.A O no hydrogen 2.845 N/A LYS 184.A N TYR 181.A O no hydrogen 3.101 N/A LYS 184.A NZ GLN 180.A O no hydrogen 3.401 N/A LYS 184.A NZ ASP 183.A OD1 no hydrogen 2.943 N/A LYS 184.A NZ ASP 183.A OD2 no hydrogen 3.463 N/A LEU 185.A N TYR 181.A O no hydrogen 2.957 N/A PHE 187.A N LEU 228.A O no hydrogen 2.789 N/A MET 188.A N GLU 186.A OE1 no hydrogen 2.836 N/A ILE 190.A N GLU 186.A O no hydrogen 3.039 N/A LEU 191.A N PHE 187.A O no hydrogen 2.878 N/A THR 192.A N MET 188.A O no hydrogen 2.957 N/A THR 192.A N HIS 189.A O no hydrogen 3.225 N/A THR 192.A OG1 MET 188.A O no hydrogen 2.792 N/A ARG 193.A N HIS 189.A O no hydrogen 3.242 N/A ARG 193.A N ILE 190.A O no hydrogen 3.097 N/A VAL 194.A N ILE 190.A O no hydrogen 3.083 N/A ASN 195.A N LEU 191.A O no hydrogen 2.966 N/A ARG 196.A N THR 192.A O no hydrogen 3.142 N/A LYS 197.A N ARG 193.A O no hydrogen 2.902 N/A LYS 197.A NZ GLU 201.A OE1 no hydrogen 2.815 N/A VAL 198.A N VAL 194.A O no hydrogen 3.049 N/A ALA 199.A N ASN 195.A O no hydrogen 2.994 N/A THR 200.A N ARG 196.A O no hydrogen 2.797 N/A THR 200.A OG1 ARG 196.A O no hydrogen 2.614 N/A GLU 201.A N LYS 197.A O no hydrogen 2.819 N/A SER 204.A N LYS 214.A O no hydrogen 2.934 N/A SER 204.A OG PHE 211.A O no hydrogen 2.651 N/A SER 206.A N HIS 212.A ND1 no hydrogen 3.200 N/A SER 206.A OG ASP 208.A O no hydrogen 3.358 N/A ASP 208.A N SER 206.A OG no hydrogen 2.948 N/A THR 210.A N ASP 208.A OD1 no hydrogen 3.075 N/A THR 210.A OG1 ASP 208.A OD1 no hydrogen 2.580 N/A PHE 211.A N ASP 208.A O no hydrogen 2.716 N/A ALA 213.A N SER 204.A O no hydrogen 2.834 N/A LYS 214.A N SER 204.A OG no hydrogen 2.787 N/A LYS 215.A N ASP 135.A O no hydrogen 2.797 N/A LYS 215.A NZ ALA 199.A O no hydrogen 2.721 N/A LYS 215.A NZ PHE 202.A O no hydrogen 2.722 N/A GLN 216.A NE2 SER 153.A O no hydrogen 2.767 N/A CYS 219.A N TYR 152.A O no hydrogen 2.936 N/A VAL 221.A N TYR 150.A O no hydrogen 2.745 N/A MET 223.A N PHE 148.A O no hydrogen 2.826 N/A LEU 224.A N SER 222.A OG no hydrogen 3.053 N/A THR 225.A N TYR 3.A OH no hydrogen 2.929 N/A THR 225.A OG1 TYR 3.A OH no hydrogen 3.427 N/A THR 225.A OG1 ASP 147.A OD1 no hydrogen 2.643 N/A GLU 227.A N ASN 1.A O no hydrogen 2.853 N/A LEU 228.A N GLU 186.A OE2 no hydrogen 2.743 N/A TYR 229.A OH GLU 227.A OE1 no hydrogen 2.664 N/A TYR 231.A OH LYS 184.A O no hydrogen 2.722 N/A