Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3lqb_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 1.A N ASN 140.A O no hydrogen 2.764 N/A LEU 2.A N GLY 105.A O no hydrogen 2.861 N/A CYS 4.A SG.A ASP 6.A OD1 no hydrogen 3.479 N/A CYS 4.A SG.A SER 8.A OG no hydrogen 3.652 N/A CYS 4.A SG.B CYS 4.A O.B no hydrogen 2.734 N/A LYS 7.A N CYS 4.A O.A no hydrogen 2.912 N/A LYS 7.A N CYS 4.A O.B no hydrogen 2.831 N/A SER 8.A N ASP 6.A OD1 no hydrogen 2.901 N/A SER 8.A OG ASP 6.A OD1 no hydrogen 2.722 N/A SER 8.A OG ASP 6.A OD2 no hydrogen 3.479 N/A PHE 10.A N LYS 7.A O no hydrogen 3.225 N/A TRP 11.A N TYR 196.A OH no hydrogen 3.275 N/A TRP 11.A NE1 ALA 103.A O no hydrogen 2.881 N/A LYS 13.A NZ ASN 17.A OD1 no hydrogen 2.703 N/A LYS 13.A NZ TYR 196.A O no hydrogen 2.883 N/A ASN 14.A N ILE 18.A O no hydrogen 2.903 N/A ASN 16.A N ASN 14.A OD1 no hydrogen 2.764 N/A ASN 17.A N ASN 14.A O no hydrogen 2.929 N/A ASN 17.A ND2 CYS 198.A OXT no hydrogen 3.219 N/A ILE 18.A N ASN 14.A OD1 no hydrogen 3.041 N/A VAL 19.A N CYS 49.A O no hydrogen 2.868 N/A VAL 21.A N ARG 51.A O no hydrogen 2.839 N/A TYR 23.A N VAL 53.A O no hydrogen 2.945 N/A VAL 24.A N LEU 62.A O no hydrogen 2.806 N/A SER 26.A N ILE 64.A O no hydrogen 2.936 N/A GLU 28.A N SER 26.A OG no hydrogen 3.019 N/A PHE 29.A N SER 26.A O no hydrogen 3.220 N/A SER 30.A N ASP 33.A OD2 no hydrogen 2.957 N/A ASP 33.A N SER 30.A OG no hydrogen 2.985 N/A LYS 34.A N SER 30.A O no hydrogen 2.934 N/A SER 35.A N ILE 31.A O no hydrogen 3.104 N/A SER 35.A OG.B ASN 32.A O no hydrogen 2.768 N/A SER 35.A OG.C ILE 31.A O no hydrogen 3.294 N/A VAL 36.A N ASN 32.A O no hydrogen 3.120 N/A ILE 37.A N ASP 33.A O no hydrogen 2.999 N/A ALA 38.A N LYS 34.A O no hydrogen 2.909 N/A ASN 39.A N SER 35.A O no hydrogen 2.929 N/A ALA 40.A N VAL 36.A O no hydrogen 3.034 N/A ILE 41.A N ILE 37.A O no hydrogen 2.978 N/A SER 42.A N.A ALA 38.A O no hydrogen 2.875 N/A SER 42.A N.B ALA 38.A O no hydrogen 2.862 N/A SER 42.A OG.A ASN 39.A O no hydrogen 2.717 N/A SER 42.A OG.B ALA 38.A O no hydrogen 2.988 N/A ILE 43.A N ALA 40.A O no hydrogen 3.148 N/A HIS 45.A N ILE 41.A O no hydrogen 3.014 N/A ALA 46.A N SER 42.A O.A no hydrogen 2.970 N/A ALA 46.A N SER 42.A O.B no hydrogen 2.878 N/A GLN 47.A N PHE 44.A O no hydrogen 3.343 N/A THR 48.A N PHE 44.A O no hydrogen 2.981 N/A THR 48.A OG1 PHE 44.A O no hydrogen 2.751 N/A ILE 50.A N THR 48.A OG1 no hydrogen 3.036 N/A ARG 51.A N VAL 19.A O no hydrogen 2.822 N/A ARG 51.A NH1 THR 48.A O no hydrogen 2.840 N/A ARG 51.A NH1 ILE 50.A O no hydrogen 2.857 N/A PHE 52.A N HIS 45.A NE2 no hydrogen 2.949 N/A VAL 53.A N VAL 21.A O no hydrogen 3.005 N/A ARG 55.A N TYR 23.A O no hydrogen 2.862 N/A ARG 55.A NE GLN 58.A O no hydrogen 2.852 N/A ARG 55.A NH2 GLN 58.A O no hydrogen 2.808 N/A SER 56.A N GLN 58.A OE1 no hydrogen 2.849 N/A SER 56.A OG GLN 58.A OE1 no hydrogen 3.246 N/A ILE 57.A N SER 56.A OG no hydrogen 2.720 N/A GLN 58.A N GLN 58.A OE1 no hydrogen 2.832 N/A TYR 61.A N GLY 79.A O no hydrogen 3.138 N/A LEU 62.A N PRO 22.A O no hydrogen 2.862 N/A SER 63.A N GLN 81.A O no hydrogen 2.806 N/A SER 63.A OG GLU 65.A OE2 no hydrogen 2.613 N/A ILE 64.A N VAL 24.A O no hydrogen 2.812 N/A GLU 65.A N VAL 83.A O no hydrogen 2.855 N/A LYS 67.A N SER 84.A OG no hydrogen 3.133 N/A TYR 71.A N SER 84.A O no hydrogen 2.998 N/A SER 72.A OG ALA 73.A O no hydrogen 2.822 N/A SER 72.A OG GLU 99.A O no hydrogen 3.233 N/A GLY 75.A N HIS 102.A O no hydrogen 2.923 N/A ARG 76.A N CYS 9.A O.A no hydrogen 2.784 N/A ARG 76.A N CYS 9.A O.B no hydrogen 2.980 N/A ARG 76.A NE PHE 10.A O no hydrogen 2.820 N/A ARG 76.A NH1 ASP 60.A OD2 no hydrogen 2.746 N/A ARG 76.A NH2 PHE 10.A O no hydrogen 3.068 N/A THR 77.A N GLN 81.A OE1 no hydrogen 2.909 N/A THR 77.A OG1 GLN 81.A OE1 no hydrogen 3.365 N/A GLY 79.A N ASP 60.A OD1 no hydrogen 2.771 N/A GLN 81.A N TYR 61.A O no hydrogen 2.910 N/A GLN 81.A NE2 GLY 75.A O no hydrogen 2.903 N/A VAL 83.A N SER 63.A O no hydrogen 2.883 N/A SER 84.A N TYR 71.A O no hydrogen 2.824 N/A SER 84.A OG GLY 69.A O no hydrogen 2.756 N/A LEU 85.A N GLU 65.A O no hydrogen 2.934 N/A ASN 86.A N GLY 69.A O no hydrogen 3.137 N/A ASN 86.A ND2.A LYS 67.A O no hydrogen 2.691 N/A ARG 87.A NE ASP 33.A OD2 no hydrogen 2.826 N/A ARG 87.A NH2 ASP 33.A OD2 no hydrogen 3.265 N/A LYS 88.A N ASN 86.A OD1.A no hydrogen 2.935 N/A GLY 89.A N ASN 86.A O no hydrogen 3.140 N/A GLY 89.A N ASN 86.A OD1.A no hydrogen 3.126 N/A CYS 90.A N ASN 86.A O no hydrogen 2.894 N/A TYR 92.A N CYS 90.A O no hydrogen 2.890 N/A SER 93.A OG ASN 39.A OD1.A no hydrogen 2.544 N/A ALA 96.A N TYR 92.A O no hydrogen 2.928 N/A GLN 97.A N SER 93.A O no hydrogen 2.883 N/A GLN 97.A NE2 SER 93.A O no hydrogen 3.430 N/A GLN 97.A NE2 SER 93.A OG no hydrogen 2.974 N/A HIS 98.A N GLY 94.A O no hydrogen 2.974 N/A HIS 98.A ND1 LEU 151.A O no hydrogen 2.789 N/A GLU 99.A N ILE 95.A O no hydrogen 2.994 N/A LEU 100.A N ALA 96.A O no hydrogen 2.933 N/A ASN 101.A N GLN 97.A O no hydrogen 2.868 N/A HIS 102.A N HIS 98.A O no hydrogen 3.101 N/A HIS 102.A ND1 PHE 106.A O no hydrogen 2.765 N/A HIS 102.A NE2 HIS 108.A NE2 no hydrogen 3.078 N/A ALA 103.A N GLU 99.A O no hydrogen 3.158 N/A LEU 104.A N LEU 100.A O no hydrogen 3.076 N/A LEU 104.A N ASN 101.A O no hydrogen 3.181 N/A GLY 105.A N HIS 102.A O no hydrogen 2.855 N/A PHE 106.A N ASN 101.A O no hydrogen 3.317 N/A GLU 109.A N MET 152.A O no hydrogen 2.945 N/A SER 111.A N HIS 108.A O no hydrogen 3.103 N/A SER 111.A OG LEU 135.A O no hydrogen 3.515 N/A SER 111.A OG GLN 137.A OE1 no hydrogen 2.819 N/A ARG 112.A N GLU 109.A O no hydrogen 3.050 N/A ARG 112.A NE ASP 114.A OD1 no hydrogen 2.822 N/A ARG 112.A NH1 THR 144.A O no hydrogen 2.953 N/A ARG 112.A NH2 ASP 114.A OD1 no hydrogen 3.411 N/A ARG 112.A NH2 ASP 114.A OD2 no hydrogen 2.882 N/A ARG 112.A NH2 THR 144.A O no hydrogen 2.966 N/A SER 113.A N THR 139.A OG1 no hydrogen 3.130 N/A ARG 115.A N ARG 112.A O no hydrogen 2.952 N/A ARG 115.A NE ASP 116.A OD1.B no hydrogen 3.019 N/A ARG 115.A NH1 PHE 134.A O no hydrogen 2.967 N/A ARG 115.A NH2 GLN 110.A O no hydrogen 2.806 N/A ARG 115.A NH2 PHE 134.A O no hydrogen 2.809 N/A GLN 117.A N ASP 114.A O no hydrogen 3.058 N/A GLN 117.A NE2 ASP 116.A OD1.A no hydrogen 2.820 N/A TYR 118.A N ARG 115.A O no hydrogen 2.900 N/A VAL 119.A N ARG 115.A O no hydrogen 2.982 N/A ARG 120.A N THR 169.A O no hydrogen 2.815 N/A ARG 120.A NE ASN 122.A OD1 no hydrogen 2.880 N/A ASN 122.A N THR 167.A O no hydrogen 2.835 N/A ASN 122.A ND2 GLU 166.A O no hydrogen 2.928 N/A ASN 122.A ND2 THR 169.A OG1 no hydrogen 2.883 N/A ASN 125.A N ASN 122.A O no hydrogen 2.905 N/A ASN 125.A ND2 GLU 166.A O no hydrogen 2.875 N/A ILE 126.A N TRP 123.A O no hydrogen 3.149 N/A SER 127.A N.A PHE 159.A O no hydrogen 2.852 N/A SER 127.A N.B PHE 159.A O no hydrogen 2.869 N/A SER 127.A OG.B PHE 159.A O no hydrogen 3.277 N/A MET 130.A N SER 127.A O.A no hydrogen 3.032 N/A MET 130.A N SER 127.A O.B no hydrogen 2.945 N/A ASN 133.A N MET 130.A O no hydrogen 3.117 N/A ASN 133.A ND2 MET 130.A O no hydrogen 2.935 N/A PHE 134.A N ALA 131.A O no hydrogen 2.826 N/A LEU 135.A N TYR 132.A O no hydrogen 3.345 N/A LYS 136.A NZ SER 113.A O no hydrogen 3.105 N/A LYS 136.A NZ ASP 116.A OD2.A no hydrogen 2.669 N/A LYS 136.A NZ ASP 116.A OD2.B no hydrogen 2.420 N/A GLN 137.A N SER 111.A O no hydrogen 2.884 N/A THR 139.A OG1 ASN 141.A OD1 no hydrogen 2.774 N/A ASN 140.A N ALA 1.A O no hydrogen 2.896 N/A ASN 141.A ND2 SER 113.A OG no hydrogen 3.092 N/A GLN 142.A N ASN 140.A OD1 no hydrogen 2.884 N/A GLN 142.A NE2 ARG 191.A O no hydrogen 3.046 N/A THR 144.A N ASN 141.A O no hydrogen 2.980 N/A THR 144.A OG1 ASN 141.A O no hydrogen 2.759 N/A TYR 146.A OH HIS 153.A NE2 no hydrogen 2.751 N/A ASP 147.A N GLU 109.A OE2 no hydrogen 2.765 N/A TYR 148.A OH TYR 118.A O no hydrogen 2.657 N/A GLY 149.A N ASP 147.A OD1 no hydrogen 2.976 N/A SER 150.A N ASP 147.A O no hydrogen 2.971 N/A SER 150.A OG ASP 188.A OD1 no hydrogen 2.648 N/A SER 150.A OG ASP 188.A OD2 no hydrogen 3.527 N/A LEU 151.A N ASP 188.A OD2 no hydrogen 2.811 N/A MET 152.A N SER 150.A OG no hydrogen 2.875 N/A HIS 153.A N SER 150.A O no hydrogen 3.098 N/A HIS 153.A ND1 TYR 154.A O no hydrogen 2.737 N/A TYR 154.A N GLN 110.A OE1 no hydrogen 2.889 N/A LYS 156.A NZ GLU 174.A O no hydrogen 2.766 N/A ALA 158.A N GLY 155.A O no hydrogen 3.310 N/A ALA 160.A N THR 157.A O no hydrogen 3.101 N/A ILE 161.A N ASN 125.A O no hydrogen 2.805 N/A LEU 165.A N GLN 162.A O no hydrogen 3.214 N/A THR 167.A N LYS 156.A O no hydrogen 2.773 N/A THR 167.A OG1 LYS 156.A O no hydrogen 3.309 N/A THR 167.A OG1 ALA 158.A O no hydrogen 2.769 N/A ILE 168.A N LYS 156.A O no hydrogen 3.197 N/A THR 169.A N ARG 120.A O no hydrogen 2.894 N/A THR 169.A OG1 GLU 166.A OE2 no hydrogen 2.739 N/A ILE 171.A N TYR 118.A O no hydrogen 2.915 N/A ASN 175.A N ASP 173.A OD1 no hydrogen 2.943 N/A VAL 176.A N ASP 173.A O no hydrogen 3.453 N/A GLN 180.A NE2 GLY 149.A O no hydrogen 2.927 N/A GLN 180.A NE2 GLY 183.A O no hydrogen 2.872 N/A ARG 181.A NH1 HIS 153.A O no hydrogen 2.926 N/A ARG 181.A NH1 GLN 180.A O no hydrogen 2.841 N/A ARG 181.A NH2 HIS 153.A O no hydrogen 2.997 N/A GLN 182.A N GLN 180.A OE1 no hydrogen 2.798 N/A GLY 183.A N GLN 180.A OE1 no hydrogen 3.173 N/A LEU 184.A N GLN 97.A OE1 no hydrogen 2.898 N/A SER 185.A N ASP 188.A OD2 no hydrogen 2.882 N/A SER 185.A OG ASP 147.A OD2 no hydrogen 2.726 N/A ASP 188.A N SER 185.A OG no hydrogen 2.973 N/A ILE 189.A N SER 185.A O no hydrogen 2.968 N/A LEU 190.A N LYS 186.A O no hydrogen 2.921 N/A ARG 191.A N ILE 187.A O no hydrogen 2.955 N/A ARG 191.A NE THR 144.A OG1 no hydrogen 2.901 N/A ARG 191.A NH1 GLU 109.A OE1 no hydrogen 2.728 N/A ARG 191.A NH2 GLU 109.A OE1 no hydrogen 3.480 N/A ARG 191.A NH2 GLU 109.A OE2 no hydrogen 2.885 N/A ARG 191.A NH2 THR 144.A OG1 no hydrogen 3.390 N/A ARG 191.A NH2 PRO 145.A O no hydrogen 3.043 N/A ILE 192.A N ASP 188.A O no hydrogen 3.159 N/A ASN 193.A N ILE 189.A O no hydrogen 3.022 N/A ASN 193.A ND2 GLN 47.A O no hydrogen 2.921 N/A LYS 194.A N LEU 190.A O no hydrogen 2.858 N/A LYS 194.A NZ GLN 142.A O no hydrogen 2.778 N/A LEU 195.A N ARG 191.A O no hydrogen 2.936 N/A TYR 196.A N ILE 192.A O no hydrogen 2.984 N/A TYR 196.A OH LEU 104.A O no hydrogen 2.693 N/A GLY 197.A N LYS 194.A O no hydrogen 3.340 N/A CYS 198.A N ASN 193.A O no hydrogen 3.055 N/A CYS 198.A SG ASN 193.A OD1 no hydrogen 3.231 N/A