Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6llx_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 4.A N GLN 56.A O no hydrogen 2.951 N/A VAL 5.A N LYS 29.A O no hydrogen 2.773 N/A VAL 6.A N LYS 54.A O no hydrogen 2.856 N/A TYR 7.A N GLU 31.A O no hydrogen 3.203 N/A VAL 10.A N.A PHE 8.A O no hydrogen 2.804 N/A VAL 10.A N.B PHE 8.A O no hydrogen 2.784 N/A ARG 11.A N PRO 202.A O no hydrogen 2.876 N/A ARG 11.A NE TYR 198.A O no hydrogen 3.039 N/A ARG 11.A NH2 TYR 198.A O no hydrogen 3.087 N/A ARG 11.A NH2 VAL 199.A O no hydrogen 3.180 N/A GLY 12.A N ILE 203.A O no hydrogen 2.857 N/A ARG 13.A N TYR 7.A OH no hydrogen 2.967 N/A ARG 13.A NH1 SER 65.A OG no hydrogen 3.255 N/A ARG 13.A NH1 GLU 97.A OE1 no hydrogen 2.919 N/A ARG 13.A NH1 GLU 97.A OE2 no hydrogen 3.515 N/A ARG 13.A NH2 GLU 97.A OE2 no hydrogen 3.003 N/A CYS 14.A N ARG 11.A O no hydrogen 2.983 N/A ARG 18.A N CYS 14.A O no hydrogen 2.983 N/A ARG 18.A NE GLU 30.A OE2 no hydrogen 2.764 N/A ARG 18.A NH1 VAL 10.A O.A no hydrogen 2.925 N/A ARG 18.A NH1 VAL 10.A O.B no hydrogen 2.941 N/A ARG 18.A NH2 GLU 30.A OE1 no hydrogen 2.966 N/A MET 19.A N ALA 15.A O no hydrogen 2.901 N/A LEU 20.A N ALA 16.A O no hydrogen 2.924 N/A LEU 21.A N LEU 17.A O no hydrogen 2.946 N/A ALA 22.A N ARG 18.A O no hydrogen 2.876 N/A ASP 23.A N MET 19.A O no hydrogen 2.877 N/A GLN 24.A N LEU 20.A O no hydrogen 2.942 N/A GLN 24.A NE2 TYR 153.A OH no hydrogen 3.085 N/A GLY 25.A N ALA 22.A O no hydrogen 3.092 N/A GLN 26.A N LEU 21.A O no hydrogen 2.958 N/A GLN 26.A NE2 GLN 24.A O no hydrogen 3.355 N/A TRP 28.A NE1 GLU 30.A OE2 no hydrogen 2.813 N/A LYS 29.A N TYR 3.A O no hydrogen 2.822 N/A GLU 31.A N VAL 5.A O no hydrogen 2.788 N/A VAL 33.A N TYR 7.A O no hydrogen 2.890 N/A THR 34.A OG1 THR 37.A OG1 no hydrogen 2.980 N/A GLU 36.A N GLU 36.A OE2 no hydrogen 2.891 N/A THR 37.A N THR 34.A OG1 no hydrogen 3.135 N/A THR 37.A OG1 THR 34.A OG1 no hydrogen 2.980 N/A TRP 38.A N THR 34.A O no hydrogen 2.880 N/A GLN 39.A N VAL 35.A O no hydrogen 2.848 N/A GLU 40.A N GLU 36.A O no hydrogen 3.161 N/A GLU 40.A N THR 37.A O no hydrogen 3.207 N/A GLY 41.A N TRP 38.A O no hydrogen 3.102 N/A SER 42.A N GLU 40.A OE1 no hydrogen 2.959 N/A SER 42.A OG GLU 40.A OE1 no hydrogen 2.545 N/A LYS 44.A NZ GLY 50.A O no hydrogen 2.931 N/A ALA 45.A N GLY 41.A O no hydrogen 2.996 N/A SER 46.A N SER 42.A O no hydrogen 3.226 N/A SER 46.A N LEU 43.A O no hydrogen 2.992 N/A SER 46.A OG LEU 43.A O no hydrogen 2.669 N/A CYS 47.A N LYS 44.A O no hydrogen 3.098 N/A CYS 47.A SG LEU 43.A O no hydrogen 3.380 N/A CYS 47.A SG GLN 51.A O no hydrogen 3.646 N/A GLY 50.A N CYS 47.A O no hydrogen 3.020 N/A LYS 54.A N VAL 6.A O no hydrogen 3.117 N/A PHE 55.A N LEU 62.A O no hydrogen 2.833 N/A GLN 56.A N THR 4.A O no hydrogen 2.932 N/A ASP 57.A N LEU 60.A O no hydrogen 2.853 N/A GLY 58.A N PRO 2.A O no hydrogen 3.048 N/A LEU 60.A N ASP 57.A O no hydrogen 2.963 N/A LEU 62.A N PHE 55.A O no hydrogen 2.778 N/A ASN 66.A ND2 GLU 97.A OE1 no hydrogen 3.015 N/A ILE 68.A N GLN 64.A O no hydrogen 3.022 N/A LEU 69.A N SER 65.A O no hydrogen 3.021 N/A ARG 70.A N ASN 66.A O no hydrogen 2.932 N/A ARG 70.A NE TYR 79.A OH no hydrogen 3.176 N/A ARG 70.A NE ASP 90.A OD1 no hydrogen 2.903 N/A ARG 70.A NH2 ASP 90.A OD1 no hydrogen 3.159 N/A ARG 70.A NH2 ASP 94.A OD1 no hydrogen 3.076 N/A HIS 71.A N THR 67.A O no hydrogen 2.835 N/A HIS 71.A NE2 ASP 57.A OD2 no hydrogen 2.789 N/A LEU 72.A N ILE 68.A O no hydrogen 2.963 N/A GLY 73.A N LEU 69.A O no hydrogen 2.845 N/A ARG 74.A N ARG 70.A O no hydrogen 2.834 N/A THR 75.A N HIS 71.A O no hydrogen 3.003 N/A THR 75.A OG1 HIS 71.A O no hydrogen 2.833 N/A THR 75.A OG1 LEU 72.A O no hydrogen 3.517 N/A LEU 76.A N LEU 72.A O no hydrogen 2.886 N/A LEU 78.A N GLY 73.A O no hydrogen 2.782 N/A TYR 79.A OH ASP 90.A OD1 no hydrogen 2.561 N/A TYR 79.A OH ASP 90.A OD2 no hydrogen 3.426 N/A LYS 81.A N GLU 85.A OE1 no hydrogen 2.849 N/A GLU 85.A N ASP 82.A OD1 no hydrogen 2.856 N/A ALA 86.A N ASP 82.A O no hydrogen 2.967 N/A ALA 87.A N GLN 83.A O no hydrogen 3.043 N/A LEU 88.A N GLN 84.A O no hydrogen 3.083 N/A VAL 89.A N GLU 85.A O no hydrogen 2.814 N/A ASP 90.A N ALA 86.A O no hydrogen 3.005 N/A MET 91.A N ALA 87.A O no hydrogen 2.907 N/A VAL 92.A N LEU 88.A O no hydrogen 2.993 N/A ASN 93.A N VAL 89.A O no hydrogen 2.905 N/A ASN 93.A ND2 ASN 66.A OD1 no hydrogen 2.984 N/A ASP 94.A N ASP 90.A O no hydrogen 2.815 N/A GLY 95.A N MET 91.A O no hydrogen 3.154 N/A VAL 96.A N VAL 92.A O no hydrogen 2.862 N/A GLU 97.A N ASN 93.A O no hydrogen 2.844 N/A ASP 98.A N ASP 94.A O no hydrogen 3.002 N/A LEU 99.A N GLY 95.A O no hydrogen 3.227 N/A ARG 100.A N VAL 96.A O no hydrogen 2.834 N/A ARG 100.A NH1 ASP 157.A OD2 no hydrogen 3.045 N/A ARG 100.A NH2 ASN 154.A OD1 no hydrogen 2.872 N/A ARG 100.A NH2 ASP 157.A OD2 no hydrogen 2.930 N/A CYS 101.A N GLU 97.A O no hydrogen 2.892 N/A CYS 101.A SG GLU 97.A O no hydrogen 3.488 N/A CYS 101.A SG GLU 97.A OE2 no hydrogen 3.270 N/A LYS 102.A N ASP 98.A O no hydrogen 3.244 N/A LYS 102.A NZ GLN 125.A OE1 no hydrogen 3.178 N/A TYR 103.A N LEU 99.A O no hydrogen 2.876 N/A ILE 104.A N ARG 100.A O no hydrogen 2.822 N/A SER 105.A N CYS 101.A O no hydrogen 2.962 N/A SER 105.A OG THR 109.A OG1 no hydrogen 3.414 N/A LEU 106.A N LYS 102.A O no hydrogen 3.002 N/A ILE 107.A N TYR 103.A O no hydrogen 2.888 N/A TYR 108.A N ILE 104.A O no hydrogen 2.955 N/A THR 109.A N SER 105.A O no hydrogen 2.952 N/A THR 109.A OG1 SER 105.A O no hydrogen 2.669 N/A THR 109.A OG1 SER 105.A OG no hydrogen 3.414 N/A ASN 110.A N LEU 106.A O no hydrogen 3.144 N/A TYR 111.A OH GLN 209.A OXT no hydrogen 2.639 N/A GLY 114.A N ASN 110.A O no hydrogen 2.830 N/A LYS 115.A N TYR 111.A O no hydrogen 3.104 N/A LYS 115.A NZ TYR 111.A OH no hydrogen 2.984 N/A TYR 118.A N GLY 114.A O no hydrogen 2.991 N/A TYR 118.A OH HIS 162.A NE2 no hydrogen 2.675 N/A VAL 119.A N LYS 115.A O no hydrogen 2.874 N/A LYS 120.A N ASP 116.A O no hydrogen 2.965 N/A ALA 121.A N ASP 117.A O no hydrogen 2.957 N/A ALA 121.A N TYR 118.A O no hydrogen 3.134 N/A LEU 122.A N VAL 119.A O no hydrogen 3.125 N/A GLN 125.A N LEU 122.A O no hydrogen 2.939 N/A LEU 126.A N LEU 122.A O no hydrogen 2.937 N/A LEU 126.A N PRO 123.A O no hydrogen 3.197 N/A LYS 127.A N PRO 123.A O no hydrogen 2.930 N/A PHE 129.A N LEU 126.A O no hydrogen 2.977 N/A GLU 130.A N LEU 126.A O no hydrogen 3.484 N/A THR 131.A N LYS 127.A O no hydrogen 2.919 N/A THR 131.A OG1 LYS 127.A O no hydrogen 3.250 N/A LEU 132.A N PRO 128.A O no hydrogen 2.881 N/A LEU 133.A N PHE 129.A O no hydrogen 3.022 N/A SER 134.A N GLU 130.A O no hydrogen 2.892 N/A SER 134.A OG THR 131.A O no hydrogen 2.678 N/A GLN 135.A N THR 131.A O no hydrogen 3.194 N/A GLN 135.A N LEU 132.A O no hydrogen 3.092 N/A ASN 136.A N LEU 133.A O no hydrogen 3.031 N/A ASN 136.A ND2 PHE 142.A O no hydrogen 2.759 N/A ASN 136.A ND2 GLY 145.A O no hydrogen 2.940 N/A GLY 139.A N ASN 136.A O no hydrogen 2.885 N/A LYS 140.A N GLN 137.A O no hydrogen 3.032 N/A THR 141.A OG1 GLN 137.A OE1 no hydrogen 2.741 N/A THR 141.A OG1 GLY 145.A O no hydrogen 3.199 N/A PHE 142.A N THR 141.A OG1 no hydrogen 2.713 N/A ILE 143.A N ASP 152.A OD1 no hydrogen 2.855 N/A SER 149.A N ASP 152.A OD2 no hydrogen 2.799 N/A SER 149.A OG ASP 152.A OD2 no hydrogen 3.348 N/A PHE 150.A N LEU 78.A O no hydrogen 2.951 N/A ASP 152.A N SER 149.A O no hydrogen 2.978 N/A TYR 153.A OH ASP 23.A OD2 no hydrogen 2.752 N/A ASN 154.A N PHE 150.A O no hydrogen 3.149 N/A ASN 154.A ND2 ASN 93.A OD1 no hydrogen 2.856 N/A LEU 155.A N ALA 151.A O no hydrogen 2.781 N/A LEU 156.A N ASP 152.A O no hydrogen 2.777 N/A ASP 157.A N TYR 153.A O no hydrogen 3.030 N/A LEU 158.A N ASN 154.A O no hydrogen 2.953 N/A LEU 159.A N LEU 155.A O no hydrogen 2.866 N/A LEU 160.A N LEU 156.A O no hydrogen 2.902 N/A ILE 161.A N ASP 157.A O no hydrogen 2.940 N/A HIS 162.A N LEU 158.A O no hydrogen 3.154 N/A HIS 162.A ND1 LEU 158.A O no hydrogen 2.810 N/A HIS 162.A NE2 TYR 118.A OH no hydrogen 2.675 N/A GLU 163.A N LEU 159.A O no hydrogen 2.917 N/A VAL 164.A N LEU 160.A O no hydrogen 3.233 N/A LEU 165.A N ILE 161.A O no hydrogen 3.057 N/A ALA 166.A N HIS 162.A O no hydrogen 2.809 N/A CYS 169.A N ALA 166.A O no hydrogen 2.985 N/A CYS 169.A SG HIS 162.A O no hydrogen 3.422 N/A CYS 169.A SG ALA 166.A O no hydrogen 3.347 N/A ASP 171.A N GLY 168.A O no hydrogen 2.945 N/A PHE 173.A N LEU 170.A O no hydrogen 2.881 N/A LEU 175.A N GLU 130.A OE2 no hydrogen 2.935 N/A LEU 176.A N GLU 130.A OE1 no hydrogen 2.755 N/A SER 177.A N PHE 173.A O no hydrogen 2.942 N/A SER 177.A OG.B LEU 170.A O no hydrogen 2.739 N/A SER 177.A OG.B PHE 173.A O no hydrogen 3.128 N/A ALA 178.A N PRO 174.A O no hydrogen 3.029 N/A TYR 179.A N LEU 175.A O no hydrogen 2.856 N/A TYR 179.A OH ASP 152.A OD1 no hydrogen 2.668 N/A VAL 180.A N LEU 176.A O no hydrogen 2.934 N/A GLY 181.A N SER 177.A O no hydrogen 3.221 N/A ARG 182.A N ALA 178.A O no hydrogen 2.840 N/A ARG 182.A NH2 GLY 139.A O no hydrogen 3.005 N/A ARG 182.A NH2 THR 141.A O no hydrogen 2.923 N/A LEU 183.A N TYR 179.A O no hydrogen 2.929 N/A SER 184.A N VAL 180.A O no hydrogen 2.971 N/A SER 184.A OG VAL 180.A O no hydrogen 2.762 N/A ALA 185.A N GLY 181.A O no hydrogen 3.206 N/A ALA 185.A N ARG 182.A O no hydrogen 3.135 N/A ARG 186.A N LEU 183.A O no hydrogen 3.162 N/A ARG 186.A NE ASP 23.A OD2 no hydrogen 2.721 N/A ARG 186.A NH2 ASP 23.A OD2 no hydrogen 3.149 N/A LYS 190.A N ARG 186.A O no hydrogen 2.727 N/A ALA 191.A N PRO 187.A O no hydrogen 3.039 N/A PHE 192.A N LYS 188.A O no hydrogen 3.011 N/A LEU 193.A N LEU 189.A O no hydrogen 2.847 N/A ALA 194.A N LYS 190.A O no hydrogen 3.155 N/A ALA 194.A N ALA 191.A O no hydrogen 3.299 N/A SER 195.A N PHE 192.A O no hydrogen 2.972 N/A SER 195.A OG PHE 192.A O no hydrogen 2.736 N/A TYR 198.A N SER 195.A O no hydrogen 3.036 N/A VAL 199.A N SER 195.A O no hydrogen 2.868 N/A ASN 200.A N PRO 196.A O no hydrogen 2.929 N/A LEU 201.A N TYR 198.A O no hydrogen 3.201 N/A ASN 204.A ND2 TYR 103.A OH no hydrogen 2.982 N/A ASN 204.A ND2 LYS 208.A O no hydrogen 2.897 N/A GLY 205.A N TYR 108.A OH no hydrogen 2.763 N/A ASN 206.A ND2 ILE 107.A O no hydrogen 2.905 N/A LYS 208.A N ASN 206.A OD1 no hydrogen 3.109 N/A