Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3tql_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 4.A N VAL 38.A O no hydrogen 2.968 N/A LYS 5.A N ASP 59.A OD2 no hydrogen 2.824 N/A LYS 5.A NZ LYS 57.A O no hydrogen 2.881 N/A PHE 6.A N THR 40.A O no hydrogen 2.913 N/A ALA 7.A N ALA 60.A O no hydrogen 2.936 N/A THR 8.A N SER 42.A O.A no hydrogen 2.967 N/A THR 8.A N SER 42.A O.B no hydrogen 2.969 N/A THR 8.A OG1 PHE 62.A O no hydrogen 2.669 N/A ALA 10.A N ASN 43.A OD1 no hydrogen 2.849 N/A THR 11.A N GLU 9.A O no hydrogen 2.919 N/A THR 11.A OG1 GLU 9.A O no hydrogen 3.371 N/A THR 11.A OG1 GLU 9.A OE1 no hydrogen 2.583 N/A TYR 12.A N VAL 16.A O.A no hydrogen 2.813 N/A TYR 12.A N VAL 16.A O.B no hydrogen 2.697 N/A TYR 12.A OH SER 84.A OG no hydrogen 2.522 N/A TYR 12.A OH SER 86.A OG no hydrogen 2.623 N/A TYR 15.A OH THR 82.A O no hydrogen 3.111 N/A VAL 16.A N.A TYR 12.A O no hydrogen 3.013 N/A VAL 16.A N.B TYR 12.A O no hydrogen 3.009 N/A TYR 17.A N GLU 22.A O no hydrogen 2.915 N/A GLU 22.A N TYR 17.A O no hydrogen 2.789 N/A PHE 24.A N PRO 14.A O no hydrogen 3.105 N/A GLY 25.A N TYR 15.A O no hydrogen 2.785 N/A ASP 27.A N GLY 23.A O no hydrogen 2.992 N/A ILE 28.A N PHE 24.A O no hydrogen 2.954 N/A VAL 29.A N GLY 25.A O no hydrogen 2.890 N/A LYS 30.A N ALA 26.A O no hydrogen 3.007 N/A ALA 31.A N ASP 27.A O no hydrogen 2.869 N/A VAL 32.A N.A ILE 28.A O no hydrogen 2.883 N/A VAL 32.A N.B ILE 28.A O no hydrogen 2.856 N/A CYS 33.A N.A VAL 29.A O no hydrogen 2.978 N/A CYS 33.A N.B VAL 29.A O no hydrogen 2.857 N/A CYS 33.A SG.A VAL 29.A O no hydrogen 3.343 N/A CYS 33.A SG.B ALA 37.A O no hydrogen 2.524 N/A LYS 34.A N LYS 30.A O no hydrogen 2.958 N/A GLN 35.A N ALA 31.A O no hydrogen 2.988 N/A ALA 37.A N CYS 33.A O.A no hydrogen 2.845 N/A ALA 37.A N CYS 33.A O.B no hydrogen 2.877 N/A VAL 38.A N ASP 2.A O no hydrogen 2.479 N/A SER 42.A N.A PHE 6.A O no hydrogen 2.838 N/A SER 42.A N.B PHE 6.A O no hydrogen 2.831 N/A GLN 44.A N THR 8.A O no hydrogen 2.861 N/A TRP 46.A N GLU 9.A OE2 no hydrogen 2.845 N/A SER 48.A N PRO 45.A O no hydrogen 2.895 N/A SER 48.A OG PRO 45.A O no hydrogen 2.692 N/A LEU 49.A N TRP 46.A O no hydrogen 3.215 N/A SER 52.A N SER 48.A O no hydrogen 2.941 N/A SER 52.A OG SER 48.A O no hydrogen 3.142 N/A LEU 53.A N LEU 49.A O no hydrogen 2.875 N/A LYS 54.A N ILE 50.A O no hydrogen 2.919 N/A LYS 54.A NZ GLU 73.A OE1 no hydrogen 2.926 N/A LEU 55.A N PRO 51.A O no hydrogen 2.956 N/A GLY 56.A N LEU 53.A O no hydrogen 3.081 N/A LYS 57.A N SER 52.A O no hydrogen 2.937 N/A ASP 59.A N LYS 5.A O no hydrogen 2.816 N/A ALA 60.A N LYS 5.A O no hydrogen 3.161 N/A LEU 61.A N ALA 188.A O no hydrogen 2.795 N/A PHE 62.A N ALA 7.A O no hydrogen 3.219 N/A ASN 65.A ND2 SER 84.A O no hydrogen 2.972 N/A ILE 66.A N GLY 184.A O no hydrogen 2.830 N/A ARG 70.A N THR 67.A OG1 no hydrogen 3.136 N/A ARG 70.A NH1 ASN 65.A O no hydrogen 2.904 N/A GLN 71.A N THR 67.A O no hydrogen 2.989 N/A LYS 72.A N ALA 69.A O no hydrogen 3.180 N/A GLU 73.A N ARG 70.A O no hydrogen 2.882 N/A VAL 74.A N ARG 70.A O no hydrogen 3.076 N/A ASP 75.A N VAL 189.A O no hydrogen 3.017 N/A THR 77.A N ILE 187.A O no hydrogen 2.867 N/A THR 77.A OG1 ASP 78.A O no hydrogen 2.764 N/A ASP 78.A N ASN 201.A OD1 no hydrogen 2.816 N/A TYR 80.A N VAL 185.A O no hydrogen 2.982 N/A THR 82.A OG1 ASN 83.A OD1 no hydrogen 3.200 N/A THR 82.A OG1 VAL 175.A O no hydrogen 2.747 N/A ASN 83.A ND2 TYR 180.A O no hydrogen 3.482 N/A SER 84.A N ASN 65.A OD1 no hydrogen 2.866 N/A SER 84.A OG TYR 12.A OH no hydrogen 2.522 N/A VAL 85.A N LYS 173.A O no hydrogen 2.830 N/A SER 86.A OG TYR 12.A OH no hydrogen 2.623 N/A PHE 87.A N ILE 171.A O no hydrogen 2.831 N/A ILE 88.A N VAL 149.A O.A no hydrogen 2.801 N/A ILE 88.A N VAL 149.A O.B no hydrogen 2.890 N/A ALA 89.A N VAL 169.A O no hydrogen 2.967 N/A LYS 91.A N GLU 167.A O no hydrogen 2.892 N/A ASN 92.A N ASP 90.A OD1 no hydrogen 2.910 N/A THR 93.A N ASP 90.A O no hydrogen 3.462 N/A THR 93.A OG1 ASN 92.A OD1 no hydrogen 2.754 N/A SER 98.A N THR 96.A O no hydrogen 2.971 N/A LYS 99.A NZ PHE 123.A O no hydrogen 2.955 N/A LYS 99.A NZ SER 126.A OG no hydrogen 2.914 N/A GLY 101.A N SER 98.A OG no hydrogen 2.954 N/A LEU 102.A N SER 98.A O no hydrogen 2.890 N/A LYS 103.A N GLN 100.A O no hydrogen 3.224 N/A LYS 105.A N LEU 102.A O no hydrogen 2.861 N/A ILE 106.A N ASP 147.A OD2 no hydrogen 2.862 N/A ILE 107.A N THR 128.A O no hydrogen 2.885 N/A GLY 108.A N ALA 148.A O no hydrogen 2.830 N/A VAL 109.A N GLN 130.A O no hydrogen 3.004 N/A GLN 110.A NE2 PRO 133.A O no hydrogen 3.021 N/A GLY 111.A N TYR 132.A O no hydrogen 2.956 N/A GLY 112.A N ASP 116.A OD2 no hydrogen 2.910 N/A THR 113.A OG1 GLN 110.A O no hydrogen 2.789 N/A ASP 116.A N THR 113.A OG1 no hydrogen 3.258 N/A SER 117.A N THR 113.A O no hydrogen 3.117 N/A TYR 118.A N THR 114.A O no hydrogen 2.875 N/A LEU 119.A N PHE 115.A O no hydrogen 2.986 N/A GLN 120.A N ASP 116.A O no hydrogen 3.036 N/A GLN 120.A NE2 ASP 116.A O no hydrogen 3.561 N/A GLN 120.A NE2 ASP 116.A OD1 no hydrogen 3.000 N/A ASP 121.A N SER 117.A O no hydrogen 2.960 N/A SER 122.A N.A TYR 118.A O no hydrogen 2.865 N/A SER 122.A N.B TYR 118.A O no hydrogen 2.870 N/A SER 122.A OG.A TYR 118.A O no hydrogen 3.369 N/A SER 122.A OG.B TYR 118.A O no hydrogen 2.976 N/A PHE 123.A N LEU 119.A O no hydrogen 2.946 N/A GLY 124.A N GLN 120.A O no hydrogen 2.952 N/A SER 126.A N PHE 123.A O no hydrogen 3.093 N/A SER 126.A OG PHE 123.A O no hydrogen 3.146 N/A THR 128.A N LYS 105.A O no hydrogen 3.193 N/A GLN 130.A N ILE 107.A O no hydrogen 2.901 N/A ARG 131.A NE ASP 116.A OD1 no hydrogen 3.198 N/A ARG 131.A NE ASP 116.A OD2 no hydrogen 2.887 N/A ARG 131.A NH2 ASP 116.A OD1 no hydrogen 3.168 N/A TYR 132.A N VAL 109.A O no hydrogen 2.954 N/A TYR 132.A OH ASP 140.A OD2 no hydrogen 2.613 N/A ASP 137.A N SER 134.A OG no hydrogen 3.180 N/A ALA 138.A N SER 134.A O no hydrogen 3.290 N/A LEU 139.A N GLU 135.A O no hydrogen 2.847 N/A LEU 141.A N ALA 138.A O no hydrogen 2.941 N/A THR 142.A N LEU 139.A O no hydrogen 2.883 N/A THR 142.A OG1 LEU 139.A O no hydrogen 2.898 N/A SER 143.A N ASP 140.A O no hydrogen 3.285 N/A SER 143.A OG ASP 140.A O no hydrogen 3.442 N/A GLY 144.A N LEU 141.A O no hydrogen 3.052 N/A ARG 145.A N ASP 140.A O no hydrogen 2.718 N/A ARG 145.A NH1 SER 143.A OG no hydrogen 2.853 N/A ASP 147.A N ILE 106.A O no hydrogen 2.826 N/A ALA 148.A N ILE 106.A O no hydrogen 3.425 N/A VAL 149.A N.A ILE 88.A O no hydrogen 2.925 N/A VAL 149.A N.B ILE 88.A O no hydrogen 2.955 N/A VAL 150.A N.A GLY 108.A O no hydrogen 3.047 N/A VAL 150.A N.B GLY 108.A O no hydrogen 3.079 N/A ASP 152.A N GLU 135.A OE2 no hydrogen 2.883 N/A LEU 155.A N ASP 152.A OD2 no hydrogen 3.204 N/A ILE 156.A N.A ASP 152.A O no hydrogen 2.949 N/A ILE 156.A N.B ASP 152.A O no hydrogen 2.963 N/A LYS 157.A N THR 153.A O no hydrogen 2.831 N/A GLN 158.A N PRO 154.A O no hydrogen 3.037 N/A TRP 159.A N LEU 155.A O no hydrogen 2.948 N/A TRP 159.A NE1 GLU 136.A OE2 no hydrogen 3.120 N/A LEU 160.A N ILE 156.A O.A no hydrogen 2.877 N/A LEU 160.A N ILE 156.A O.B no hydrogen 2.894 N/A LYS 161.A N LYS 157.A O no hydrogen 2.937 N/A LYS 161.A NZ ASP 47.A OD2 no hydrogen 2.791 N/A GLN 162.A N GLN 158.A O no hydrogen 2.891 N/A ASN 163.A N TRP 159.A O no hydrogen 3.024 N/A ASN 163.A ND2 TRP 159.A O no hydrogen 2.946 N/A GLY 164.A N LYS 161.A O no hydrogen 3.045 N/A ARG 165.A N LEU 160.A O no hydrogen 2.899 N/A ARG 165.A NH2 THR 142.A O no hydrogen 3.238 N/A ARG 165.A NH2 GLU 167.A OE1 no hydrogen 3.195 N/A ARG 165.A NH2 GLU 167.A OE2 no hydrogen 3.568 N/A VAL 169.A N ALA 89.A O no hydrogen 2.854 N/A ILE 171.A N PHE 87.A O no hydrogen 2.867 N/A GLY 172.A N PRO 13.A O no hydrogen 2.910 N/A LYS 173.A N VAL 85.A O no hydrogen 3.023 N/A LYS 173.A NZ TYR 118.A OH no hydrogen 2.859 N/A VAL 175.A N ASN 83.A O no hydrogen 2.909 N/A ASN 179.A N ASP 177.A OD1 no hydrogen 3.019 N/A TYR 180.A N ASP 177.A O no hydrogen 2.851 N/A TYR 180.A OH ASP 121.A OD2 no hydrogen 2.704 N/A PHE 181.A N PRO 178.A O no hydrogen 3.386 N/A GLY 182.A N ASN 83.A OD1 no hydrogen 2.851 N/A VAL 185.A N TYR 81.A O no hydrogen 2.968 N/A ILE 187.A N THR 77.A OG1 no hydrogen 3.074 N/A ALA 188.A N LEU 61.A O no hydrogen 2.853 N/A VAL 189.A N ASP 75.A O no hydrogen 2.802 N/A LYS 190.A NZ LYS 54.A O no hydrogen 2.848 N/A GLY 192.A N ASP 75.A OD2 no hydrogen 2.895 N/A ASN 193.A N LYS 190.A O no hydrogen 2.891 N/A GLN 194.A N GLY 192.A O no hydrogen 2.756 N/A LEU 196.A N ASN 193.A OD1 no hydrogen 3.215 N/A LEU 197.A N ASN 193.A O no hydrogen 3.183 N/A LEU 198.A N GLN 194.A O no hydrogen 2.983 N/A LYS 199.A N ALA 195.A O no hydrogen 3.192 N/A LEU 200.A N LEU 196.A O no hydrogen 2.852 N/A ASN 201.A N LEU 197.A O no hydrogen 2.913 N/A LYS 202.A N LEU 198.A O no hydrogen 2.951 N/A ALA 203.A N LYS 199.A O no hydrogen 2.990 N/A LEU 204.A N LEU 200.A O no hydrogen 2.856 N/A ALA 205.A N ASN 201.A O no hydrogen 3.022 N/A ALA 206.A N LYS 202.A O no hydrogen 2.970 N/A ILE 207.A N ALA 203.A O no hydrogen 3.050 N/A LYS 208.A N LEU 204.A O no hydrogen 3.147 N/A LYS 208.A NZ PRO 79.A O no hydrogen 3.335 N/A ALA 209.A N ALA 205.A O no hydrogen 3.002 N/A ASN 210.A N ALA 206.A O no hydrogen 3.036 N/A ASN 210.A ND2 GLN 35.A OE1 no hydrogen 3.295 N/A VAL 212.A N ASN 210.A OD1 no hydrogen 2.982 N/A TYR 213.A N ILE 207.A O no hydrogen 2.857 N/A TYR 213.A OH TYR 80.A O no hydrogen 2.565 N/A ALA 215.A N GLY 211.A O no hydrogen 3.175 N/A ILE 216.A N VAL 212.A O no hydrogen 3.205 N/A VAL 217.A N TYR 213.A O no hydrogen 2.929 N/A GLN 218.A N ALA 214.A O no hydrogen 2.965 N/A GLN 218.A NE2 GLN 218.A O no hydrogen 2.945 N/A LYS 219.A N.A ALA 215.A O no hydrogen 3.163 N/A LYS 219.A N.A ILE 216.A O no hydrogen 3.173 N/A LYS 219.A N.B ALA 215.A O no hydrogen 3.184 N/A LYS 219.A N.B ILE 216.A O no hydrogen 3.184 N/A LYS 219.A NZ.A ASP 27.A OD2 no hydrogen 2.935 N/A LYS 219.A NZ.B ASP 27.A OD2 no hydrogen 2.994 N/A TYR 220.A N VAL 217.A O no hydrogen 3.235 N/A TYR 220.A OH ASP 27.A OD2 no hydrogen 2.772 N/A PHE 221.A N VAL 217.A O no hydrogen 2.826 N/A