Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3oql_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 5.A NE GLY 7.A O no hydrogen 2.789 N/A ARG 5.A NH1 GLU 195.A OE2 no hydrogen 2.769 N/A THR 6.A OG1 GLU 4.A O no hydrogen 3.457 N/A SER 13.A N GLU 10.A O no hydrogen 3.071 N/A SER 13.A OG PRO 8.A O no hydrogen 2.672 N/A SER 13.A OG GLU 10.A O no hydrogen 3.373 N/A TYR 14.A N ALA 11.A O no hydrogen 3.076 N/A TYR 14.A OH LEU 9.A O no hydrogen 2.694 N/A TRP 17.A NE1 GLY 202.A O no hydrogen 2.988 N/A ALA 18.A N PRO 15.A O no hydrogen 2.915 N/A GLN 19.A N PRO 15.A O no hydrogen 3.092 N/A GLN 19.A NE2 TYR 14.A O no hydrogen 2.853 N/A GLN 20.A N ALA 16.A O no hydrogen 2.969 N/A GLN 20.A NE2 ASP 24.A OD2 no hydrogen 3.460 N/A LEU 21.A N TRP 17.A O no hydrogen 2.924 N/A ILE 22.A N ALA 18.A O no hydrogen 2.926 N/A ASN 23.A N GLN 19.A O no hydrogen 3.067 N/A ASP 24.A N GLN 20.A O no hydrogen 2.867 N/A CYS 25.A N LEU 21.A O no hydrogen 2.992 N/A CYS 25.A SG LEU 21.A O no hydrogen 3.313 N/A CYS 25.A SG ARG 214.A O no hydrogen 3.887 N/A CYS 25.A SG THR 218.A OG1 no hydrogen 3.590 N/A SER 26.A N ASN 23.A O no hydrogen 3.371 N/A SER 26.A OG ASN 23.A O no hydrogen 2.936 N/A LYS 29.A N CYS 25.A O no hydrogen 3.098 N/A LYS 29.A NZ GLU 155.A OE2 no hydrogen 2.765 N/A ALA 30.A N SER 26.A O no hydrogen 2.909 N/A ARG 31.A N PRO 27.A O no hydrogen 3.112 N/A ARG 31.A NH2 ASP 222.A OD1 no hydrogen 2.700 N/A VAL 32.A N LYS 29.A O no hydrogen 3.157 N/A VAL 33.A N LYS 29.A O no hydrogen 3.050 N/A GLU 34.A N ALA 30.A O no hydrogen 2.782 N/A HIS 35.A N VAL 32.A O no hydrogen 3.207 N/A HIS 35.A NE2 GLU 228.A OE2 no hydrogen 2.763 N/A LEU 37.A N HIS 35.A ND1 no hydrogen 3.037 N/A TYR 38.A OH TYR 52.A OH no hydrogen 2.655 N/A GLN 39.A N HIS 35.A O no hydrogen 3.358 N/A GLN 39.A NE2 GLU 34.A O no hydrogen 3.275 N/A GLN 40.A N GLU 36.A O no hydrogen 2.897 N/A GLN 40.A NE2 LYS 44.A O no hydrogen 3.549 N/A ARG 41.A NE ASP 42.A OD1 no hydrogen 3.031 N/A ARG 41.A NE ASP 42.A OD2 no hydrogen 3.413 N/A ARG 41.A NH1 GLN 39.A OE1 no hydrogen 3.488 N/A ARG 41.A NH2 ASP 42.A OD2 no hydrogen 2.887 N/A ASP 42.A N GLN 39.A O no hydrogen 3.273 N/A LYS 44.A N GLN 40.A O no hydrogen 2.796 N/A GLN 48.A N SER 46.A OG no hydrogen 3.166 N/A ARG 50.A NH1 ASP 108.A O no hydrogen 3.157 N/A ARG 50.A NH2 ASP 113.A OD2 no hydrogen 3.368 N/A GLN 51.A N GLN 48.A O no hydrogen 3.382 N/A TYR 52.A N ILE 49.A O no hydrogen 2.893 N/A TYR 52.A OH TYR 38.A OH no hydrogen 2.655 N/A ILE 54.A N ARG 50.A O no hydrogen 2.954 N/A GLY 55.A N GLN 51.A O no hydrogen 2.794 N/A GLY 56.A N TYR 52.A O no hydrogen 2.834 N/A TRP 57.A N ILE 54.A O no hydrogen 3.176 N/A VAL 60.A N GLY 56.A O no hydrogen 3.472 N/A GLU 61.A N TRP 57.A O no hydrogen 2.719 N/A GLN 62.A N PRO 58.A O no hydrogen 3.081 N/A TYR 66.A N GLN 62.A O no hydrogen 2.971 N/A TYR 66.A OH SER 127.A O no hydrogen 3.343 N/A LYS 68.A N VAL 65.A O no hydrogen 2.861 N/A LYS 68.A NZ SER 135.A OG no hydrogen 3.188 N/A ASN 69.A N TYR 66.A O no hydrogen 3.138 N/A THR 71.A N ALA 67.A O no hydrogen 3.247 N/A THR 71.A OG1 LYS 68.A O no hydrogen 2.468 N/A LYS 72.A N ASN 69.A O no hydrogen 2.998 N/A LYS 72.A NZ ASN 69.A OD1 no hydrogen 2.992 N/A LYS 72.A NZ THR 133.A O no hydrogen 3.390 N/A LYS 72.A NZ SER 134.A O no hydrogen 2.836 N/A LYS 72.A NZ ASP 137.A O no hydrogen 2.961 N/A THR 73.A N LEU 70.A O no hydrogen 3.102 N/A THR 73.A OG1 LEU 70.A O no hydrogen 2.610 N/A ARG 74.A N GLU 81.A OE2 no hydrogen 2.896 N/A GLY 76.A N ASP 82.A OD1 no hydrogen 2.872 N/A ARG 77.A NE GLU 81.A OE1 no hydrogen 3.273 N/A ARG 77.A NE GLU 81.A OE2 no hydrogen 2.790 N/A ARG 77.A NH2 GLU 81.A OE2 no hydrogen 2.789 N/A GLY 80.A N HIS 78.A ND1 no hydrogen 2.934 N/A ASP 82.A N HIS 78.A O no hydrogen 3.069 N/A ARG 84.A N GLU 81.A O no hydrogen 2.844 N/A ARG 85.A N ASP 82.A O no hydrogen 3.222 N/A TRP 86.A NE1 GLU 192.A OE1 no hydrogen 2.876 N/A LEU 87.A N ALA 83.A O no hydrogen 2.872 N/A ASN 89.A N TRP 86.A O no hydrogen 2.880 N/A ASN 89.A ND2 TRP 86.A O no hydrogen 2.836 N/A ILE 90.A N LEU 87.A O no hydrogen 3.017 N/A ARG 91.A NH1 ARG 91.A O no hydrogen 3.264 N/A GLU 93.A N ASN 89.A O no hydrogen 3.397 N/A GLU 93.A N ILE 90.A O no hydrogen 3.284 N/A LEU 94.A N ARG 91.A O no hydrogen 3.175 N/A HIS 96.A N GLU 93.A O no hydrogen 3.093 N/A TYR 99.A N ASN 95.A O no hydrogen 2.973 N/A TRP 100.A N HIS 96.A O no hydrogen 3.037 N/A TRP 100.A NE1 LEU 53.A O no hydrogen 2.877 N/A VAL 101.A N ALA 97.A O no hydrogen 3.029 N/A ASN 102.A N ASP 98.A O no hydrogen 3.060 N/A TRP 103.A N TYR 99.A O no hydrogen 2.968 N/A TRP 103.A NE1 TYR 166.A OH no hydrogen 2.848 N/A CYS 104.A N TRP 100.A O no hydrogen 2.957 N/A CYS 104.A SG TRP 100.A O no hydrogen 3.196 N/A ALA 105.A N VAL 101.A O no hydrogen 2.998 N/A ALA 106.A N ASN 102.A O no hydrogen 3.387 N/A ALA 106.A N TRP 103.A O no hydrogen 3.177 N/A HIS 107.A N CYS 104.A O no hydrogen 3.014 N/A HIS 107.A NE2 TYR 166.A OH no hydrogen 2.704 N/A ASP 108.A N ALA 105.A O no hydrogen 3.152 N/A VAL 109.A N CYS 104.A O no hydrogen 2.846 N/A THR 110.A N ASP 113.A OD2 no hydrogen 2.901 N/A THR 110.A OG1 ASP 113.A OD2 no hydrogen 3.050 N/A ASP 113.A N THR 110.A OG1 no hydrogen 3.058 N/A LEU 114.A N THR 110.A O no hydrogen 3.268 N/A HIS 115.A N LEU 111.A O no hydrogen 2.926 N/A ASP 116.A N GLU 112.A O no hydrogen 2.884 N/A GLN 117.A N ASP 113.A O no hydrogen 3.137 N/A GLN 117.A NE2 ILE 54.A O no hydrogen 2.910 N/A GLN 117.A NE2 LEU 114.A O no hydrogen 2.796 N/A ARG 118.A NH2.B ASP 116.A O no hydrogen 3.465 N/A GLU 122.A N GLU 122.A OE1 no hydrogen 2.612 N/A LEU 123.A N ALA 120.A O no hydrogen 3.039 N/A HIS 124.A N PRO 121.A O no hydrogen 2.906 N/A HIS 124.A NE2 GLN 117.A OE1 no hydrogen 2.633 N/A ALA 125.A N GLU 122.A O no hydrogen 3.339 N/A SER 127.A OG HIS 124.A O no hydrogen 2.730 N/A HIS 128.A N HIS 124.A O no hydrogen 3.207 N/A TRP 129.A N ALA 125.A O no hydrogen 2.979 N/A TRP 129.A NE1 SER 220.A OG no hydrogen 2.822 N/A CYS 130.A N LEU 126.A O no hydrogen 2.823 N/A CYS 130.A SG LEU 126.A O no hydrogen 3.214 N/A TRP 131.A N SER 127.A O no hydrogen 2.932 N/A GLN 132.A N HIS 128.A O no hydrogen 3.027 N/A THR 133.A N TRP 129.A O no hydrogen 2.928 N/A THR 133.A OG1 ASP 137.A OD2 no hydrogen 2.716 N/A SER 134.A N CYS 130.A O no hydrogen 2.974 N/A SER 134.A OG CYS 130.A O no hydrogen 3.111 N/A SER 134.A OG TRP 131.A O no hydrogen 3.434 N/A SER 135.A N TRP 131.A O no hydrogen 2.885 N/A SER 135.A OG TRP 131.A O no hydrogen 2.789 N/A SER 136.A N GLN 132.A O no hydrogen 2.858 N/A SER 136.A OG GLN 132.A O no hydrogen 2.863 N/A ASP 137.A N THR 133.A O no hydrogen 2.974 N/A ALA 142.A N SER 138.A O no hydrogen 2.890 N/A ALA 144.A N VAL 141.A O no hydrogen 3.136 N/A ALA 144.A N ALA 142.A O no hydrogen 3.135 N/A THR 145.A N ALA 142.A O no hydrogen 3.027 N/A THR 145.A OG1 ALA 142.A O no hydrogen 3.037 N/A THR 145.A OG1 ASN 146.A OD1 no hydrogen 3.308 N/A ASN 146.A N THR 145.A OG1 no hydrogen 2.746 N/A ASN 146.A ND2 HIS 189.A NE2 no hydrogen 3.562 N/A ALA 148.A N ALA 143.A O no hydrogen 3.044 N/A ILE 149.A N THR 145.A O no hydrogen 2.941 N/A GLU 150.A N THR 145.A O no hydrogen 3.415 N/A GLY 151.A N TYR 147.A O no hydrogen 3.096 N/A ALA 152.A N ALA 148.A O no hydrogen 3.047 N/A THR 153.A N ILE 149.A O no hydrogen 2.887 N/A THR 153.A OG1 ILE 149.A O no hydrogen 2.672 N/A GLY 154.A N GLU 150.A O no hydrogen 3.094 N/A GLU 155.A N GLY 151.A O no hydrogen 3.390 N/A TRP 156.A N ALA 152.A O no hydrogen 2.932 N/A SER 157.A N THR 153.A O no hydrogen 2.956 N/A SER 157.A OG THR 153.A O no hydrogen 2.669 N/A SER 157.A OG GLY 154.A O no hydrogen 3.158 N/A ALA 158.A N GLY 154.A O no hydrogen 3.240 N/A VAL 159.A N GLU 155.A O no hydrogen 3.215 N/A VAL 160.A N TRP 156.A O no hydrogen 3.004 N/A CYS 161.A N SER 157.A O no hydrogen 3.110 N/A CYS 161.A N ALA 158.A O no hydrogen 3.236 N/A CYS 161.A SG SER 157.A O no hydrogen 3.452 N/A SER 162.A N VAL 159.A O no hydrogen 3.284 N/A SER 162.A OG VAL 159.A O no hydrogen 2.630 N/A VAL 165.A N THR 163.A OG1 no hydrogen 3.381 N/A TYR 166.A OH HIS 107.A NE2 no hydrogen 2.704 N/A GLU 168.A N GLY 164.A O no hydrogen 3.053 N/A ALA 169.A N VAL 165.A O no hydrogen 3.222 N/A ALA 169.A N TYR 166.A O no hydrogen 3.272 N/A PHE 170.A N ALA 167.A O no hydrogen 3.055 N/A THR 174.A N ALA 171.A O no hydrogen 3.171 N/A THR 174.A OG1 ALA 171.A O no hydrogen 3.521 N/A ARG 175.A N GLU 172.A O no hydrogen 3.402 N/A ARG 175.A NH1 ALA 167.A O no hydrogen 3.231 N/A SER 178.A N THR 174.A O no hydrogen 3.111 N/A SER 178.A OG THR 174.A O no hydrogen 2.998 N/A HIS 183.A ND1 TRP 180.A O no hydrogen 2.889 N/A ALA 184.A N LEU 181.A O no hydrogen 2.753 N/A GLN 185.A N LYS 182.A O no hydrogen 2.969 N/A GLU 192.A N ALA 188.A O no hydrogen 3.079 N/A ALA 193.A N HIS 189.A O no hydrogen 3.103 N/A LEU 194.A N PRO 190.A O no hydrogen 2.779 N/A GLU 195.A N TRP 191.A O no hydrogen 2.758 N/A ILE 196.A N GLU 192.A O no hydrogen 2.867 N/A ILE 197.A N ALA 193.A O no hydrogen 2.943 N/A CYS 198.A N LEU 194.A O no hydrogen 2.926 N/A CYS 198.A SG LEU 194.A O no hydrogen 3.200 N/A THR 199.A N GLU 195.A O no hydrogen 2.960 N/A THR 199.A OG1 GLU 195.A O no hydrogen 2.629 N/A LEU 200.A N ILE 196.A O no hydrogen 2.954 N/A VAL 201.A N ILE 197.A O no hydrogen 3.110 N/A GLY 202.A N CYS 198.A O no hydrogen 2.889 N/A ASN 203.A N ASP 1.A O no hydrogen 2.909 N/A LEU 209.A N SER 206.A OG no hydrogen 3.176 N/A GLN 210.A N SER 206.A O no hydrogen 3.007 N/A GLN 210.A NE2 PRO 205.A O no hydrogen 3.064 N/A GLN 210.A NE2 SER 206.A O no hydrogen 3.685 N/A ALA 211.A N LEU 207.A O no hydrogen 2.945 N/A GLU 212.A N GLN 208.A O no hydrogen 3.044 N/A LEU 213.A N LEU 209.A O no hydrogen 2.939 N/A ARG 214.A N GLN 210.A O no hydrogen 2.933 N/A GLN 215.A N ALA 211.A O no hydrogen 2.836 N/A ALA 216.A N GLU 212.A O no hydrogen 2.865 N/A VAL 217.A N LEU 213.A O no hydrogen 3.147 N/A THR 218.A N ARG 214.A O no hydrogen 2.960 N/A THR 218.A OG1 ARG 214.A O no hydrogen 2.801 N/A LYS 219.A N GLN 215.A O no hydrogen 2.811 N/A SER 220.A N ALA 216.A O no hydrogen 3.205 N/A SER 220.A OG ALA 144.A O no hydrogen 2.754 N/A SER 220.A OG ALA 216.A O no hydrogen 3.267 N/A TYR 221.A N VAL 217.A O no hydrogen 3.200 N/A ASP 222.A N THR 218.A O no hydrogen 2.763 N/A TYR 223.A N LYS 219.A O no hydrogen 2.905 N/A LEU 225.A N ASP 222.A O no hydrogen 2.887 N/A PHE 226.A N TYR 223.A O no hydrogen 2.982 N/A GLU 228.A N TYR 224.A O no hydrogen 2.872 N/A ARG 229.A N LEU 225.A O no hydrogen 2.931 N/A ARG 229.A NE GLU 122.A OE2 no hydrogen 2.957 N/A ARG 229.A NH1 ARG 229.A O no hydrogen 2.916 N/A CYS 230.A N PHE 226.A O no hydrogen 3.035 N/A CYS 230.A SG PHE 226.A O no hydrogen 3.449 N/A ILE 231.A N LEU 227.A O no hydrogen 3.062 N/A GLN 232.A N GLU 228.A O no hydrogen 3.147 N/A GLN 232.A N ARG 229.A O no hydrogen 3.252 N/A