Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3bq3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 5.A N SER 1.A O no hydrogen 2.948 N/A ALA 6.A N PRO 2.A O no hydrogen 3.038 N/A ILE 7.A N GLU 3.A O no hydrogen 3.089 N/A GLU 8.A N GLN 4.A O no hydrogen 3.033 N/A SER 9.A N GLU 5.A O no hydrogen 2.918 N/A SER 9.A OG GLU 5.A O no hydrogen 2.964 N/A PHE 10.A N ALA 6.A O no hydrogen 2.948 N/A THR 11.A N ILE 7.A O no hydrogen 2.968 N/A THR 11.A OG1 ILE 7.A O no hydrogen 2.787 N/A THR 11.A OG1 SER 21.A OG no hydrogen 2.730 N/A SER 12.A N GLU 8.A O no hydrogen 2.989 N/A SER 12.A OG GLU 8.A O no hydrogen 3.310 N/A LEU 13.A N SER 9.A O no hydrogen 2.939 N/A THR 14.A N PHE 10.A O no hydrogen 3.012 N/A THR 14.A OG1 PHE 10.A O no hydrogen 2.828 N/A CYS 16.A N THR 14.A OG1 no hydrogen 3.256 N/A CYS 16.A SG THR 14.A OG1 no hydrogen 3.027 N/A CYS 16.A SG ASP 17.A O no hydrogen 3.307 N/A CYS 16.A SG SER 21.A OG no hydrogen 2.805 N/A LYS 19.A N ASP 17.A OD1 no hydrogen 2.896 N/A SER 21.A N ASP 17.A O no hydrogen 2.981 N/A SER 21.A OG THR 11.A OG1 no hydrogen 2.730 N/A SER 21.A OG ASP 17.A O no hydrogen 3.354 N/A ARG 22.A N PRO 18.A O no hydrogen 2.993 N/A LYS 23.A N LYS 19.A O no hydrogen 3.074 N/A TYR 24.A N VAL 20.A O no hydrogen 3.045 N/A LEU 25.A N SER 21.A O no hydrogen 3.060 N/A GLN 26.A N ARG 22.A O no hydrogen 2.804 N/A ARG 27.A N LYS 23.A O no hydrogen 3.116 N/A ARG 27.A NE ASP 38.A OD2 no hydrogen 3.003 N/A ARG 27.A NH2 ASP 38.A OD1 no hydrogen 3.154 N/A ARG 27.A NH2 ASP 38.A OD2 no hydrogen 3.380 N/A ASN 28.A N LEU 25.A O no hydrogen 2.983 N/A ASN 28.A ND2 TYR 24.A O no hydrogen 2.835 N/A ASN 28.A ND2 ASP 38.A OD2 no hydrogen 2.703 N/A TRP 30.A N LEU 25.A O no hydrogen 2.777 N/A ASN 31.A N ASN 28.A O no hydrogen 3.073 N/A TYR 34.A N ASN 31.A OD1 no hydrogen 3.126 N/A ALA 35.A N ASN 31.A O no hydrogen 2.916 N/A LEU 36.A N ILE 32.A O no hydrogen 2.819 N/A ASN 37.A N ASN 33.A O no hydrogen 3.183 N/A ASP 38.A N TYR 34.A O no hydrogen 2.888 N/A TYR 39.A N ALA 35.A O no hydrogen 2.850 N/A TYR 40.A N LEU 36.A O no hydrogen 2.925 N/A ASP 41.A N ASN 37.A O no hydrogen 3.135 N/A LYS 42.A N ASP 38.A O no hydrogen 3.182 N/A GLU 43.A N TYR 39.A O no hydrogen 3.019 N/A ILE 44.A N TYR 40.A O no hydrogen 3.088 N/A TYR 52.A OH GLU 109.A OE2 no hydrogen 2.649 N/A THR 57.A N PRO 53.A O no hydrogen 3.323 N/A THR 57.A OG1 LYS 54.A O no hydrogen 3.309 N/A GLN 58.A N LYS 54.A O no hydrogen 3.098 N/A VAL 59.A N GLU 55.A O no hydrogen 3.207 N/A PHE 60.A N LEU 56.A O no hydrogen 3.399 N/A GLU 61.A N THR 57.A O no hydrogen 3.102 N/A HIS 62.A N GLN 58.A O no hydrogen 2.920 N/A TYR 63.A N PHE 60.A O no hydrogen 3.033 N/A ILE 64.A N PHE 60.A O no hydrogen 3.141 N/A ASN 65.A N LEU 68.A O no hydrogen 2.676 N/A LEU 68.A N ASN 65.A O no hydrogen 3.049 N/A ASP 70.A N SER 73.A OG no hydrogen 3.144 N/A SER 73.A N ASP 70.A OD1 no hydrogen 3.220 N/A SER 73.A OG TYR 63.A O no hydrogen 2.632 N/A SER 73.A OG ASN 65.A OD1 no hydrogen 3.417 N/A SER 73.A OG LEU 68.A O no hydrogen 3.344 N/A SER 73.A OG ASP 70.A OD1 no hydrogen 3.367 N/A LEU 74.A N ASP 70.A O no hydrogen 2.974 N/A VAL 75.A N ILE 71.A O no hydrogen 2.921 N/A LYS 76.A N ASP 72.A O no hydrogen 3.011 N/A PHE 77.A N SER 73.A O no hydrogen 2.782 N/A ILE 78.A N LEU 74.A O no hydrogen 2.813 N/A GLU 79.A N VAL 75.A O no hydrogen 2.966 N/A GLU 80.A N LYS 76.A O no hydrogen 3.136 N/A LEU 81.A N PHE 77.A O no hydrogen 3.026 N/A GLY 82.A N ILE 78.A O no hydrogen 2.935 N/A GLY 82.A N GLU 79.A O no hydrogen 3.049 N/A TYR 83.A N ILE 78.A O no hydrogen 3.020 N/A ASN 84.A N ASP 87.A OD2 no hydrogen 2.763 N/A ASN 84.A ND2 ASP 87.A OD1 no hydrogen 3.206 N/A ASP 87.A N ASN 84.A O no hydrogen 3.028 N/A THR 90.A N ASP 87.A O no hydrogen 3.118 N/A THR 90.A OG1 ASN 84.A O no hydrogen 2.812 N/A LEU 91.A N ASP 87.A O no hydrogen 3.422 N/A CYS 92.A N LEU 88.A O no hydrogen 3.262 N/A CYS 92.A SG LEU 88.A O no hydrogen 3.562 N/A CYS 92.A SG TYR 141.A OH no hydrogen 3.452 N/A LEU 93.A N ALA 89.A O no hydrogen 2.962 N/A ALA 94.A N THR 90.A O no hydrogen 2.816 N/A HIS 95.A N LEU 91.A O no hydrogen 2.841 N/A LEU 96.A N CYS 92.A O no hydrogen 2.873 N/A LEU 97.A N LEU 93.A O no hydrogen 2.859 N/A GLY 98.A N HIS 95.A O no hydrogen 3.135 N/A TYR 99.A N ALA 94.A O no hydrogen 3.102 N/A LYS 101.A NZ GLU 104.A OE2 no hydrogen 2.286 N/A GLU 103.A N GLU 103.A OE1 no hydrogen 2.770 N/A GLU 104.A N LYS 101.A O no hydrogen 3.083 N/A LEU 106.A N PHE 69.A O no hydrogen 2.694 N/A ARG 108.A NH1 GLU 61.A OE2 no hydrogen 3.103 N/A PHE 111.A N LYS 107.A O no hydrogen 3.136 N/A LEU 112.A N ARG 108.A O no hydrogen 3.088 N/A SER 113.A N GLU 109.A O no hydrogen 3.053 N/A SER 113.A OG GLU 109.A O no hydrogen 2.592 N/A SER 113.A OG ASP 110.A O no hydrogen 3.468 N/A THR 114.A N ASP 110.A O no hydrogen 3.251 N/A THR 114.A OG1 ASP 110.A O no hydrogen 2.611 N/A TRP 115.A N PHE 111.A O no hydrogen 3.311 N/A PHE 116.A N LEU 112.A O no hydrogen 2.915 N/A GLY 118.A N PHE 116.A O no hydrogen 3.017 N/A CYS 119.A N TRP 115.A O no hydrogen 2.921 N/A CYS 119.A SG GLN 117.A O no hydrogen 3.738 N/A SER 120.A N ASP 124.A OD2 no hydrogen 2.884 N/A SER 120.A OG GLU 55.A OE1 no hydrogen 3.282 N/A SER 120.A OG ASP 124.A OD2 no hydrogen 3.505 N/A THR 121.A N ASP 124.A OD2 no hydrogen 3.111 N/A ASP 124.A N THR 121.A OG1 no hydrogen 3.047 N/A GLN 125.A NE2 LEU 81.A O no hydrogen 3.071 N/A GLU 126.A N SER 123.A O no hydrogen 3.198 N/A CYS 127.A N ASP 124.A O no hydrogen 2.977 N/A LYS 129.A N GLN 125.A O no hydrogen 3.137 N/A THR 130.A N GLU 126.A O no hydrogen 3.037 N/A THR 130.A OG1 GLU 126.A O no hydrogen 3.034 N/A LEU 131.A N CYS 127.A O no hydrogen 2.994 N/A ASP 132.A N ILE 128.A O no hydrogen 2.906 N/A VAL 133.A N LYS 129.A O no hydrogen 3.057 N/A LYS 134.A N THR 130.A O no hydrogen 3.069 N/A LEU 135.A N LEU 131.A O no hydrogen 2.858 N/A HIS 136.A N ASP 132.A O no hydrogen 3.250 N/A HIS 136.A ND1 ASP 132.A O no hydrogen 2.564 N/A GLU 137.A N LYS 134.A O no hydrogen 3.193 N/A ASP 138.A N LYS 134.A O no hydrogen 2.893 N/A TYR 141.A N ASP 138.A OD1 no hydrogen 3.003 N/A PHE 142.A N ASP 138.A O no hydrogen 2.839 N/A THR 143.A N LEU 139.A O no hydrogen 2.797 N/A THR 143.A OG1 LEU 139.A O no hydrogen 2.866 N/A GLN 144.A N GLN 140.A O no hydrogen 3.196 N/A GLN 144.A NE2 GLN 140.A O no hydrogen 3.293 N/A ILE 145.A N TYR 141.A O no hydrogen 3.031 N/A TYR 146.A N PHE 142.A O no hydrogen 2.829 N/A TYR 146.A OH TRP 206.A O no hydrogen 2.646 N/A ASN 147.A N THR 143.A O no hydrogen 3.004 N/A TYR 148.A N GLN 144.A O no hydrogen 2.822 N/A TYR 148.A OH TYR 99.A O no hydrogen 2.800 N/A ALA 149.A N ILE 145.A O no hydrogen 2.870 N/A ALA 149.A N TYR 146.A O no hydrogen 3.267 N/A LEU 152.A N TYR 148.A O no hydrogen 2.960 N/A ILE 153.A N ALA 149.A O no hydrogen 2.885 N/A ARG 158.A NH1 ASP 162.A OD1 no hydrogen 2.887 N/A ARG 158.A NH2 ASP 162.A OD1 no hydrogen 2.759 N/A ILE 161.A N ILE 201.A O no hydrogen 2.932 N/A ASP 162.A N GLU 165.A OE1 no hydrogen 3.334 N/A THR 163.A N THR 199.A O no hydrogen 2.955 N/A THR 163.A OG1 LYS 198.A O no hydrogen 3.043 N/A GLU 165.A N ASP 162.A O no hydrogen 3.132 N/A GLY 166.A N ASP 162.A O no hydrogen 3.157 N/A ILE 167.A N THR 163.A O no hydrogen 2.837 N/A GLN 168.A N ASP 164.A O no hydrogen 2.975 N/A GLN 168.A NE2 GLU 86.A OE2 no hydrogen 3.079 N/A TYR 169.A N GLU 165.A O no hydrogen 3.120 N/A TRP 170.A N GLY 166.A O no hydrogen 2.808 N/A TRP 170.A NE1 TYR 146.A OH no hydrogen 2.799 N/A LYS 171.A N ILE 167.A O no hydrogen 3.062 N/A LEU 172.A N TYR 169.A O no hydrogen 2.952 N/A PHE 173.A N TYR 169.A O no hydrogen 2.851 N/A PHE 174.A N TRP 170.A O no hydrogen 2.941 N/A TYR 178.A N GLN 175.A O no hydrogen 3.012 N/A GLU 182.A N PRO 216.A O no hydrogen 2.785 N/A LEU 185.A N GLU 182.A O no hydrogen 3.049 N/A LEU 186.A N GLU 182.A O no hydrogen 3.269 N/A GLU 187.A N PRO 183.A O no hydrogen 2.988 N/A ALA 188.A N ASP 184.A O no hydrogen 2.987 N/A TRP 189.A N LEU 185.A O no hydrogen 2.833 N/A PHE 190.A N LEU 186.A O no hydrogen 3.124 N/A ARG 191.A N GLU 187.A O no hydrogen 2.973 N/A ARG 191.A NH1 GLU 187.A OE2 no hydrogen 3.163 N/A PHE 192.A N ALA 188.A O no hydrogen 2.945 N/A LEU 193.A N TRP 189.A O no hydrogen 3.015 N/A ARG 194.A N PHE 190.A O no hydrogen 3.098 N/A ASP 195.A N ARG 191.A O no hydrogen 2.855 N/A GLU 196.A N PHE 192.A O no hydrogen 2.868 N/A GLY 197.A N ARG 194.A O no hydrogen 3.007 N/A LYS 198.A N LEU 193.A O no hydrogen 3.002 N/A LYS 198.A NZ THR 200.A O no hydrogen 2.931 N/A ILE 201.A N ILE 161.A O no hydrogen 2.826 N/A SER 202.A OG THR 205.A OG1 no hydrogen 3.372 N/A THR 205.A N SER 202.A OG no hydrogen 3.211 N/A THR 205.A OG1 SER 202.A OG no hydrogen 3.372 N/A TRP 206.A N SER 202.A O no hydrogen 3.022 N/A TRP 206.A NE1 TYR 146.A O no hydrogen 2.925 N/A ARG 207.A N LYS 203.A O no hydrogen 2.970 N/A PHE 212.A N LEU 208.A O no hydrogen 2.999 N/A LYS 213.A N LEU 209.A O no hydrogen 3.187 N/A ARG 214.A N LEU 210.A O no hydrogen 3.049 N/A ARG 214.A NH1 ARG 214.A O no hydrogen 3.125 N/A TYR 215.A N PHE 211.A O no hydrogen 2.792 N/A ILE 218.A N GLU 182.A OE1 no hydrogen 2.950 N/A LYS 220.A N THR 217.A OG1 no hydrogen 3.019 N/A LYS 220.A NZ ARG 214.A O no hydrogen 2.847 N/A ILE 221.A N THR 217.A O no hydrogen 3.096 N/A ILE 222.A N ILE 218.A O no hydrogen 2.874 N/A SER 223.A N GLN 219.A O no hydrogen 2.925 N/A SER 223.A OG ASP 224.A OD1 no hydrogen 3.063 N/A ASP 224.A N LYS 220.A O no hydrogen 2.879 N/A TYR 225.A N ILE 221.A O no hydrogen 2.995 N/A TYR 225.A OH ASP 236.A OD1 no hydrogen 2.460 N/A THR 228.A N ASP 226.A OD1 no hydrogen 3.363 N/A THR 228.A OG1 ASP 226.A OD1 no hydrogen 2.693 N/A ALA 229.A N ASP 226.A O no hydrogen 3.220 N/A ILE 235.A N PRO 232.A O no hydrogen 3.053 N/A ASP 236.A N PRO 232.A O no hydrogen 3.226 N/A GLU 237.A N PHE 233.A O no hydrogen 2.870 N/A PHE 238.A N ILE 234.A O no hydrogen 3.015 N/A TYR 239.A N ILE 235.A O no hydrogen 2.952 N/A GLU 240.A N ASP 236.A O no hydrogen 3.158 N/A CYS 241.A N.A GLU 237.A O no hydrogen 2.977 N/A CYS 241.A N.B GLU 237.A O no hydrogen 2.954 N/A CYS 241.A SG.A GLU 237.A O no hydrogen 3.061 N/A CYS 241.A SG.A GLU 237.A OE2 no hydrogen 3.755 N/A LEU 242.A N PHE 238.A O no hydrogen 2.806 N/A GLN 243.A N TYR 239.A O no hydrogen 2.773 N/A ASP 244.A N GLU 240.A O no hydrogen 2.929 N/A GLN 245.A N CYS 241.A O.B no hydrogen 3.019 N/A GLN 245.A N LEU 242.A O no hydrogen 3.118 N/A