Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3bgq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 4.A N PRO 1.A O no hydrogen 3.193 N/A GLN 5.A N PRO 1.A O no hydrogen 3.353 N/A GLN 5.A NE2 PRO 1.A O no hydrogen 3.619 N/A GLN 7.A N ILE 24.A O no hydrogen 2.983 N/A GLY 9.A N SER 22.A O no hydrogen 2.689 N/A LEU 12.A N VAL 20.A O no hydrogen 2.736 N/A GLY 13.A N VAL 20.A O no hydrogen 3.314 N/A GLY 15.A N GLY 18.A O no hydrogen 2.792 N/A GLY 18.A N GLY 15.A O no hydrogen 2.935 N/A SER 19.A N HIS 36.A O no hydrogen 3.098 N/A VAL 20.A N GLY 13.A O no hydrogen 2.809 N/A TYR 21.A N ILE 34.A O no hydrogen 2.700 N/A SER 22.A N PRO 10.A O no hydrogen 2.961 N/A GLY 23.A N VAL 32.A O no hydrogen 2.927 N/A ILE 24.A N GLN 7.A O no hydrogen 3.169 N/A ARG 25.A N LEU 30.A O no hydrogen 2.800 N/A ARG 25.A NH1 ASP 28.A OD1 no hydrogen 3.051 N/A VAL 26.A N GLN 5.A O no hydrogen 3.251 N/A ASN 29.A N ARG 25.A O no hydrogen 2.752 N/A VAL 32.A N GLY 23.A O no hydrogen 2.978 N/A ALA 33.A N LEU 88.A O no hydrogen 2.807 N/A ILE 34.A N TYR 21.A O no hydrogen 2.730 N/A LYS 35.A N LEU 86.A O no hydrogen 2.883 N/A LYS 35.A NZ GLU 57.A OE1 no hydrogen 2.659 N/A LYS 35.A NZ GLU 57.A OE2 no hydrogen 3.482 N/A LYS 35.A NZ ASP 154.A OD1 no hydrogen 3.027 N/A HIS 36.A N SER 19.A O no hydrogen 2.810 N/A VAL 37.A N PHE 84.A O no hydrogen 2.961 N/A LYS 39.A N ASP 82.A O no hydrogen 2.964 N/A LYS 39.A NZ GLU 79.A OE2 no hydrogen 3.040 N/A LYS 39.A NZ ARG 80.A O no hydrogen 3.031 N/A LYS 39.A NZ PRO 81.A O no hydrogen 2.996 N/A ARG 41.A N GLU 38.A O no hydrogen 3.026 N/A ARG 41.A NH1 GLU 38.A OE2 no hydrogen 2.546 N/A ARG 41.A NH2 GLU 38.A OE2 no hydrogen 2.737 N/A SER 43.A OG ASP 44.A OD2 no hydrogen 3.080 N/A GLY 46.A N VAL 54.A O no hydrogen 2.772 N/A LEU 48.A N THR 52.A O no hydrogen 3.398 N/A VAL 54.A N GLY 46.A O no hydrogen 2.976 N/A MET 56.A N ASP 44.A O no hydrogen 2.926 N/A VAL 58.A N PRO 55.A O no hydrogen 2.959 N/A LEU 60.A N MET 56.A O no hydrogen 2.819 N/A LEU 61.A N GLU 57.A O no hydrogen 2.796 N/A LYS 62.A N VAL 58.A O no hydrogen 3.093 N/A LYS 62.A N VAL 59.A O no hydrogen 3.200 N/A LYS 63.A N VAL 59.A O no hydrogen 3.049 N/A VAL 64.A N LEU 60.A O no hydrogen 3.267 N/A SER 69.A OG GLU 149.A OE1 no hydrogen 3.231 N/A ILE 72.A N LEU 152.A O no hydrogen 3.107 N/A ARG 73.A N GLU 89.A OE1 no hydrogen 2.976 N/A LEU 75.A N ILE 87.A O no hydrogen 2.793 N/A ASP 76.A N ILE 87.A O no hydrogen 3.295 N/A TRP 77.A N ASP 76.A OD2 no hydrogen 2.759 N/A PHE 78.A N VAL 85.A O no hydrogen 2.776 N/A ARG 80.A N SER 83.A O no hydrogen 2.587 N/A ARG 80.A NH2 GLU 3.A OE1 no hydrogen 3.285 N/A SER 83.A N ARG 80.A O no hydrogen 3.428 N/A PHE 84.A N VAL 37.A O no hydrogen 2.918 N/A VAL 85.A N PHE 78.A O no hydrogen 2.782 N/A LEU 86.A N LYS 35.A O no hydrogen 2.797 N/A ILE 87.A N ASP 76.A O no hydrogen 2.740 N/A LEU 88.A N ALA 33.A O no hydrogen 2.853 N/A GLU 89.A N ARG 73.A O no hydrogen 2.955 N/A ARG 90.A NE VAL 32.A O no hydrogen 2.744 N/A ARG 90.A NH2 GLY 23.A O no hydrogen 2.752 N/A GLN 95.A N ILE 143.A O no hydrogen 3.271 N/A LEU 97.A N ILE 141.A O no hydrogen 2.774 N/A ASP 99.A N ASP 96.A OD2 no hydrogen 2.882 N/A PHE 100.A N ASP 96.A O no hydrogen 3.083 N/A ILE 101.A N LEU 97.A O no hydrogen 2.868 N/A THR 102.A N PHE 98.A O no hydrogen 2.887 N/A THR 102.A OG1 PHE 98.A O no hydrogen 2.892 N/A GLU 103.A N ASP 99.A O no hydrogen 2.994 N/A ARG 104.A N PHE 100.A O no hydrogen 2.996 N/A ARG 104.A NH1 HIS 270.A O no hydrogen 2.790 N/A ARG 104.A NH2 HIS 270.A O no hydrogen 2.674 N/A GLY 105.A N ILE 101.A O no hydrogen 2.619 N/A LEU 107.A N MET 203.A O no hydrogen 2.866 N/A ALA 112.A N GLN 108.A O no hydrogen 2.973 N/A ARG 113.A N GLU 109.A O no hydrogen 2.778 N/A ARG 113.A NH1 TRP 256.A O no hydrogen 3.015 N/A SER 114.A N GLU 110.A O no hydrogen 3.292 N/A SER 114.A OG THR 266.A OG1 no hydrogen 2.693 N/A PHE 115.A N LEU 111.A O no hydrogen 2.973 N/A PHE 116.A N ALA 112.A O no hydrogen 2.783 N/A TRP 117.A N ARG 113.A O no hydrogen 2.880 N/A GLN 118.A N SER 114.A O no hydrogen 3.126 N/A GLN 118.A NE2 GLY 148.A O no hydrogen 3.015 N/A VAL 119.A N PHE 115.A O no hydrogen 2.958 N/A LEU 120.A N PHE 116.A O no hydrogen 2.910 N/A GLU 121.A N TRP 117.A O no hydrogen 3.008 N/A ALA 122.A N GLN 118.A O no hydrogen 3.084 N/A VAL 123.A N VAL 119.A O no hydrogen 2.908 N/A ARG 124.A N LEU 120.A O no hydrogen 2.884 N/A ARG 124.A NH1 GLN 252.A OE1 no hydrogen 2.892 N/A HIS 125.A N GLU 121.A O no hydrogen 3.059 N/A CYS 126.A N ALA 122.A O no hydrogen 3.082 N/A CYS 126.A SG ALA 122.A O no hydrogen 3.420 N/A HIS 127.A N VAL 123.A O no hydrogen 2.933 N/A ASN 128.A N ARG 124.A O no hydrogen 2.746 N/A CYS 129.A N HIS 125.A O no hydrogen 2.981 N/A CYS 129.A N CYS 126.A O no hydrogen 2.890 N/A CYS 129.A SG LYS 63.A O no hydrogen 3.901 N/A CYS 129.A SG HIS 125.A O no hydrogen 3.420 N/A GLY 130.A N HIS 127.A O no hydrogen 2.898 N/A VAL 131.A N CYS 126.A O no hydrogen 2.818 N/A LEU 132.A N ALA 159.A O no hydrogen 2.926 N/A HIS 133.A NE2 ILE 153.A O no hydrogen 2.909 N/A ARG 134.A NE SER 157.A O no hydrogen 2.824 N/A ARG 134.A NH1 ASP 168.A OD1 no hydrogen 3.407 N/A ARG 134.A NH1 ASP 168.A OD2 no hydrogen 3.090 N/A ARG 134.A NH1 TYR 186.A OH no hydrogen 3.051 N/A ARG 134.A NH2 GLY 158.A O no hydrogen 3.014 N/A ARG 134.A NH2 ASP 168.A OD2 no hydrogen 3.328 N/A ASP 135.A N HIS 133.A ND1 no hydrogen 2.919 N/A LYS 137.A NZ GLU 139.A OE1 no hydrogen 2.796 N/A LYS 137.A NZ THR 172.A OG1 no hydrogen 2.806 N/A ASN 140.A N LYS 137.A O no hydrogen 2.889 N/A ASN 140.A ND2 ASP 135.A O no hydrogen 2.870 N/A ASN 140.A ND2 ASP 135.A OD2 no hydrogen 2.924 N/A ILE 141.A N ASP 138.A O no hydrogen 3.195 N/A LEU 142.A N LYS 151.A O no hydrogen 2.799 N/A ILE 143.A N GLN 95.A O no hydrogen 2.896 N/A ASP 144.A N GLU 149.A O no hydrogen 2.814 N/A GLY 148.A N ASP 144.A O no hydrogen 2.659 N/A LEU 150.A N GLN 118.A OE1 no hydrogen 2.834 N/A LYS 151.A N LEU 142.A O no hydrogen 2.776 N/A LYS 151.A NZ SER 69.A O no hydrogen 2.907 N/A LYS 151.A NZ GLU 89.A OE2 no hydrogen 2.982 N/A LEU 152.A N GLY 70.A O no hydrogen 3.053 N/A ILE 153.A N ASN 140.A O no hydrogen 2.927 N/A PHE 155.A N GLU 57.A OE2 no hydrogen 2.821 N/A GLY 156.A N ASP 154.A OD1 no hydrogen 3.092 N/A SER 157.A OG ASP 170.A O no hydrogen 3.414 N/A GLY 158.A N PHE 155.A O no hydrogen 3.160 N/A ALA 159.A N LEU 132.A O no hydrogen 2.999 N/A LEU 161.A N GLY 130.A O no hydrogen 2.878 N/A LYS 162.A NZ VAL 165.A O no hydrogen 3.170 N/A TYR 166.A N TYR 186.A O no hydrogen 2.797 N/A TYR 166.A OH LEU 160.A O no hydrogen 2.837 N/A THR 172.A N ASP 135.A OD1 no hydrogen 3.078 N/A THR 172.A OG1 ASP 135.A OD1 no hydrogen 2.716 N/A ARG 173.A NE ASP 213.A OD1 no hydrogen 2.886 N/A ARG 173.A NE ASP 213.A OD2 no hydrogen 3.347 N/A ARG 173.A NH2 ASP 213.A OD2 no hydrogen 2.835 N/A TYR 175.A N THR 172.A O no hydrogen 2.915 N/A SER 176.A N ARG 173.A O no hydrogen 2.877 N/A SER 176.A OG ARG 173.A O no hydrogen 2.648 N/A GLU 179.A N GLU 179.A OE1 no hydrogen 2.642 N/A TRP 180.A N PRO 177.A O no hydrogen 3.077 N/A ILE 181.A N PRO 177.A O no hydrogen 3.181 N/A ARG 182.A N PRO 178.A O no hydrogen 2.851 N/A TYR 183.A N GLU 179.A O no hydrogen 2.913 N/A HIS 184.A N TRP 180.A O no hydrogen 2.911 N/A TYR 186.A N TYR 166.A O no hydrogen 3.219 N/A TYR 186.A OH ASP 168.A O no hydrogen 2.733 N/A ARG 189.A NH1 ASP 163.A OD2 no hydrogen 3.248 N/A ARG 189.A NH2 ASP 163.A OD2 no hydrogen 3.248 N/A SER 190.A OG HIS 187.A O no hydrogen 3.533 N/A ALA 191.A N HIS 187.A O no hydrogen 3.125 N/A ALA 192.A N GLY 188.A O no hydrogen 3.041 N/A VAL 193.A N ARG 189.A O no hydrogen 2.982 N/A TRP 194.A N SER 190.A O no hydrogen 3.208 N/A SER 195.A N ALA 191.A O no hydrogen 3.198 N/A SER 195.A OG ALA 192.A O no hydrogen 2.645 N/A LEU 196.A N ALA 192.A O no hydrogen 2.944 N/A GLY 197.A N VAL 193.A O no hydrogen 2.961 N/A ILE 198.A N TRP 194.A O no hydrogen 2.979 N/A LEU 199.A N SER 195.A O no hydrogen 2.881 N/A LEU 200.A N LEU 196.A O no hydrogen 2.913 N/A TYR 201.A N GLY 197.A O no hydrogen 3.104 N/A TYR 201.A OH PHE 222.A O no hydrogen 2.731 N/A ASP 202.A N ILE 198.A O no hydrogen 2.922 N/A MET 203.A N LEU 199.A O no hydrogen 2.932 N/A VAL 204.A N LEU 200.A O no hydrogen 3.142 N/A CYS 205.A N TYR 201.A O no hydrogen 2.854 N/A GLY 206.A N ASP 202.A O no hydrogen 2.789 N/A ILE 208.A N ASP 207.A OD1 no hydrogen 2.696 N/A GLU 211.A N GLU 215.A OE1 no hydrogen 2.696 N/A HIS 212.A N GLU 215.A OE1 no hydrogen 2.770 N/A GLU 215.A N HIS 212.A O no hydrogen 2.871 N/A ILE 216.A N HIS 212.A O no hydrogen 3.143 N/A ILE 217.A N ASP 213.A O no hydrogen 3.070 N/A ARG 218.A N GLU 214.A O no hydrogen 3.121 N/A GLY 219.A N GLU 215.A O no hydrogen 2.894 N/A ARG 224.A NE TYR 201.A OH no hydrogen 3.106 N/A SER 228.A N GLU 109.A OE1 no hydrogen 2.727 N/A SER 228.A OG GLU 109.A OE1 no hydrogen 3.301 N/A SER 228.A OG GLU 109.A OE2 no hydrogen 2.616 N/A CYS 230.A N SER 228.A OG no hydrogen 3.182 N/A GLN 231.A N SER 228.A O no hydrogen 2.843 N/A GLN 231.A NE2 VAL 227.A O no hydrogen 3.179 N/A HIS 232.A ND1 HIS 254.A NE2 no hydrogen 2.750 N/A LEU 233.A N GLU 229.A O no hydrogen 3.062 N/A ILE 234.A N CYS 230.A O no hydrogen 3.045 N/A ARG 235.A N GLN 231.A O no hydrogen 2.990 N/A ARG 235.A NH1 GLN 231.A OE1 no hydrogen 2.945 N/A ARG 235.A NH2 VAL 221.A O no hydrogen 2.841 N/A TRP 236.A N HIS 232.A O no hydrogen 2.966 N/A TRP 236.A NE1 ASP 244.A O no hydrogen 2.903 N/A CYS 237.A N LEU 233.A O no hydrogen 2.984 N/A CYS 237.A SG LEU 233.A O no hydrogen 3.471 N/A LEU 238.A N ILE 234.A O no hydrogen 3.015 N/A ALA 239.A N TRP 236.A O no hydrogen 3.117 N/A ARG 241.A NH1 ASP 244.A OD1 no hydrogen 2.877 N/A ASP 244.A N ARG 241.A O no hydrogen 2.859 N/A ARG 245.A N PRO 242.A O no hydrogen 3.137 N/A ARG 245.A NE ALA 239.A O no hydrogen 2.728 N/A ARG 245.A NH1 GLU 179.A OE2 no hydrogen 2.801 N/A ARG 245.A NH1 SER 190.A O no hydrogen 3.055 N/A ARG 245.A NH2 GLU 179.A OE1 no hydrogen 2.906 N/A ARG 245.A NH2 GLU 179.A OE2 no hydrogen 3.539 N/A ARG 245.A NH2 ALA 239.A O no hydrogen 3.159 N/A ARG 245.A NH2 LEU 240.A O no hydrogen 3.191 N/A THR 247.A N GLU 250.A OE1 no hydrogen 2.894 N/A THR 247.A OG1 GLU 250.A OE1 no hydrogen 3.450 N/A GLU 250.A N THR 247.A OG1 no hydrogen 3.126 N/A ILE 251.A N THR 247.A O no hydrogen 2.972 N/A GLN 252.A N PHE 248.A O no hydrogen 3.025 N/A GLN 252.A NE2 GLU 121.A OE1 no hydrogen 2.917 N/A ASN 253.A N GLU 249.A O no hydrogen 2.968 N/A HIS 254.A N ILE 251.A O no hydrogen 3.205 N/A HIS 254.A NE2 HIS 232.A ND1 no hydrogen 2.750 N/A TRP 256.A N HIS 254.A ND1 no hydrogen 2.946 N/A TRP 256.A NE1 GLU 109.A OE2 no hydrogen 2.795 N/A MET 257.A N HIS 254.A O no hydrogen 2.921 N/A GLN 258.A N PRO 255.A O no hydrogen 3.425 N/A LEU 262.A N GLU 265.A OE1 no hydrogen 2.861 N/A GLN 264.A NE2 GLU 268.A OE1 no hydrogen 3.375 N/A GLN 264.A NE2 HIS 272.A NE2 no hydrogen 3.396 N/A THR 266.A N LEU 262.A O no hydrogen 2.961 N/A THR 266.A OG1 SER 114.A OG no hydrogen 2.693 N/A THR 266.A OG1 LEU 262.A O no hydrogen 2.930 N/A ALA 267.A N PRO 263.A O no hydrogen 2.985 N/A GLU 268.A N GLN 264.A O no hydrogen 3.034 N/A ILE 269.A N GLU 265.A O no hydrogen 2.874 N/A HIS 270.A N THR 266.A O no hydrogen 2.866 N/A HIS 270.A NE2 GLU 110.A OE2 no hydrogen 2.699 N/A LEU 271.A N ALA 267.A O no hydrogen 2.783 N/A HIS 272.A N ALA 267.A O no hydrogen 2.636 N/A