Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3bfx_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 3.A N LEU 10.A O no hydrogen 2.968 N/A LYS 3.A NZ ASP 16.A OD1 no hydrogen 2.765 N/A VAL 5.A N THR 8.A O no hydrogen 2.922 N/A THR 8.A N VAL 5.A O no hydrogen 2.929 N/A LEU 10.A N LYS 3.A O no hydrogen 2.892 N/A THR 14.A OG1 GLU 60.A O no hydrogen 2.711 N/A VAL 15.A N GLN 11.A O no hydrogen 3.259 N/A ASP 16.A N PRO 12.A O no hydrogen 2.912 N/A ASN 17.A N ALA 13.A O no hydrogen 3.051 N/A ASN 17.A N THR 14.A O no hydrogen 3.054 N/A ASN 17.A ND2 GLN 20.A OE1 no hydrogen 3.391 N/A TRP 18.A N VAL 15.A O no hydrogen 3.165 N/A ILE 21.A N ASN 17.A O no hydrogen 2.959 N/A GLN 22.A N TRP 18.A O no hydrogen 2.940 N/A GLN 22.A NE2 LEU 90.A O no hydrogen 2.859 N/A SER 23.A N SER 19.A O no hydrogen 3.107 N/A SER 23.A OG SER 19.A O no hydrogen 3.142 N/A SER 23.A OG GLN 20.A O no hydrogen 3.378 N/A PHE 24.A N ILE 21.A O no hydrogen 3.190 N/A ALA 26.A N SER 94.A OG no hydrogen 2.918 N/A LYS 27.A N ASP 30.A OD2 no hydrogen 2.837 N/A ASP 30.A N LYS 27.A O no hydrogen 2.912 N/A LEU 31.A N ARG 80.A O no hydrogen 2.893 N/A LEU 32.A N LYS 101.A O no hydrogen 2.831 N/A ILE 33.A N LEU 82.A O no hydrogen 2.821 N/A CYS 34.A N LEU 103.A O no hydrogen 2.843 N/A CYS 34.A SG LEU 32.A O no hydrogen 3.593 N/A THR 35.A N THR 84.A O no hydrogen 3.303 N/A THR 35.A OG1 THR 41.A OG1 no hydrogen 2.551 N/A THR 35.A OG1 HIS 85.A ND1 no hydrogen 3.139 N/A TYR 36.A OH GLY 147.A O no hydrogen 2.639 N/A ALA 39.A N TYR 36.A O no hydrogen 3.121 N/A THR 41.A OG1 THR 35.A OG1 no hydrogen 2.551 N/A ILE 44.A N GLY 40.A O no hydrogen 2.921 N/A GLN 45.A N THR 41.A O no hydrogen 2.888 N/A GLU 46.A N THR 42.A O no hydrogen 3.124 N/A ILE 47.A N TRP 43.A O no hydrogen 3.038 N/A VAL 48.A N ILE 44.A O no hydrogen 2.858 N/A ASP 49.A N GLN 45.A O no hydrogen 2.884 N/A MET 50.A N GLU 46.A O no hydrogen 2.903 N/A ILE 51.A N ILE 47.A O no hydrogen 2.966 N/A GLU 52.A N VAL 48.A O no hydrogen 2.819 N/A GLN 53.A N MET 50.A O no hydrogen 3.236 N/A ASN 54.A ND2 ASN 54.A O no hydrogen 2.561 N/A GLY 55.A N MET 50.A O no hydrogen 2.633 N/A ILE 59.A N LYS 83.A O no hydrogen 2.939 N/A GLU 60.A N GLU 60.A OE2 no hydrogen 2.768 N/A TRP 61.A N PHE 58.A O.A no hydrogen 3.057 N/A TRP 61.A N PHE 58.A O.B no hydrogen 3.147 N/A ARG 63.A NH1 PRO 64.A O no hydrogen 3.258 N/A GLN 66.A N ARG 63.A O no hydrogen 2.982 N/A SER 68.A N GLU 71.A OE1 no hydrogen 2.925 N/A SER 68.A OG GLN 20.A OE1 no hydrogen 2.817 N/A GLY 69.A N TRP 61.A O no hydrogen 2.845 N/A GLU 71.A N SER 68.A OG no hydrogen 3.048 N/A LYS 72.A N SER 68.A O no hydrogen 2.963 N/A LYS 72.A NZ PRO 67.A O no hydrogen 2.537 N/A ALA 73.A N GLY 69.A O no hydrogen 2.958 N/A LYS 74.A N VAL 70.A O no hydrogen 2.937 N/A ALA 75.A N LYS 72.A O no hydrogen 3.252 N/A MET 76.A N ALA 73.A O no hydrogen 3.040 N/A SER 78.A OG ASP 29.A OD1 no hydrogen 3.561 N/A ARG 80.A NE ASP 30.A OD1 no hydrogen 2.874 N/A ARG 80.A NH1 ALA 73.A O no hydrogen 3.047 N/A ARG 80.A NH2 GLU 25.A O no hydrogen 3.019 N/A ARG 80.A NH2 ASP 30.A OD1 no hydrogen 3.429 N/A ARG 80.A NH2 ASP 30.A OD2 no hydrogen 2.857 N/A LEU 82.A N LEU 31.A O no hydrogen 2.905 N/A LYS 83.A N PRO 57.A O no hydrogen 2.966 N/A LYS 83.A NZ GLN 45.A OE1 no hydrogen 2.646 N/A THR 84.A N ILE 33.A O no hydrogen 2.935 N/A THR 84.A OG1 GLU 60.A OE1 no hydrogen 3.320 N/A THR 84.A OG1 GLU 60.A OE2 no hydrogen 2.658 N/A HIS 85.A N GLU 60.A OE1 no hydrogen 2.836 N/A HIS 85.A ND1 THR 35.A O no hydrogen 2.787 N/A LEU 86.A N THR 84.A OG1 no hydrogen 3.000 N/A LEU 90.A N SER 87.A O no hydrogen 3.175 N/A LEU 90.A N SER 87.A OG no hydrogen 3.268 N/A PHE 95.A N PRO 92.A O no hydrogen 3.282 N/A TRP 96.A N PRO 93.A O no hydrogen 3.127 N/A GLU 97.A N PRO 93.A O no hydrogen 3.411 N/A ASN 98.A N SER 94.A O no hydrogen 3.202 N/A ASN 98.A ND2 SER 94.A O no hydrogen 2.960 N/A CYS 100.A SG LYS 27.A O no hydrogen 3.345 N/A CYS 100.A SG PHE 95.A O no hydrogen 3.446 N/A LYS 101.A N ASP 30.A O no hydrogen 3.235 N/A PHE 102.A N GLN 164.A O no hydrogen 2.879 N/A LEU 103.A N LEU 32.A O no hydrogen 2.843 N/A TYR 104.A N LEU 166.A O no hydrogen 2.882 N/A TYR 104.A OH HIS 152.A ND1 no hydrogen 2.755 N/A VAL 105.A N CYS 34.A O no hydrogen 3.176 N/A ALA 106.A N LEU 168.A O no hydrogen 2.798 N/A ARG 107.A NH1 THR 218.A O no hydrogen 2.918 N/A ARG 107.A NH2 LYS 38.A O no hydrogen 3.016 N/A ASN 108.A N GLU 171.A OE2 no hydrogen 2.731 N/A ASN 108.A ND2 ASP 111.A OD2 no hydrogen 2.874 N/A ASN 108.A ND2 GLU 171.A OE2 no hydrogen 3.082 N/A ASN 108.A ND2 SER 250.A O no hydrogen 3.517 N/A LYS 110.A NZ ASN 231.A OD1 no hydrogen 2.662 N/A LYS 110.A NZ ASP 235.A OD1 no hydrogen 2.819 N/A ASP 111.A N ASN 108.A OD1 no hydrogen 2.803 N/A CYS 112.A N ASN 108.A O no hydrogen 2.956 N/A CYS 112.A SG ARG 107.A O no hydrogen 3.525 N/A CYS 112.A SG ASN 108.A O no hydrogen 3.402 N/A MET 113.A N ALA 109.A O no hydrogen 2.950 N/A VAL 114.A N LYS 110.A O no hydrogen 3.181 N/A SER 115.A N ASP 111.A O no hydrogen 2.976 N/A TYR 116.A N CYS 112.A O no hydrogen 2.889 N/A TYR 116.A OH VAL 145.A O no hydrogen 2.689 N/A TYR 117.A N MET 113.A O no hydrogen 2.950 N/A HIS 118.A N VAL 114.A O no hydrogen 3.246 N/A PHE 119.A N SER 115.A O no hydrogen 3.023 N/A GLN 120.A N TYR 116.A O no hydrogen 2.828 N/A GLN 120.A NE2 PRO 127.A O no hydrogen 2.825 N/A ARG 121.A N TYR 117.A O no hydrogen 3.122 N/A MET 122.A N HIS 118.A O no hydrogen 3.039 N/A ASN 123.A N PHE 119.A O no hydrogen 2.932 N/A MET 125.A N ASN 123.A OD1 no hydrogen 2.965 N/A LEU 126.A N ASN 123.A O no hydrogen 2.980 N/A GLY 130.A N ASP 128.A OD1 no hydrogen 3.038 N/A THR 131.A N GLU 134.A OE1 no hydrogen 3.078 N/A THR 131.A OG1 GLU 133.A OE1 no hydrogen 3.519 N/A TRP 132.A NE1 GLN 230.A OE1 no hydrogen 2.906 N/A GLU 134.A N THR 131.A OG1 no hydrogen 3.089 N/A TYR 135.A N THR 131.A O no hydrogen 2.966 N/A TYR 135.A OH GLN 120.A OE1 no hydrogen 2.758 N/A PHE 136.A N TRP 132.A O no hydrogen 3.009 N/A THR 138.A N GLU 134.A O no hydrogen 3.152 N/A THR 138.A OG1 GLU 134.A O no hydrogen 3.142 N/A PHE 139.A N TYR 135.A O no hydrogen 2.754 N/A ILE 140.A N PHE 136.A O no hydrogen 3.103 N/A ASN 141.A N GLU 137.A O no hydrogen 2.944 N/A GLY 142.A N PHE 139.A O no hydrogen 2.989 N/A LYS 143.A N THR 138.A O no hydrogen 2.999 N/A LYS 143.A NZ ASN 141.A O no hydrogen 3.172 N/A TRP 146.A N LEU 9.A O no hydrogen 2.868 N/A TRP 146.A NE1 GLU 60.A OE1 no hydrogen 2.874 N/A GLY 147.A N VAL 144.A O no hydrogen 2.956 N/A TRP 149.A NE1 ARG 107.A O no hydrogen 3.056 N/A ASP 151.A N SER 148.A OG no hydrogen 3.344 N/A HIS 152.A N SER 148.A O no hydrogen 3.076 N/A HIS 152.A ND1 TYR 104.A OH no hydrogen 2.755 N/A HIS 152.A NE2 HIS 85.A O no hydrogen 2.763 N/A VAL 153.A N TRP 149.A O no hydrogen 3.061 N/A LYS 154.A N PHE 150.A O no hydrogen 2.970 N/A LYS 154.A NZ LYS 241.A O no hydrogen 2.746 N/A GLY 155.A N ASP 151.A O no hydrogen 3.095 N/A TRP 156.A N HIS 152.A O no hydrogen 3.095 N/A TRP 156.A NE1 LEU 86.A O no hydrogen 3.182 N/A TRP 157.A N VAL 153.A O no hydrogen 2.915 N/A TRP 157.A NE1 SER 246.A OG no hydrogen 2.934 N/A GLU 158.A N LYS 154.A O no hydrogen 2.934 N/A MET 159.A N GLY 155.A O no hydrogen 3.124 N/A LYS 160.A N TRP 156.A O no hydrogen 3.224 N/A LYS 160.A N TRP 157.A O no hydrogen 3.367 N/A LYS 160.A NZ TRP 157.A O no hydrogen 3.006 N/A LYS 160.A NZ ASP 161.A OD2 no hydrogen 3.127 N/A ARG 162.A N MET 159.A O no hydrogen 2.983 N/A HIS 163.A N MET 159.A O no hydrogen 3.064 N/A GLN 164.A NE2 ASN 99.A O no hydrogen 3.343 N/A ILE 165.A N HIS 163.A O no hydrogen 2.925 N/A LEU 166.A N PHE 102.A O no hydrogen 2.808 N/A LEU 168.A N TYR 104.A O no hydrogen 2.767 N/A TYR 170.A N ALA 106.A O no hydrogen 2.784 N/A ILE 173.A N PHE 169.A O no hydrogen 3.138 N/A LYS 174.A N TYR 170.A O no hydrogen 2.913 N/A LYS 174.A NZ GLY 217.A O no hydrogen 2.809 N/A ARG 175.A N GLU 171.A O no hydrogen 2.863 N/A ARG 175.A NH1 ASP 172.A OD1 no hydrogen 2.946 N/A ARG 175.A NH2 SER 250.A OG no hydrogen 2.798 N/A ASP 176.A N ASP 172.A O no hydrogen 2.851 N/A LYS 178.A NZ ASP 198.A OD1 no hydrogen 2.915 N/A HIS 179.A N ASP 176.A OD1 no hydrogen 3.244 N/A HIS 179.A ND1 GLU 180.A OE2 no hydrogen 3.165 N/A GLU 180.A N ASP 176.A O no hydrogen 3.328 N/A ILE 181.A N PRO 177.A O no hydrogen 2.888 N/A ARG 182.A N LYS 178.A O no hydrogen 2.959 N/A ARG 182.A NE GLU 194.A OE2 no hydrogen 3.135 N/A ARG 182.A NH1 GLU 194.A OE1 no hydrogen 2.906 N/A ARG 182.A NH1 GLU 194.A OE2 no hydrogen 3.473 N/A LYS 183.A NZ GLU 180.A OE1 no hydrogen 2.985 N/A LYS 183.A NZ GLU 180.A OE2 no hydrogen 3.435 N/A VAL 184.A N GLU 180.A O no hydrogen 3.200 N/A MET 185.A N ILE 181.A O no hydrogen 2.957 N/A GLN 186.A N ARG 182.A O no hydrogen 3.064 N/A PHE 187.A N LYS 183.A O no hydrogen 2.907 N/A MET 188.A N VAL 184.A O no hydrogen 2.875 N/A GLY 189.A N GLN 186.A O no hydrogen 2.986 N/A LYS 190.A N MET 185.A O no hydrogen 2.983 N/A LYS 190.A NZ ASN 54.A OD1 no hydrogen 3.298 N/A THR 195.A N ASP 193.A OD1 no hydrogen 2.828 N/A VAL 196.A N ASP 193.A OD1 no hydrogen 3.184 N/A LEU 197.A N ASP 193.A O no hydrogen 2.845 N/A ASP 198.A N GLU 194.A O no hydrogen 2.987 N/A LYS 199.A N THR 195.A O no hydrogen 3.179 N/A LYS 199.A NZ GLY 55.A O no hydrogen 3.371 N/A ILE 200.A N VAL 196.A O no hydrogen 2.964 N/A VAL 201.A N LEU 197.A O no hydrogen 2.954 N/A GLN 202.A N ASP 198.A O no hydrogen 3.184 N/A GLU 203.A N LYS 199.A O no hydrogen 2.873 N/A THR 204.A N ILE 200.A O no hydrogen 3.008 N/A THR 204.A OG1 ILE 200.A O no hydrogen 2.716 N/A SER 205.A OG GLN 202.A O no hydrogen 3.459 N/A LYS 208.A N SER 205.A OG no hydrogen 3.168 N/A MET 209.A N SER 205.A O no hydrogen 2.940 N/A LYS 210.A N PHE 206.A O no hydrogen 2.825 N/A ASN 212.A N LYS 208.A O no hydrogen 3.228 N/A ARG 215.A NH1 ASP 221.A OD2 no hydrogen 2.819 N/A ARG 215.A NH2 ASP 221.A OD2 no hydrogen 2.895 N/A VAL 219.A N THR 218.A OG1 no hydrogen 2.735 N/A GLY 220.A N ASP 111.A OD2 no hydrogen 2.717 N/A TRP 222.A N ASP 111.A OD1 no hydrogen 2.930 N/A TRP 222.A NE1 MET 251.A O no hydrogen 2.850 N/A LYS 223.A N GLY 220.A O no hydrogen 3.045 N/A LYS 223.A NZ GLU 252.A OE1 no hydrogen 2.932 N/A ASN 224.A N ASP 221.A O no hydrogen 3.009 N/A ASN 224.A ND2 ASP 221.A OD1 no hydrogen 2.876 N/A HIS 225.A N TRP 222.A O no hydrogen 3.032 N/A HIS 225.A ND1 ASP 221.A O no hydrogen 2.943 N/A PHE 226.A N TRP 222.A O no hydrogen 2.876 N/A THR 227.A N GLN 230.A OE1 no hydrogen 2.962 N/A GLN 230.A N THR 227.A OG1 no hydrogen 3.018 N/A ASN 231.A N THR 227.A O no hydrogen 2.872 N/A GLU 232.A N VAL 228.A O no hydrogen 2.922 N/A ARG 233.A N ALA 229.A O no hydrogen 3.089 N/A PHE 234.A N GLN 230.A O no hydrogen 2.821 N/A ASP 235.A N ASN 231.A O no hydrogen 2.869 N/A GLU 236.A N GLU 232.A O no hydrogen 3.239 N/A ILE 237.A N ARG 233.A O no hydrogen 3.116 N/A TYR 238.A N PHE 234.A O no hydrogen 2.781 N/A ARG 239.A N ASP 235.A O no hydrogen 2.990 N/A ARG 239.A NE GLU 236.A OE2 no hydrogen 3.145 N/A ARG 239.A NH2 GLU 236.A OE2 no hydrogen 3.133 N/A ARG 240.A N GLU 236.A O no hydrogen 3.190 N/A LYS 241.A N ILE 237.A O no hydrogen 2.839 N/A LYS 241.A NZ ILE 140.A O no hydrogen 3.443 N/A MET 242.A N TYR 238.A O no hydrogen 2.833 N/A THR 245.A N MET 242.A O no hydrogen 3.045 N/A THR 245.A OG1 MET 242.A O no hydrogen 2.852 N/A