Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3gba_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 4.A N GLY 1.A O no hydrogen 3.251 N/A ARG 4.A NH1.A ASP 83.A OD2 no hydrogen 3.048 N/A ARG 4.A NH1.B ASP 83.A OD1 no hydrogen 3.051 N/A ARG 4.A NH1.B ASP 83.A OD2 no hydrogen 3.407 N/A ARG 4.A NH2.A ASP 83.A OD1 no hydrogen 3.076 N/A ARG 4.A NH2.B ASP 83.A OD2 no hydrogen 3.006 N/A LEU 6.A N LEU 50.A O no hydrogen 2.881 N/A ILE 7.A N ASP 83.A OD2 no hydrogen 2.802 N/A VAL 8.A N ASP 52.A O no hydrogen 2.919 N/A THR 9.A N LEU 84.A O no hydrogen 2.924 N/A THR 10.A N LYS 54.A O no hydrogen 3.265 N/A THR 10.A OG1 VAL 86.A O no hydrogen 2.770 N/A GLU 13.A N VAL 17.A O no hydrogen 2.875 N/A VAL 17.A N GLU 13.A O no hydrogen 2.897 N/A MET 18.A N GLU 33.A O no hydrogen 2.776 N/A ARG 20.A N ARG 31.A O no hydrogen 2.826 N/A ARG 20.A NE.A ASP 30.A O no hydrogen 3.200 N/A ARG 20.A NH1.B ASP 30.A O no hydrogen 3.009 N/A ARG 20.A NH2.A PHE 32.A O no hydrogen 3.139 N/A SER 22.A OG LYS 24.A O no hydrogen 2.623 N/A LYS 24.A N SER 22.A OG no hydrogen 3.109 N/A ASN 29.A ND2 TYR 51.A O no hydrogen 2.968 N/A ARG 31.A N GLY 28.A O no hydrogen 3.099 N/A ARG 31.A NE GLY 28.A O no hydrogen 2.840 N/A ARG 31.A NH2 GLY 28.A O no hydrogen 3.459 N/A PHE 32.A N ASN 29.A O no hydrogen 2.996 N/A GLU 33.A N MET 18.A O no hydrogen 2.861 N/A TYR 35.A N PRO 15.A O no hydrogen 2.961 N/A CYS 36.A N TYR 16.A O no hydrogen 2.862 N/A ASP 38.A N GLY 34.A O no hydrogen 3.010 N/A LEU 39.A N TYR 35.A O no hydrogen 2.877 N/A LEU 40.A N CYS 36.A O no hydrogen 2.861 N/A LYS 41.A N LEU 37.A O no hydrogen 2.934 N/A GLU 42.A N ASP 38.A O no hydrogen 3.091 N/A LEU 43.A N LEU 39.A O no hydrogen 2.890 N/A SER 44.A N LEU 40.A O no hydrogen 2.861 N/A SER 44.A OG.A LEU 40.A O no hydrogen 3.548 N/A SER 44.A OG.A LYS 41.A O no hydrogen 2.696 N/A SER 44.A OG.B PHE 49.A O no hydrogen 2.538 N/A ASN 45.A N LYS 41.A O no hydrogen 3.044 N/A ILE 46.A N GLU 42.A O no hydrogen 3.036 N/A LEU 47.A N LEU 43.A O no hydrogen 2.846 N/A GLY 48.A N SER 44.A O no hydrogen 2.800 N/A PHE 49.A N SER 44.A O no hydrogen 3.154 N/A ASP 52.A N LEU 6.A O no hydrogen 2.888 N/A VAL 53.A N ASN 29.A OD1 no hydrogen 2.941 N/A LYS 54.A N VAL 8.A O no hydrogen 2.844 N/A VAL 56.A N THR 10.A O no hydrogen 2.835 N/A GLY 59.A N VAL 56.A O no hydrogen 3.201 N/A LYS 60.A N ASP 58.A OD1 no hydrogen 3.156 N/A TYR 61.A OH GLU 13.A OE1 no hydrogen 2.705 N/A GLY 62.A N ASP 139.A O no hydrogen 2.890 N/A ALA 63.A N ASN 71.A OD1 no hydrogen 2.822 N/A GLN 64.A NE2 GLY 68.A O no hydrogen 2.594 N/A ASN 65.A N GLU 69.A O no hydrogen 2.742 N/A LYS 67.A N ASN 65.A OD1 no hydrogen 2.908 N/A GLY 68.A N ASN 65.A O no hydrogen 2.889 N/A GLU 69.A N ASN 65.A OD1 no hydrogen 3.049 N/A ASN 71.A N ALA 63.A O no hydrogen 3.239 N/A ASN 71.A ND2 ASP 139.A OD1 no hydrogen 3.411 N/A GLY 72.A N ASP 58.A OD2 no hydrogen 2.892 N/A MET 73.A N LYS 60.A O no hydrogen 3.186 N/A MET 73.A N TYR 61.A O no hydrogen 2.923 N/A VAL 74.A N TYR 61.A O no hydrogen 3.367 N/A LYS 75.A N ASN 71.A O no hydrogen 3.137 N/A LYS 75.A NZ ASP 79.A OD2 no hydrogen 2.642 N/A GLU 76.A N GLY 72.A O no hydrogen 3.147 N/A LEU 77.A N MET 73.A O no hydrogen 3.155 N/A ILE 78.A N VAL 74.A O no hydrogen 2.975 N/A ASP 79.A N LYS 75.A O no hydrogen 2.954 N/A HIS 80.A N LEU 77.A O no hydrogen 2.979 N/A ARG 81.A N GLU 76.A O no hydrogen 2.884 N/A ARG 81.A NE GLU 76.A OE1 no hydrogen 3.221 N/A ARG 81.A NE GLU 76.A OE2 no hydrogen 3.129 N/A ARG 81.A NH1 ASP 79.A OD2 no hydrogen 2.899 N/A ARG 81.A NH2 GLU 76.A OE2 no hydrogen 2.994 N/A ALA 82.A N GLU 76.A O no hydrogen 3.197 N/A ASP 83.A N ILE 7.A O no hydrogen 2.763 N/A LEU 84.A N ILE 7.A O no hydrogen 3.270 N/A ALA 85.A N GLY 219.A O no hydrogen 2.824 N/A VAL 86.A N THR 9.A O no hydrogen 3.183 N/A LEU 89.A N ALA 87.A O no hydrogen 2.753 N/A THR 90.A OG1 SER 141.A OG no hydrogen 3.286 N/A THR 90.A OG1 GLU 190.A OE2 no hydrogen 2.739 N/A ILE 91.A N GLY 215.A O no hydrogen 2.861 N/A ARG 95.A N THR 92.A OG1 no hydrogen 3.313 N/A ARG 95.A NH1 THR 90.A O no hydrogen 2.897 N/A ARG 95.A NH2 GLY 62.A O no hydrogen 2.866 N/A GLU 96.A N THR 92.A O no hydrogen 2.932 N/A LYS 97.A N VAL 94.A O no hydrogen 3.355 N/A VAL 98.A N ARG 95.A O no hydrogen 2.928 N/A ILE 99.A N ARG 95.A O no hydrogen 2.904 N/A ASP 100.A N THR 220.A O no hydrogen 2.959 N/A SER 102.A N VAL 218.A O no hydrogen 2.892 N/A SER 102.A OG LYS 103.A O no hydrogen 2.784 N/A LYS 103.A N THR 231.A OG1 no hydrogen 2.945 N/A PHE 105.A N TYR 216.A O no hydrogen 2.924 N/A LEU 108.A N LYS 214.A O no hydrogen 2.956 N/A GLY 109.A N SER 191.A OG no hydrogen 3.011 N/A ILE 110.A N ASP 212.A OD1 no hydrogen 2.838 N/A SER 111.A N MET 189.A O.A no hydrogen 2.751 N/A SER 111.A N MET 189.A O.B no hydrogen 2.922 N/A SER 111.A OG ILE 207.A O no hydrogen 3.312 N/A SER 111.A OG GLY 209.A O no hydrogen 2.913 N/A LEU 113.A N LEU 187.A O no hydrogen 2.817 N/A TYR 114.A N THR 205.A O no hydrogen 3.067 N/A TYR 114.A OH ASP 184.A OD1 no hydrogen 2.704 N/A ARG 115.A NH1 THR 183.A O no hydrogen 3.538 N/A ARG 115.A NH1 ASP 184.A OD1 no hydrogen 2.817 N/A ARG 115.A NH2 ASP 184.A OD1 no hydrogen 3.322 N/A LYS 116.A N ASN 203.A O no hydrogen 2.852 N/A LYS 116.A NZ CYS 202.A O no hydrogen 2.759 N/A ILE 120.A N THR 118.A OG1 no hydrogen 3.098 N/A ASP 121.A N ASP 125.A OD2 no hydrogen 2.817 N/A ASP 125.A N SER 122.A OG no hydrogen 3.099 N/A LEU 126.A N SER 122.A O no hydrogen 3.363 N/A ALA 127.A N ALA 123.A O no hydrogen 2.876 N/A LYS 128.A N ASP 124.A O no hydrogen 3.107 N/A GLN 129.A N LEU 126.A O no hydrogen 3.278 N/A GLN 129.A NE2 LEU 126.A O no hydrogen 2.913 N/A GLN 129.A NE2 ILE 132.A O no hydrogen 2.952 N/A ILE 132.A N GLN 129.A OE1 no hydrogen 2.747 N/A GLU 133.A N ASP 184.A O no hydrogen 3.256 N/A GLY 135.A N ALA 186.A O no hydrogen 3.139 N/A ARG 138.A N VAL 170.A O no hydrogen 2.759 N/A ARG 138.A NE LEU 169.A O no hydrogen 2.993 N/A THR 144.A N GLY 140.A O no hydrogen 3.090 N/A THR 144.A OG1 GLY 140.A O no hydrogen 3.054 N/A PHE 145.A N SER 141.A O no hydrogen 2.871 N/A PHE 146.A N THR 142.A O no hydrogen 3.222 N/A LYS 147.A N MET 143.A O no hydrogen 2.924 N/A LYS 148.A N THR 144.A O no hydrogen 2.958 N/A SER 149.A N PHE 146.A O no hydrogen 3.364 N/A LYS 150.A NZ LYS 148.A O no hydrogen 3.209 N/A ILE 151.A N SER 149.A OG no hydrogen 3.081 N/A THR 153.A OG1 ASP 124.A OD1 no hydrogen 3.005 N/A GLU 155.A N ILE 151.A O no hydrogen 2.896 N/A LYS 156.A N SER 152.A O no hydrogen 3.042 N/A LYS 156.A NZ ALA 127.A O no hydrogen 3.279 N/A MET 157.A N THR 153.A O no hydrogen 2.967 N/A TRP 158.A N TYR 154.A O no hydrogen 2.838 N/A ALA 159.A N GLU 155.A O no hydrogen 3.024 N/A PHE 160.A N LYS 156.A O no hydrogen 3.090 N/A MET 161.A N MET 157.A O no hydrogen 2.835 N/A SER 162.A N TRP 158.A O no hydrogen 3.009 N/A SER 162.A OG TRP 158.A O no hydrogen 2.684 N/A SER 162.A OG ALA 159.A O no hydrogen 3.558 N/A SER 163.A N PHE 160.A O no hydrogen 3.138 N/A SER 163.A OG ALA 159.A O no hydrogen 2.654 N/A SER 163.A OG PHE 160.A O no hydrogen 3.342 N/A ARG 164.A NE PHE 160.A O no hydrogen 2.866 N/A ARG 164.A NH1 SER 163.A OG no hydrogen 2.886 N/A SER 167.A OG LEU 169.A O no hydrogen 3.313 N/A LEU 169.A N SER 167.A OG no hydrogen 3.150 N/A VAL 170.A N ALA 136.A O no hydrogen 2.958 N/A LYS 171.A N GLU 175.A OE2 no hydrogen 2.955 N/A SER 173.A OG GLU 13.A OE1 no hydrogen 2.822 N/A SER 173.A OG GLU 13.A OE2 no hydrogen 2.865 N/A GLU 175.A N ASN 172.A OD1 no hydrogen 3.000 N/A GLY 176.A N ASN 172.A O no hydrogen 3.147 N/A ILE 177.A N SER 173.A O no hydrogen 2.824 N/A GLN 178.A N ASP 174.A O no hydrogen 3.004 N/A ARG 179.A N GLU 175.A O no hydrogen 3.063 N/A ARG 179.A NH1 SER 167.A O no hydrogen 2.728 N/A ARG 179.A NH2 GLN 166.A O no hydrogen 3.532 N/A ARG 179.A NH2 SER 167.A O no hydrogen 3.542 N/A VAL 180.A N GLY 176.A O no hydrogen 3.020 N/A LEU 181.A N ILE 177.A O no hydrogen 3.024 N/A THR 182.A N GLN 178.A O no hydrogen 2.952 N/A THR 182.A OG1 GLN 178.A O no hydrogen 2.659 N/A THR 183.A N ARG 179.A O no hydrogen 2.964 N/A THR 183.A OG1 ARG 179.A O no hydrogen 2.706 N/A TYR 185.A OH ALA 168.A O no hydrogen 2.698 N/A ALA 186.A N GLU 133.A O no hydrogen 2.977 N/A LEU 187.A N LEU 113.A O no hydrogen 2.964 N/A LEU 188.A N GLY 135.A O no hydrogen 2.775 N/A MET 189.A N.A SER 111.A O no hydrogen 2.984 N/A MET 189.A N.B SER 111.A O no hydrogen 2.952 N/A SER 191.A N GLY 109.A O no hydrogen 2.795 N/A SER 191.A OG GLY 109.A O no hydrogen 3.299 N/A THR 192.A OG1 TYR 216.A OH no hydrogen 2.750 N/A ILE 194.A N GLU 190.A O no hydrogen 2.945 N/A GLU 195.A N SER 191.A O no hydrogen 2.918 N/A TYR 196.A N THR 192.A O no hydrogen 3.257 N/A VAL 197.A N SER 193.A O no hydrogen 2.922 N/A THR 198.A N ILE 194.A O no hydrogen 2.791 N/A THR 198.A OG1 ILE 194.A O no hydrogen 2.938 N/A THR 198.A OG1 GLU 195.A O no hydrogen 3.416 N/A GLN 199.A N GLU 195.A O no hydrogen 3.278 N/A GLN 199.A NE2 TRP 251.A O no hydrogen 2.751 N/A ARG 200.A N TYR 196.A O no hydrogen 3.376 N/A ASN 201.A N THR 198.A O no hydrogen 3.249 N/A ASN 201.A ND2 VAL 197.A O no hydrogen 2.905 N/A CYS 202.A SG GLN 199.A O no hydrogen 4.028 N/A CYS 202.A SG GLY 255.A O no hydrogen 3.877 N/A LEU 204.A N ASN 201.A O no hydrogen 2.929 N/A THR 205.A N TYR 114.A O no hydrogen 2.827 N/A THR 205.A OG1 GLN 206.A O no hydrogen 3.252 N/A GLN 206.A NE2 GLY 208.A O no hydrogen 2.929 N/A ILE 207.A N ILE 112.A O no hydrogen 2.832 N/A ILE 211.A N ILE 110.A O no hydrogen 2.793 N/A LYS 214.A N LEU 108.A O no hydrogen 2.814 N/A LYS 214.A NZ ASP 212.A OD2 no hydrogen 2.683 N/A TYR 216.A N MET 106.A O no hydrogen 2.941 N/A TYR 216.A OH GLU 190.A OE1 no hydrogen 2.628 N/A TYR 216.A OH THR 192.A OG1 no hydrogen 2.750 N/A GLY 217.A N LEU 89.A O no hydrogen 3.077 N/A VAL 218.A N SER 102.A OG no hydrogen 2.972 N/A GLY 219.A N ALA 85.A O no hydrogen 2.997 N/A THR 220.A N ASP 100.A O no hydrogen 2.871 N/A THR 220.A OG1 PRO 221.A O no hydrogen 2.970 N/A GLY 223.A N ASP 100.A OD2 no hydrogen 2.978 N/A SER 224.A N PRO 221.A O no hydrogen 3.096 N/A TYR 226.A N SER 224.A OG no hydrogen 3.064 N/A ARG 227.A N SER 224.A O no hydrogen 3.347 N/A ARG 227.A NH1 PHE 101.A O no hydrogen 2.959 N/A ILE 230.A N TYR 226.A O no hydrogen 2.850 N/A THR 231.A N ARG 227.A O no hydrogen 3.023 N/A THR 231.A OG1 ARG 227.A O no hydrogen 3.428 N/A ILE 232.A N ASP 228.A O no hydrogen 3.118 N/A ALA 233.A N LYS 229.A O no hydrogen 3.051 N/A ILE 234.A N ILE 230.A O no hydrogen 2.828 N/A LEU 235.A N THR 231.A O no hydrogen 3.071 N/A GLN 236.A N ILE 232.A O no hydrogen 3.069 N/A GLN 236.A NE2.A GLU 240.A OE1 no hydrogen 3.482 N/A GLN 236.A NE2.B ILE 232.A O no hydrogen 3.638 N/A LEU 237.A N ALA 233.A O no hydrogen 2.865 N/A GLN 238.A N ILE 234.A O no hydrogen 2.875 N/A GLU 239.A N LEU 235.A O no hydrogen 2.965 N/A GLU 240.A N GLN 236.A O no hydrogen 2.927 N/A GLY 241.A N GLN 238.A O no hydrogen 3.038 N/A LYS 242.A N LEU 237.A O no hydrogen 2.910 N/A LYS 242.A NZ GLU 42.A OE1 no hydrogen 3.215 N/A LEU 243.A N LEU 237.A O no hydrogen 3.458 N/A MET 245.A N GLY 241.A O no hydrogen 3.037 N/A MET 246.A N LYS 242.A O no hydrogen 2.957 N/A LYS 247.A N LEU 243.A O no hydrogen 2.975 N/A GLU 248.A N HIS 244.A O no hydrogen 2.918 N/A LYS 249.A N MET 245.A O no hydrogen 2.970 N/A LYS 249.A NZ ASP 38.A OD2 no hydrogen 2.805 N/A TRP 250.A N MET 246.A O no hydrogen 3.167 N/A TRP 250.A NE1 ASP 38.A OD2 no hydrogen 2.870 N/A TRP 251.A N LYS 247.A O no hydrogen 2.922 N/A TRP 251.A NE1 THR 192.A O no hydrogen 2.978 N/A GLY 255.A N GLN 199.A OE1 no hydrogen 3.126 N/A CYS 256.A SG THR 198.A O no hydrogen 3.379 N/A CYS 256.A SG GLN 199.A O no hydrogen 3.762 N/A