Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3rdt_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 1.A N ASN 25.A OD1 no hydrogen 2.782 N/A THR 3.A N ASN 22.A O no hydrogen 2.889 N/A GLN 4.A NE2 TYR 87.A O no hydrogen 2.890 N/A GLN 4.A NE2 THR 105.A OG1 no hydrogen 2.904 N/A SER 5.A N SER 20.A O no hydrogen 3.193 N/A ARG 7.A NE GLY 104.A O no hydrogen 2.994 N/A LYS 9.A N ARG 106.A O no hydrogen 2.932 N/A ALA 11.A N SER 108.A O no hydrogen 2.926 N/A THR 13.A N LEU 110.A O no hydrogen 3.183 N/A GLY 14.A N ALA 79.A O no hydrogen 2.646 N/A GLY 15.A N VAL 12.A O no hydrogen 3.042 N/A VAL 17.A N LEU 76.A O no hydrogen 2.958 N/A LEU 19.A N LEU 74.A O no hydrogen 2.874 N/A SER 20.A N SER 5.A O no hydrogen 2.970 N/A CYS 21.A SG ASN 22.A O no hydrogen 3.975 N/A ASN 22.A N THR 3.A O no hydrogen 2.998 N/A GLN 23.A N GLU 70.A O no hydrogen 2.989 N/A GLN 23.A NE2 HIS 27.A O no hydrogen 3.456 N/A THR 24.A N ALA 1.A O no hydrogen 2.924 N/A ASN 25.A ND2 SER 91.A OG no hydrogen 3.425 N/A HIS 27.A N GLN 23.A OE1 no hydrogen 2.560 N/A HIS 27.A ND1 SER 91.A OG no hydrogen 2.546 N/A ASN 29.A N GLY 92.A O no hydrogen 2.986 N/A ASN 29.A ND2 TYR 31.A OH no hydrogen 3.215 N/A MET 30.A N SER 47.A O no hydrogen 3.108 N/A TYR 31.A N ALA 90.A O no hydrogen 2.769 N/A TRP 32.A N HIS 45.A O no hydrogen 2.884 N/A TRP 32.A NE1 PHE 72.A O no hydrogen 3.159 N/A TYR 33.A N PHE 88.A O no hydrogen 2.691 N/A ARG 34.A N ARG 42.A O no hydrogen 3.103 N/A ARG 34.A NE ASP 36.A OD2 no hydrogen 2.782 N/A ARG 34.A NH1 SER 82.A O no hydrogen 3.216 N/A ARG 34.A NH2 ASP 36.A OD1 no hydrogen 3.407 N/A ARG 34.A NH2 ASP 36.A OD2 no hydrogen 3.075 N/A ARG 34.A NH2 SER 82.A O no hydrogen 2.977 N/A GLN 35.A N VAL 86.A O no hydrogen 2.972 N/A ARG 42.A N ARG 34.A O no hydrogen 3.016 N/A ARG 42.A NH2 ASP 36.A OD2 no hydrogen 2.793 N/A ILE 44.A N TRP 32.A O no hydrogen 2.867 N/A HIS 45.A NE2 TYR 62.A O no hydrogen 2.831 N/A TYR 46.A N GLU 54.A O no hydrogen 2.908 N/A SER 47.A N MET 30.A O no hydrogen 2.956 N/A SER 47.A OG SER 52.A O no hydrogen 2.609 N/A GLY 49.A N SER 47.A OG no hydrogen 3.297 N/A GLY 51.A N ARG 66.A O no hydrogen 2.613 N/A SER 52.A OG GLY 49.A O no hydrogen 3.040 N/A GLU 54.A N TYR 46.A O no hydrogen 2.748 N/A GLY 56.A N ILE 44.A O no hydrogen 3.061 N/A ILE 58.A N LEU 43.A O no hydrogen 3.212 N/A TYR 62.A N PRO 59.A O no hydrogen 3.061 N/A TYR 62.A OH TYR 87.A OH no hydrogen 2.814 N/A LYS 63.A N ILE 75.A O no hydrogen 2.738 N/A SER 65.A N SER 73.A O no hydrogen 2.823 N/A ARG 66.A NE SER 68.A O no hydrogen 2.711 N/A ARG 66.A NH1 ASN 28.A O no hydrogen 2.918 N/A ARG 66.A NH1 SER 47.A O no hydrogen 3.156 N/A ARG 66.A NH1 SER 47.A OG no hydrogen 3.042 N/A ARG 66.A NH2 ASN 28.A O no hydrogen 2.653 N/A ARG 66.A NH2 GLN 69.A O no hydrogen 3.025 N/A SER 68.A OG GLU 70.A OE1 no hydrogen 2.558 N/A GLU 70.A N SER 68.A OG no hydrogen 3.308 N/A PHE 72.A N CYS 21.A O no hydrogen 3.036 N/A SER 73.A N SER 65.A O no hydrogen 2.754 N/A SER 73.A OG ASN 71.A OD1 no hydrogen 3.011 N/A LEU 74.A N LEU 19.A O no hydrogen 2.817 N/A ILE 75.A N LYS 63.A O no hydrogen 2.735 N/A LEU 76.A N VAL 17.A O no hydrogen 2.684 N/A ALA 79.A N GLY 15.A O no hydrogen 2.855 N/A THR 80.A N GLN 83.A OE1 no hydrogen 2.712 N/A THR 80.A OG1 SER 82.A OG no hydrogen 3.012 N/A THR 80.A OG1 GLN 83.A OE1 no hydrogen 3.288 N/A SER 82.A OG THR 80.A OG1 no hydrogen 3.012 N/A GLN 83.A N THR 80.A O no hydrogen 2.864 N/A GLN 83.A NE2 GLY 61.A O no hydrogen 3.419 N/A THR 84.A N PRO 81.A O no hydrogen 3.052 N/A THR 84.A OG1 PRO 81.A O no hydrogen 3.023 N/A THR 84.A OG1 VAL 109.A O no hydrogen 3.241 N/A SER 85.A N LEU 107.A O no hydrogen 3.040 N/A SER 85.A OG GLN 35.A O no hydrogen 3.048 N/A SER 85.A OG ASP 36.A OD1 no hydrogen 2.383 N/A SER 85.A OG VAL 86.A O no hydrogen 3.513 N/A TYR 87.A N THR 105.A O no hydrogen 2.747 N/A TYR 87.A OH TYR 62.A OH no hydrogen 2.814 N/A TYR 87.A OH GLN 83.A O no hydrogen 2.465 N/A PHE 88.A N TYR 33.A O no hydrogen 2.975 N/A CYS 89.A N GLN 4.A OE1 no hydrogen 2.757 N/A CYS 89.A SG TYR 31.A O no hydrogen 4.041 N/A ALA 90.A N TYR 31.A O no hydrogen 2.901 N/A SER 91.A N TYR 100.A O no hydrogen 2.962 N/A SER 91.A OG HIS 27.A ND1 no hydrogen 2.546 N/A GLY 92.A N ASN 29.A O no hydrogen 2.781 N/A GLY 96.A N ASP 93.A O no hydrogen 2.818 N/A TYR 100.A N SER 91.A O no hydrogen 2.876 N/A GLY 102.A N CYS 89.A O no hydrogen 2.767 N/A THR 105.A N TYR 87.A O no hydrogen 2.887 N/A THR 105.A OG1 PRO 6.A O no hydrogen 2.573 N/A ARG 106.A N ARG 7.A O no hydrogen 2.997 N/A ARG 106.A NE ASN 8.A OD1 no hydrogen 2.816 N/A ARG 106.A NH2 ASN 8.A OD1 no hydrogen 3.227 N/A LEU 107.A N SER 85.A O no hydrogen 2.779 N/A SER 108.A N LYS 9.A O no hydrogen 3.016 N/A VAL 109.A N THR 84.A OG1 no hydrogen 2.752 N/A LEU 110.A N ALA 11.A O no hydrogen 2.944 N/A LYS 114.A NZ THR 220.A OG1 no hydrogen 3.127 N/A PHE 117.A N TYR 147.A O no hydrogen 2.991 N/A GLU 120.A N THR 144.A O no hydrogen 2.838 N/A ALA 122.A N LEU 142.A O no hydrogen 3.027 N/A PHE 124.A N VAL 140.A O no hydrogen 2.846 N/A GLU 130.A N SER 127.A OG no hydrogen 2.627 N/A ILE 131.A N SER 127.A O no hydrogen 2.979 N/A SER 132.A N GLU 128.A O no hydrogen 2.764 N/A HIS 133.A N GLU 130.A O no hydrogen 3.365 N/A THR 134.A OG1 GLU 130.A O no hydrogen 2.751 N/A GLN 135.A N ILE 131.A O no hydrogen 2.821 N/A GLN 135.A NE2 SER 132.A O no hydrogen 3.308 N/A LYS 136.A N THR 134.A OG1 no hydrogen 2.976 N/A ALA 137.A N VAL 192.A O no hydrogen 2.798 N/A THR 138.A N GLU 130.A OE1 no hydrogen 2.718 N/A THR 138.A OG1 GLU 130.A OE1 no hydrogen 3.459 N/A THR 138.A OG1 GLU 130.A OE2 no hydrogen 2.675 N/A LEU 139.A N LEU 190.A O no hydrogen 2.694 N/A VAL 140.A N PHE 124.A O no hydrogen 3.189 N/A CYS 141.A N SER 188.A O no hydrogen 2.753 N/A CYS 141.A SG ALA 122.A O no hydrogen 3.872 N/A LEU 142.A N ALA 122.A O no hydrogen 2.845 N/A ALA 143.A N LEU 186.A O no hydrogen 2.740 N/A THR 144.A N GLU 120.A O no hydrogen 2.876 N/A THR 144.A OG1 GLU 120.A O no hydrogen 3.308 N/A GLY 145.A N GLU 175.A OE2 no hydrogen 2.820 N/A PHE 146.A N TYR 184.A O no hydrogen 3.150 N/A TYR 147.A N PHE 117.A O no hydrogen 2.957 N/A GLU 152.A N GLN 209.A O no hydrogen 2.896 N/A SER 154.A N GLN 207.A O no hydrogen 2.756 N/A TRP 155.A NE1 SER 188.A OG no hydrogen 2.622 N/A TRP 156.A N ARG 205.A O no hydrogen 2.764 N/A TRP 156.A NE1 SER 154.A OG no hydrogen 2.996 N/A VAL 157.A N LYS 160.A O no hydrogen 2.962 N/A ASN 158.A N HIS 203.A O no hydrogen 3.020 N/A ASN 158.A ND2 ASN 202.A OD1 no hydrogen 2.888 N/A LYS 160.A N VAL 157.A O no hydrogen 3.148 N/A VAL 162.A N TRP 155.A O no hydrogen 3.032 N/A VAL 166.A N HIS 163.A O no hydrogen 3.180 N/A CYS 167.A N ARG 189.A O no hydrogen 2.985 N/A THR 168.A OG1 SER 188.A OG no hydrogen 3.212 N/A ASP 169.A N SER 187.A O no hydrogen 2.990 N/A LEU 173.A N ALA 185.A O no hydrogen 2.895 N/A GLU 175.A N ARG 183.A O no hydrogen 2.984 N/A GLN 176.A N SER 182.A OG no hydrogen 3.053 N/A LEU 179.A N GLN 176.A O no hydrogen 3.012 N/A SER 182.A N LEU 179.A O no hydrogen 3.109 N/A SER 182.A OG GLN 176.A O no hydrogen 3.166 N/A SER 182.A OG ARG 183.A O no hydrogen 3.082 N/A ARG 183.A NE GLY 145.A O no hydrogen 2.969 N/A ARG 183.A NH2 GLY 145.A O no hydrogen 3.243 N/A TYR 184.A N PHE 146.A O no hydrogen 2.781 N/A ALA 185.A N LEU 173.A O no hydrogen 2.964 N/A LEU 186.A N ALA 143.A O no hydrogen 2.714 N/A SER 187.A N ASP 169.A OD1 no hydrogen 2.912 N/A SER 187.A OG ASP 169.A OD1 no hydrogen 2.796 N/A SER 187.A OG ASP 169.A OD2 no hydrogen 3.367 N/A SER 188.A N CYS 141.A O no hydrogen 3.008 N/A SER 188.A OG CYS 167.A O no hydrogen 3.509 N/A SER 188.A OG THR 168.A OG1 no hydrogen 3.212 N/A ARG 189.A N CYS 167.A O no hydrogen 2.871 N/A ARG 189.A NH1 ASP 169.A OD2 no hydrogen 2.968 N/A ARG 189.A NH2 ASP 169.A OD2 no hydrogen 3.517 N/A LEU 190.A N LEU 139.A O no hydrogen 2.880 N/A ARG 191.A N GLY 165.A O no hydrogen 2.753 N/A ARG 191.A NE GLU 130.A OE2 no hydrogen 2.986 N/A ARG 191.A NH2 GLU 130.A OE2 no hydrogen 2.949 N/A VAL 192.A N ALA 137.A O no hydrogen 2.963 N/A SER 193.A OG THR 195.A OG1 no hydrogen 3.224 N/A ALA 194.A N GLN 135.A O no hydrogen 2.877 N/A THR 195.A OG1 SER 193.A OG no hydrogen 3.224 N/A TRP 197.A N SER 193.A O no hydrogen 3.033 N/A GLN 198.A N ALA 194.A O no hydrogen 3.050 N/A ARG 201.A N ASN 199.A OD1 no hydrogen 2.864 N/A ASN 202.A N ASN 199.A O no hydrogen 3.130 N/A ASN 202.A ND2 PHE 196.A O no hydrogen 2.729 N/A HIS 203.A N ASN 158.A OD1 no hydrogen 2.883 N/A PHE 204.A N ALA 235.A O no hydrogen 2.848 N/A ARG 205.A N TRP 156.A O no hydrogen 2.713 N/A ARG 205.A NH1 GLN 207.A OE1 no hydrogen 2.695 N/A ARG 205.A NH1 SER 232.A OG no hydrogen 3.084 N/A ARG 205.A NH2 GLN 207.A OE1 no hydrogen 3.562 N/A CYS 206.A N ALA 233.A O no hydrogen 2.758 N/A GLN 207.A N SER 154.A O no hydrogen 2.719 N/A VAL 208.A N VAL 231.A O no hydrogen 2.925 N/A GLN 209.A N GLU 152.A O no hydrogen 2.705 N/A PHE 210.A N GLN 229.A O no hydrogen 2.838 N/A TYR 211.A N HIS 150.A O no hydrogen 2.911 N/A GLY 212.A N THR 228.A OG1 no hydrogen 2.968 N/A LEU 213.A N PRO 226.A O no hydrogen 3.038 N/A ASN 216.A N SER 214.A OG no hydrogen 3.398 N/A ASP 217.A N SER 214.A O no hydrogen 3.020 N/A TRP 219.A NE1 ARG 223.A O no hydrogen 3.104 N/A ASP 222.A N GLN 221.A OE1 no hydrogen 2.554 N/A ARG 223.A NH1 VAL 116.A O no hydrogen 2.803 N/A ARG 223.A NH2 LYS 114.A O no hydrogen 2.954 N/A ARG 223.A NH2 VAL 116.A O no hydrogen 2.900 N/A LYS 225.A NZ SER 214.A O no hydrogen 3.263 N/A LYS 225.A NZ GLU 215.A O no hydrogen 2.849 N/A LYS 225.A NZ ASP 217.A O no hydrogen 2.568 N/A VAL 227.A N LYS 225.A O no hydrogen 2.791 N/A THR 228.A OG1 GLY 212.A O no hydrogen 3.433 N/A GLN 229.A N PHE 210.A O no hydrogen 3.090 N/A GLN 229.A NE2 VAL 227.A O no hydrogen 2.722 N/A VAL 231.A N VAL 208.A O no hydrogen 3.108 N/A ALA 233.A N CYS 206.A O no hydrogen 3.038 N/A ALA 235.A N PHE 204.A O no hydrogen 2.892 N/A GLY 237.A N ASN 202.A O no hydrogen 2.799 N/A ARG 238.A N TRP 197.A O no hydrogen 2.757 N/A