Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3iah_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 2.A OH ASP 223.A OD2 no hydrogen 2.681 N/A GLN 6.A NE2 ARG 33.A O no hydrogen 2.803 N/A LEU 8.A N LYS 5.A O no hydrogen 3.111 N/A LEU 9.A N TYR 34.A O no hydrogen 2.779 N/A GLN 10.A N ASP 7.A O no hydrogen 3.177 N/A ARG 12.A N LEU 9.A O no hydrogen 3.082 N/A ARG 12.A NH1 ASP 222.A OD1 no hydrogen 2.698 N/A ARG 12.A NH1 ASP 222.A OD2 no hydrogen 3.035 N/A ARG 12.A NH2 ASP 222.A OD1 no hydrogen 2.939 N/A ILE 13.A N ASP 93.A OD2 no hydrogen 2.825 N/A ILE 14.A N THR 37.A O no hydrogen 2.941 N/A LEU 15.A N GLY 94.A O no hydrogen 2.900 N/A VAL 16.A N ILE 39.A O no hydrogen 2.906 N/A THR 17.A N LEU 96.A O no hydrogen 3.037 N/A THR 17.A OG1 LEU 96.A O no hydrogen 3.402 N/A ALA 19.A N LEU 41.A O no hydrogen 3.064 N/A GLY 22.A N ASP 21.A OD1 no hydrogen 2.731 N/A ARG 25.A N.A ASP 21.A O no hydrogen 3.159 N/A ARG 25.A N.B ASP 21.A O no hydrogen 3.156 N/A GLU 26.A N GLY 22.A O no hydrogen 3.196 N/A ALA 27.A N ILE 23.A O no hydrogen 2.813 N/A ALA 28.A N GLY 24.A O no hydrogen 2.875 N/A LEU 29.A N ARG 25.A O.A no hydrogen 3.029 N/A LEU 29.A N ARG 25.A O.B no hydrogen 3.054 N/A THR 30.A N GLU 26.A O no hydrogen 2.831 N/A THR 30.A OG1 GLU 26.A O no hydrogen 2.752 N/A TYR 31.A N ALA 27.A O no hydrogen 2.791 N/A TYR 31.A OH TYR 217.A O no hydrogen 2.846 N/A ALA 32.A N ALA 28.A O no hydrogen 3.104 N/A ARG 33.A N LEU 29.A O no hydrogen 3.050 N/A ARG 33.A NE GLU 58.A OE1 no hydrogen 2.842 N/A ARG 33.A NH2 GLU 58.A OE1 no hydrogen 3.568 N/A ARG 33.A NH2 GLU 58.A OE2 no hydrogen 2.779 N/A TYR 34.A N THR 30.A O no hydrogen 3.058 N/A TYR 34.A N TYR 31.A O no hydrogen 3.130 N/A GLY 35.A N ALA 32.A O no hydrogen 3.093 N/A ALA 36.A N TYR 31.A O no hydrogen 3.010 N/A THR 37.A N ARG 12.A O no hydrogen 2.847 N/A ILE 39.A N ILE 14.A O no hydrogen 2.872 N/A LEU 40.A N.A GLN 64.A O no hydrogen 2.958 N/A LEU 40.A N.B GLN 64.A O no hydrogen 2.983 N/A LEU 41.A N VAL 16.A O no hydrogen 2.885 N/A GLY 42.A N PHE 66.A O no hydrogen 3.351 N/A LYS 47.A N ASN 44.A OD1 no hydrogen 3.185 N/A LYS 47.A NZ ASP 21.A OD2 no hydrogen 3.524 N/A LEU 48.A N ASN 44.A O no hydrogen 2.962 N/A ARG 49.A N GLU 45.A O no hydrogen 2.908 N/A ARG 49.A NE GLU 46.A OE2 no hydrogen 3.555 N/A ARG 50.A N GLU 46.A O no hydrogen 3.085 N/A VAL 51.A N LYS 47.A O no hydrogen 3.155 N/A ALA 52.A N LEU 48.A O no hydrogen 2.972 N/A GLN 53.A N.A ARG 49.A O no hydrogen 2.900 N/A GLN 53.A N.B ARG 49.A O no hydrogen 2.896 N/A HIS 54.A N ARG 50.A O no hydrogen 2.979 N/A ILE 55.A N VAL 51.A O no hydrogen 3.069 N/A ALA 56.A N ALA 52.A O no hydrogen 2.836 N/A ASP 57.A N GLN 53.A O.A no hydrogen 2.846 N/A ASP 57.A N GLN 53.A O.B no hydrogen 2.856 N/A GLU 58.A N ILE 55.A O no hydrogen 3.167 N/A GLN 59.A N ILE 55.A O no hydrogen 2.773 N/A HIS 60.A N ALA 56.A O no hydrogen 2.749 N/A PHE 66.A N LEU 40.A O.A no hydrogen 2.791 N/A PHE 66.A N LEU 40.A O.B no hydrogen 2.830 N/A LEU 68.A N GLY 42.A O no hydrogen 2.856 N/A LEU 71.A N ASP 69.A OD2 no hydrogen 2.894 N/A THR 72.A N ASP 69.A O no hydrogen 3.287 N/A THR 72.A OG1 ASP 69.A O no hydrogen 3.524 N/A CYS 73.A N ASP 69.A O no hydrogen 2.897 N/A CYS 73.A SG LEU 70.A O no hydrogen 4.017 N/A GLU 77.A N THR 74.A OG1 no hydrogen 3.155 N/A CYS 78.A N THR 74.A O no hydrogen 3.183 N/A CYS 78.A SG THR 74.A O no hydrogen 3.713 N/A ARG 79.A N ALA 75.A O no hydrogen 3.093 N/A ARG 79.A NH1 ASP 83.A OD2 no hydrogen 3.046 N/A GLN 80.A N.A GLU 76.A O no hydrogen 2.891 N/A GLN 80.A N.B GLU 76.A O no hydrogen 2.887 N/A VAL 81.A N GLU 77.A O no hydrogen 3.196 N/A ALA 82.A N CYS 78.A O no hydrogen 2.953 N/A ASP 83.A N ARG 79.A O no hydrogen 2.763 N/A ARG 84.A N GLN 80.A O.A no hydrogen 2.884 N/A ARG 84.A N GLN 80.A O.B no hydrogen 2.897 N/A ILE 85.A N VAL 81.A O no hydrogen 2.868 N/A ALA 86.A N ALA 82.A O no hydrogen 2.845 N/A ALA 87.A N ASP 83.A O no hydrogen 3.048 N/A HIS 88.A N ILE 85.A O no hydrogen 2.947 N/A TYR 89.A N ILE 85.A O no hydrogen 2.773 N/A ARG 91.A NE ASP 93.A OD1 no hydrogen 3.137 N/A ARG 91.A NE ASP 93.A OD2 no hydrogen 2.951 N/A ARG 91.A NH2 ASN 11.A O.A no hydrogen 2.885 N/A ARG 91.A NH2 ASN 11.A O.B no hydrogen 2.825 N/A ARG 91.A NH2 ASN 11.A OD1.B no hydrogen 2.758 N/A ARG 91.A NH2 ASP 93.A OD2 no hydrogen 3.562 N/A LEU 92.A N LEU 134.A O no hydrogen 3.048 N/A ASP 93.A N ILE 13.A O no hydrogen 2.750 N/A GLY 94.A N ILE 13.A O no hydrogen 3.116 N/A VAL 95.A N SER 142.A O no hydrogen 2.978 N/A LEU 96.A N LEU 15.A O no hydrogen 2.829 N/A HIS 97.A N VAL 144.A O no hydrogen 2.735 N/A ASN 98.A N THR 17.A OG1 no hydrogen 2.838 N/A ASN 98.A ND2 THR 17.A O no hydrogen 3.151 N/A ALA 99.A N THR 17.A OG1 no hydrogen 3.022 N/A LEU 101.A N ASN 121.A OD1 no hydrogen 2.853 N/A GLY 106.A N ASN 157.A O no hydrogen 3.040 N/A GLU 109.A N PRO 107.A O no hydrogen 2.882 N/A GLN 110.A NE2 GLU 104.A O no hydrogen 3.347 N/A GLN 110.A NE2 GLY 106.A O no hydrogen 2.967 N/A GLN 113.A N ASP 111.A OD2 no hydrogen 2.763 N/A GLN 113.A NE2 ASP 117.A OD1 no hydrogen 2.905 N/A ILE 114.A N ASP 111.A OD2 no hydrogen 3.441 N/A TRP 115.A N ASP 111.A O no hydrogen 2.902 N/A GLN 116.A N PRO 112.A O no hydrogen 3.074 N/A ASP 117.A N GLN 113.A O no hydrogen 2.905 N/A VAL 118.A N ILE 114.A O no hydrogen 2.929 N/A VAL 120.A N ASP 117.A O no hydrogen 3.043 N/A ASN 121.A N VAL 118.A O no hydrogen 2.944 N/A ASN 121.A ND2 LEU 101.A O no hydrogen 3.049 N/A ASN 121.A ND2 SER 164.A OG no hydrogen 2.933 N/A ASN 123.A ND2 GLN 119.A OE1 no hydrogen 2.896 N/A ALA 124.A N GLN 119.A O no hydrogen 2.742 N/A THR 125.A OG1 VAL 120.A O no hydrogen 2.840 N/A THR 125.A OG1 ASN 121.A O no hydrogen 3.312 N/A PHE 126.A N VAL 122.A O no hydrogen 2.852 N/A THR 128.A N THR 125.A O no hydrogen 3.045 N/A THR 128.A OG1 HIS 97.A NE2 no hydrogen 2.795 N/A THR 128.A OG1 THR 125.A O no hydrogen 2.703 N/A GLN 129.A N PHE 126.A O no hydrogen 2.896 N/A LEU 131.A N LEU 127.A O no hydrogen 2.932 N/A LEU 132.A N GLN 129.A O no hydrogen 3.455 N/A LEU 135.A N LEU 131.A O no hydrogen 3.008 N/A LEU 136.A N.A LEU 132.A O no hydrogen 2.901 N/A LEU 136.A N.B LEU 132.A O no hydrogen 2.903 N/A LYS 137.A N LEU 134.A O no hydrogen 3.141 N/A SER 138.A N LEU 135.A O no hydrogen 3.221 N/A SER 138.A OG ASP 93.A OD1 no hydrogen 2.757 N/A SER 138.A OG ASP 139.A OD1.B no hydrogen 3.373 N/A ALA 140.A N SER 138.A OG no hydrogen 3.177 N/A SER 142.A N ASP 93.A O no hydrogen 2.940 N/A SER 142.A OG LEU 220.A O no hydrogen 2.669 N/A LEU 143.A N ARG 183.A O no hydrogen 2.880 N/A VAL 144.A N VAL 95.A O no hydrogen 2.835 N/A PHE 145.A N ASN 185.A O no hydrogen 2.952 N/A THR 146.A OG1 HIS 97.A O no hydrogen 2.769 N/A SER 147.A N ILE 187.A O no hydrogen 2.887 N/A SER 147.A OG SER 148.A O no hydrogen 3.434 N/A SER 147.A OG GLU 169.A OE2 no hydrogen 2.907 N/A GLY 151.A N SER 148.A O no hydrogen 2.907 N/A ARG 152.A N SER 149.A O no hydrogen 3.122 N/A ARG 152.A NE GLU 169.A OE2 no hydrogen 2.898 N/A ARG 152.A NE THR 230.A OG1 no hydrogen 3.410 N/A ARG 152.A NH1 ASP 232.A OD2 no hydrogen 2.727 N/A ARG 152.A NH2 THR 230.A OG1 no hydrogen 2.644 N/A ARG 152.A NH2 ASP 232.A OD2 no hydrogen 2.977 N/A GLN 153.A N SER 149.A O no hydrogen 3.236 N/A GLN 153.A NE2 GLY 154.A O no hydrogen 3.490 N/A ARG 155.A NH1 SER 149.A OG no hydrogen 3.020 N/A TRP 158.A N ARG 155.A O no hydrogen 3.342 N/A ALA 160.A N GLN 110.A OE1 no hydrogen 3.365 N/A ALA 162.A N TRP 158.A O no hydrogen 2.950 N/A THR 163.A N GLY 159.A O no hydrogen 3.121 N/A THR 163.A OG1 GLY 159.A O no hydrogen 2.921 N/A SER 164.A N ALA 160.A O no hydrogen 2.766 N/A SER 164.A OG ALA 160.A O no hydrogen 3.502 N/A SER 164.A OG TYR 161.A O no hydrogen 2.719 N/A LYS 165.A N TYR 161.A O no hydrogen 2.942 N/A LYS 165.A NZ THR 146.A O no hydrogen 2.825 N/A PHE 166.A N ALA 162.A O no hydrogen 2.989 N/A ALA 167.A N THR 163.A O no hydrogen 3.062 N/A THR 168.A N SER 164.A O no hydrogen 2.922 N/A THR 168.A OG1 SER 164.A O no hydrogen 2.801 N/A GLU 169.A N LYS 165.A O no hydrogen 3.100 N/A GLY 170.A N PHE 166.A O no hydrogen 3.015 N/A VAL 172.A N GLY 170.A O no hydrogen 2.958 N/A ASP 175.A N GLN 171.A O no hydrogen 3.051 N/A GLU 176.A N VAL 172.A O no hydrogen 2.964 N/A TYR 177.A N LEU 173.A O no hydrogen 3.037 N/A GLN 178.A NE2 ASP 175.A O no hydrogen 3.314 N/A ARG 180.A N TYR 177.A O no hydrogen 2.954 N/A ARG 183.A N GLY 141.A O no hydrogen 2.957 N/A ARG 183.A NE SER 224.A OG no hydrogen 3.233 N/A ARG 183.A NH1 LEU 220.A O no hydrogen 3.303 N/A ARG 183.A NH1 SER 224.A OG no hydrogen 3.209 N/A ARG 183.A NH2 ALA 140.A O no hydrogen 3.202 N/A VAL 184.A N THR 228.A OG1 no hydrogen 2.968 N/A ASN 185.A N LEU 143.A O no hydrogen 3.038 N/A ASN 185.A ND2 LYS 227.A O no hydrogen 3.063 N/A CYS 186.A SG GLU 169.A OE1 no hydrogen 3.448 N/A ILE 187.A N PHE 145.A O no hydrogen 2.934 N/A ASN 188.A N PHE 231.A O no hydrogen 2.728 N/A ASN 188.A ND2 ASP 232.A OD2 no hydrogen 3.202 N/A GLY 190.A N ASN 188.A OD1 no hydrogen 3.160 N/A THR 192.A OG1 GLY 190.A O no hydrogen 2.879 N/A ARG 193.A N LYS 209.A O no hydrogen 2.974 N/A ARG 193.A NE PRO 205.A O no hydrogen 2.873 N/A ARG 193.A NH2 PRO 205.A O no hydrogen 3.520 N/A ARG 193.A NH2 LEU 208.A O no hydrogen 2.868 N/A ARG 196.A NE GLU 203.A OE1 no hydrogen 2.891 N/A ARG 196.A NH2 GLU 203.A OE2 no hydrogen 2.903 N/A ARG 196.A NH2 GLY 240.A O no hydrogen 2.931 N/A ALA 197.A N THR 194.A O no hydrogen 3.172 N/A SER 198.A N.A SER 195.A O no hydrogen 2.936 N/A SER 198.A N.B SER 195.A O no hydrogen 2.943 N/A SER 198.A OG.B SER 195.A O no hydrogen 3.306 N/A PHE 200.A N ARG 196.A O no hydrogen 2.932 N/A GLU 203.A N PHE 200.A O no hydrogen 3.067 N/A GLN 206.A N ASP 204.A OD1 no hydrogen 2.936 N/A LYS 207.A N ASP 204.A O no hydrogen 3.040 N/A LYS 207.A NZ GLN 243.A OXT no hydrogen 2.743 N/A LEU 208.A N PRO 205.A O no hydrogen 3.029 N/A THR 210.A N ASP 213.A OD2 no hydrogen 2.924 N/A ASP 213.A N THR 210.A OG1 no hydrogen 3.295 N/A ILE 214.A N PRO 211.A O no hydrogen 3.257 N/A TRP 219.A N PRO 215.A O no hydrogen 2.991 N/A LEU 220.A N LEU 216.A O no hydrogen 3.034 N/A SER 224.A N GLY 221.A O no hydrogen 3.431 N/A SER 224.A OG TRP 219.A O no hydrogen 2.833 N/A SER 224.A OG LEU 220.A O no hydrogen 3.173 N/A SER 224.A OG GLY 221.A O no hydrogen 3.174 N/A ARG 225.A N.A ASP 222.A O no hydrogen 3.334 N/A ARG 225.A N.B ASP 222.A O no hydrogen 3.332 N/A ARG 225.A NH2.B ASP 139.A OD2.B no hydrogen 2.746 N/A LYS 227.A N SER 224.A O no hydrogen 3.089 N/A THR 228.A OG1 VAL 184.A O no hydrogen 3.355 N/A GLY 229.A N VAL 184.A O no hydrogen 2.689 N/A THR 230.A OG1 GLU 169.A OE1 no hydrogen 3.314 N/A THR 230.A OG1 GLU 169.A OE2 no hydrogen 2.694 N/A PHE 231.A N CYS 186.A O no hydrogen 2.830 N/A ALA 233.A N ASN 188.A O no hydrogen 2.975 N/A GLN 234.A NE2 PRO 189.A O no hydrogen 2.887 N/A GLN 234.A NE2 GLY 191.A O no hydrogen 2.973 N/A ARG 237.A N GLN 234.A O no hydrogen 3.225 N/A ARG 237.A NH1 GLY 240.A O no hydrogen 3.036 N/A ARG 237.A NH2 GLY 240.A O no hydrogen 3.089 N/A ALA 242.A N GLU 203.A OE2 no hydrogen 2.734 N/A