Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1iao_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 17.A N ASN 42.A OD1 no hydrogen 2.973 N/A GLN 19.A N ILE 40.A O no hydrogen 2.700 N/A GLN 19.A NE2 ASN 42.A O no hydrogen 2.971 N/A LYS 21.A N ARG 38.A O no hydrogen 2.779 N/A GLU 23.A N VAL 36.A O no hydrogen 2.782 N/A CYS 24.A SG GLU 23.A O no hydrogen 3.841 N/A CYS 24.A SG ARG 34.A O no hydrogen 3.404 N/A TYR 25.A N ARG 34.A O no hydrogen 2.863 N/A TYR 25.A OH GLU 23.A OE1 no hydrogen 2.746 N/A TYR 26.A OH CYS 88.A O no hydrogen 3.328 N/A THR 27.A N ARG 32.A O no hydrogen 2.898 N/A THR 27.A OG1 ARG 32.A O no hydrogen 3.311 N/A ASN 28.A ND2 GLN 31.A OE1 no hydrogen 2.673 N/A GLN 31.A N ASN 28.A O no hydrogen 2.912 N/A ARG 32.A N THR 27.A O no hydrogen 3.142 N/A ARG 34.A N TYR 25.A O no hydrogen 2.936 N/A ARG 34.A NE ASP 50.A OD1 no hydrogen 3.048 N/A ARG 34.A NH2 ASP 50.A OD2 no hydrogen 2.453 N/A LEU 35.A N SER 51.A OG no hydrogen 2.879 N/A VAL 36.A N GLU 23.A O no hydrogen 2.730 N/A THR 37.A N TYR 49.A O no hydrogen 2.941 N/A ARG 38.A N LYS 21.A O no hydrogen 2.867 N/A ARG 38.A NE GLU 23.A OE1 no hydrogen 2.746 N/A ARG 38.A NH1 GLU 45.A OE1 no hydrogen 2.865 N/A ARG 38.A NH1 GLU 45.A OE2 no hydrogen 3.324 N/A TYR 39.A N VAL 47.A O no hydrogen 3.057 N/A ILE 40.A N GLN 19.A O no hydrogen 2.603 N/A TYR 41.A N GLU 44.A O no hydrogen 2.916 N/A ASN 42.A N VAL 17.A O no hydrogen 2.578 N/A GLU 44.A N TYR 41.A O no hydrogen 3.091 N/A TYR 46.A N TYR 39.A O no hydrogen 2.878 N/A ARG 48.A N ARG 57.A O no hydrogen 2.946 N/A ARG 48.A NE GLU 45.A OE2 no hydrogen 2.696 N/A ARG 48.A NH2 GLU 45.A OE1 no hydrogen 3.083 N/A ARG 48.A NH2 GLU 45.A OE2 no hydrogen 3.568 N/A TYR 49.A N THR 37.A O no hydrogen 3.026 N/A TYR 49.A OH GLY 54.A O no hydrogen 3.234 N/A SER 51.A N LEU 35.A O no hydrogen 2.877 N/A ASP 52.A N ASP 50.A OD1 no hydrogen 2.915 N/A VAL 53.A N ASP 50.A O no hydrogen 2.869 N/A GLY 54.A N ASP 50.A O no hydrogen 2.665 N/A TYR 56.A N ASN 71.A OD1 no hydrogen 3.011 N/A TYR 56.A OH THR 80.A OG1 no hydrogen 2.734 N/A ARG 57.A N ARG 48.A O no hydrogen 2.782 N/A ARG 57.A NE GLU 55.A OE2 no hydrogen 2.780 N/A ARG 57.A NH2 GLU 55.A OE2 no hydrogen 3.018 N/A VAL 59.A N TYR 46.A O no hydrogen 2.752 N/A THR 60.A N TYR 46.A O no hydrogen 3.352 N/A THR 60.A OG1 GLU 44.A OE2 no hydrogen 2.454 N/A GLY 63.A N THR 60.A O no hydrogen 2.938 N/A ARG 64.A N GLU 61.A O no hydrogen 2.962 N/A ALA 67.A N GLY 63.A O no hydrogen 3.211 N/A GLU 68.A N ARG 64.A O no hydrogen 3.406 N/A TYR 69.A N PRO 65.A O no hydrogen 2.957 N/A TRP 70.A N ASP 66.A O no hydrogen 2.916 N/A TRP 70.A NE1 HIS 11P.A O no hydrogen 2.675 N/A ASN 71.A N ALA 67.A O no hydrogen 3.013 N/A ASN 71.A ND2 TYR 56.A O no hydrogen 2.934 N/A SER 72.A N TYR 69.A O no hydrogen 2.870 N/A SER 72.A OG GLU 68.A O no hydrogen 2.810 N/A SER 72.A OG TYR 69.A O no hydrogen 2.358 N/A GLN 73.A N TRP 70.A O no hydrogen 3.219 N/A GLU 75.A N GLU 75.A OE1 no hydrogen 2.892 N/A LEU 77.A N GLN 73.A O no hydrogen 2.926 N/A ASP 78.A N PRO 74.A O no hydrogen 2.963 N/A ARG 79.A N GLU 75.A O no hydrogen 3.007 N/A ARG 79.A N ILE 76.A O no hydrogen 3.031 N/A THR 80.A N ILE 76.A O no hydrogen 2.994 N/A THR 80.A OG1 TYR 56.A OH no hydrogen 2.734 N/A THR 80.A OG1 ILE 76.A O no hydrogen 3.031 N/A ARG 81.A N LEU 77.A O no hydrogen 3.213 N/A ARG 81.A NE GLY 54.A O no hydrogen 3.045 N/A GLU 83.A N THR 80.A O no hydrogen 2.874 N/A ASP 85.A N ALA 82.A O no hydrogen 2.882 N/A THR 86.A N ALA 82.A O no hydrogen 2.874 N/A THR 86.A OG1 ALA 82.A O no hydrogen 2.629 N/A ALA 87.A N GLU 83.A O no hydrogen 3.069 N/A CYS 88.A SG GLU 83.A O no hydrogen 3.902 N/A ARG 89.A N VAL 84.A O no hydrogen 2.933 N/A ARG 89.A NE ASP 85.A OD1 no hydrogen 3.210 N/A HIS 90.A N ASP 85.A O no hydrogen 3.129 N/A HIS 90.A NE2 ILE 3P.A O no hydrogen 2.672 N/A ASN 91.A N ALA 87.A O no hydrogen 2.801 N/A ASN 91.A ND2 GLN 5P.A O no hydrogen 2.458 N/A TYR 92.A N CYS 88.A O no hydrogen 2.727 N/A GLU 93.A N ARG 89.A O no hydrogen 3.058 N/A GLY 94.A N HIS 90.A O no hydrogen 2.740 N/A GLU 96.A N ASN 91.A O no hydrogen 2.887 N/A THR 97.A OG1 TYR 92.A O no hydrogen 2.880 N/A THR 97.A OG1 GLU 93.A O no hydrogen 3.285 N/A SER 98.A N PRO 95.A O no hydrogen 3.002 N/A SER 98.A OG GLY 94.A O no hydrogen 2.930 N/A SER 98.A OG PRO 95.A O no hydrogen 3.362 N/A THR 99.A N GLU 96.A O no hydrogen 3.234 N/A THR 99.A OG1 SER 98.A O no hydrogen 3.163 N/A SER 100.A OG GLU 96.A OE1 no hydrogen 2.970 N/A LEU 101.A N GLU 96.A O no hydrogen 2.968 N/A ARG 103.A N SER 100.A O no hydrogen 3.258 N/A ARG 103.A NH1 TRP 163.A O no hydrogen 2.758 N/A ARG 103.A NH2 TRP 163.A O no hydrogen 3.022 N/A GLU 105.A N TYR 133.A O no hydrogen 2.528 N/A ASN 108.A N THR 130.A O no hydrogen 2.887 N/A SER 112.A N VAL 126.A O no hydrogen 3.026 N/A GLU 117.A N SER 114.A O no hydrogen 3.277 N/A THR 124.A OG1 HIS 122.A O no hydrogen 3.448 N/A LEU 125.A N LEU 171.A O no hydrogen 2.824 N/A VAL 126.A N SER 112.A O no hydrogen 3.317 N/A CYS 127.A N VAL 169.A O no hydrogen 3.015 N/A SER 128.A N ALA 110.A O no hydrogen 2.862 N/A VAL 129.A N VAL 167.A O no hydrogen 2.952 N/A PHE 132.A N PHE 165.A O no hydrogen 3.343 N/A TYR 133.A N GLU 105.A O no hydrogen 3.402 N/A TYR 133.A OH SER 100.A O no hydrogen 3.141 N/A LYS 138.A N GLU 186.A O no hydrogen 2.984 N/A ARG 140.A N HIS 184.A O no hydrogen 2.724 N/A TRP 141.A NE1 VAL 169.A O no hydrogen 3.114 N/A PHE 142.A N THR 182.A O no hydrogen 2.903 N/A ARG 143.A N GLN 146.A O no hydrogen 2.567 N/A ARG 143.A NE GLN 146.A OE1 no hydrogen 2.683 N/A ASN 144.A N VAL 180.A O no hydrogen 2.823 N/A GLN 146.A N ARG 143.A O no hydrogen 2.742 N/A GLU 148.A N TRP 141.A O no hydrogen 2.639 N/A SER 153.A N MET 170.A O no hydrogen 2.987 N/A SER 154.A OG THR 155.A O no hydrogen 3.412 N/A THR 155.A N LEU 168.A O no hydrogen 3.005 N/A THR 155.A OG1 GLN 156.A O no hydrogen 2.640 N/A ILE 158.A N GLN 166.A O no hydrogen 3.217 N/A ASN 160.A N THR 164.A O no hydrogen 2.875 N/A ASN 160.A ND2 THR 164.A OG1 no hydrogen 2.780 N/A THR 164.A OG1 ASP 162.A OD1 no hydrogen 2.353 N/A PHE 165.A N PHE 132.A O no hydrogen 2.822 N/A GLN 166.A N ILE 158.A O no hydrogen 2.995 N/A GLN 166.A NE2 ASN 160.A OD1 no hydrogen 3.168 N/A VAL 167.A N VAL 129.A O no hydrogen 2.658 N/A VAL 169.A N CYS 127.A O no hydrogen 3.024 N/A MET 170.A N SER 153.A O no hydrogen 2.620 N/A LEU 171.A N LEU 125.A O no hydrogen 2.853 N/A GLU 172.A N GLY 151.A O no hydrogen 3.225 N/A MET 173.A N ASN 123.A O no hydrogen 2.652 N/A TYR 181.A N TRP 198.A O no hydrogen 2.773 N/A THR 182.A N PHE 142.A O no hydrogen 3.115 N/A THR 182.A OG1 GLU 197.A OE2 no hydrogen 3.090 N/A CYS 183.A N VAL 196.A O no hydrogen 2.968 N/A HIS 184.A N ARG 140.A O no hydrogen 2.784 N/A VAL 185.A N ILE 194.A O no hydrogen 3.117 N/A GLU 186.A N LYS 138.A O no hydrogen 2.626 N/A HIS 187.A ND1 SER 189.A OG no hydrogen 3.236 N/A HIS 187.A NE2 PRO 134.A O no hydrogen 2.563 N/A SER 189.A N HIS 187.A ND1 no hydrogen 3.423 N/A SER 189.A OG HIS 187.A ND1 no hydrogen 3.236 N/A LEU 190.A N HIS 187.A O no hydrogen 2.681 N/A THR 195.A OG1 GLU 197.A OE2 no hydrogen 2.776 N/A VAL 196.A N CYS 183.A O no hydrogen 3.367 N/A GLN 5P.A N ASN 91.A OD1 no hydrogen 2.634 N/A HIS 8P.A N GLU 83.A OE2 no hydrogen 3.206 N/A ALA 10P.A N TYR 39.A OH no hydrogen 3.072 N/A SER 200T.A OG GLN 177.A O no hydrogen 2.793 N/A SER 200T.A OG GLU 179.A O no hydrogen 3.565 N/A