Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1bii_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 1.A N SER 105.A OG no hydrogen 2.630 N/A HIS 3.A N VAL 103.A O no hydrogen 2.993 N/A HIS 3.A ND1 ASP 29.A OD2 no hydrogen 3.104 N/A LEU 5.A N CYS 101.A O no hydrogen 3.133 N/A ARG 6.A N TYR 27.A O no hydrogen 2.979 N/A ARG 6.A NH2 ASP 102.A OD2 no hydrogen 3.099 N/A TYR 7.A N ALA 99.A O no hydrogen 2.653 N/A PHE 8.A N VAL 25.A O no hydrogen 2.800 N/A VAL 9.A N TRP 97.A O no hydrogen 2.895 N/A THR 10.A N MET 23.A O no hydrogen 2.889 N/A ALA 11.A N LEU 95.A O no hydrogen 2.974 N/A VAL 12.A N ARG 21.A O no hydrogen 3.023 N/A SER 13.A N HIS 93.A O no hydrogen 2.881 N/A SER 13.A OG HIS 93.A O no hydrogen 3.315 N/A ARG 14.A NE GLU 19.A O no hydrogen 2.468 N/A ARG 14.A NH1 ASP 39.A OD1 no hydrogen 3.382 N/A ARG 14.A NH1 ASP 39.A OD2 no hydrogen 2.724 N/A ARG 14.A NH2 GLU 19.A O no hydrogen 2.985 N/A ARG 14.A NH2 ASP 39.A OD1 no hydrogen 2.836 N/A PHE 17.A N ARG 14.A O no hydrogen 2.874 N/A GLY 18.A N ARG 14.A O no hydrogen 2.772 N/A ARG 21.A N VAL 12.A O no hydrogen 3.208 N/A ARG 21.A NE ASP 37.A OD1 no hydrogen 3.053 N/A ARG 21.A NH2 ASP 37.A OD1 no hydrogen 3.143 N/A ARG 21.A NH2 ASP 37.A OD2 no hydrogen 2.652 N/A TYR 22.A N SER 38.A OG no hydrogen 3.057 N/A TYR 22.A OH GLU 24.A OE2 no hydrogen 2.660 N/A MET 23.A N THR 10.A O no hydrogen 2.818 N/A GLU 24.A N PHE 36.A O no hydrogen 3.071 N/A VAL 25.A N PHE 8.A O no hydrogen 2.687 N/A GLY 26.A N VAL 34.A O no hydrogen 3.031 N/A TYR 27.A N ARG 6.A O no hydrogen 2.916 N/A VAL 28.A N THR 31.A O no hydrogen 2.967 N/A ASP 29.A N SER 4.A O no hydrogen 3.076 N/A THR 31.A OG1 TYR 209.A OH no hydrogen 2.812 N/A PHE 33.A N GLY 26.A O no hydrogen 3.032 N/A ARG 35.A N GLU 46.A O no hydrogen 3.025 N/A PHE 36.A N GLU 24.A O no hydrogen 2.788 N/A SER 38.A N TYR 22.A O no hydrogen 2.916 N/A SER 38.A OG TYR 22.A O no hydrogen 3.232 N/A SER 38.A OG GLU 71.A OE2 no hydrogen 2.842 N/A ASP 39.A N ASP 37.A OD1 no hydrogen 3.222 N/A ALA 40.A N ASP 37.A O no hydrogen 3.406 N/A ASN 42.A ND2 ASN 42.A O no hydrogen 2.814 N/A TYR 45.A N THR 64.A OG1 no hydrogen 2.833 N/A TYR 45.A OH GLU 24.A OE1 no hydrogen 2.625 N/A GLU 46.A N ARG 35.A O no hydrogen 2.860 N/A ARG 48.A N PHE 33.A O no hydrogen 2.993 N/A ILE 52.A N ALA 49.A O no hydrogen 3.153 N/A GLU 53.A N ARG 50.A O no hydrogen 3.136 N/A TYR 59.A N GLY 56.A O no hydrogen 3.182 N/A TYR 59.A OH TYR 171.A OH no hydrogen 2.588 N/A TRP 60.A NE1 GLU 55.A O no hydrogen 3.185 N/A GLU 61.A N PRO 57.A O no hydrogen 3.074 N/A ARG 62.A N GLU 58.A O no hydrogen 2.892 N/A GLU 63.A N TYR 59.A O no hydrogen 3.206 N/A THR 64.A N TRP 60.A O no hydrogen 3.160 N/A THR 64.A OG1 TRP 60.A O no hydrogen 2.745 N/A ARG 65.A N GLU 61.A O no hydrogen 2.885 N/A ARG 66.A N ARG 62.A O no hydrogen 2.918 N/A ARG 66.A NE GLU 63.A OE1 no hydrogen 3.303 N/A ARG 66.A NE GLU 63.A OE2 no hydrogen 3.353 N/A ARG 66.A NH1 GLU 24.A OE1 no hydrogen 2.849 N/A ARG 66.A NH2 GLU 24.A OE1 no hydrogen 3.048 N/A ARG 66.A NH2 TYR 45.A OH no hydrogen 2.815 N/A ARG 66.A NH2 GLU 63.A OE1 no hydrogen 3.035 N/A ALA 67.A N GLU 63.A O no hydrogen 2.594 N/A LYS 68.A N THR 64.A O no hydrogen 2.756 N/A GLY 69.A N ARG 65.A O no hydrogen 2.710 N/A ASN 70.A N ARG 66.A O no hydrogen 2.911 N/A ASN 70.A ND2 GLU 24.A OE2 no hydrogen 2.692 N/A GLU 71.A N ALA 67.A O no hydrogen 3.019 N/A PHE 74.A N ASN 70.A O no hydrogen 3.145 N/A ARG 75.A N GLU 71.A O no hydrogen 2.960 N/A VAL 76.A N GLN 72.A O no hydrogen 3.170 N/A ASP 77.A N SER 73.A O no hydrogen 2.825 N/A LEU 78.A N PHE 74.A O no hydrogen 2.829 N/A ARG 79.A N ARG 75.A O no hydrogen 3.252 N/A THR 80.A N VAL 76.A O no hydrogen 2.948 N/A THR 80.A OG1 VAL 76.A O no hydrogen 3.541 N/A ALA 81.A N ASP 77.A O no hydrogen 3.009 N/A LEU 82.A N LEU 78.A O no hydrogen 3.134 N/A ARG 83.A N ARG 79.A O no hydrogen 3.313 N/A TYR 84.A N THR 80.A O no hydrogen 2.974 N/A TYR 85.A N ALA 81.A O no hydrogen 2.971 N/A TYR 85.A OH ASP 137.A OD2 no hydrogen 2.508 N/A ASN 86.A N ARG 83.A O no hydrogen 3.186 N/A GLN 87.A N LEU 82.A O no hydrogen 3.269 N/A GLN 87.A NE2 ALA 81.A O no hydrogen 3.587 N/A GLN 87.A NE2 TYR 118.A OH no hydrogen 3.220 N/A GLY 90.A N SER 88.A OG no hydrogen 2.996 N/A SER 92.A OG SER 13.A O no hydrogen 2.582 N/A HIS 93.A N SER 13.A OG no hydrogen 2.588 N/A THR 94.A N ASP 119.A OD1 no hydrogen 2.938 N/A LEU 95.A N ALA 11.A O no hydrogen 2.710 N/A GLN 96.A N ALA 117.A O no hydrogen 2.945 N/A TRP 97.A N VAL 9.A O no hydrogen 2.945 N/A MET 98.A N GLN 115.A O no hydrogen 2.954 N/A ALA 99.A N TYR 7.A O no hydrogen 2.999 N/A GLY 100.A N TYR 113.A O no hydrogen 3.031 N/A CYS 101.A N LEU 5.A O no hydrogen 3.085 N/A ASP 102.A N ARG 111.A O no hydrogen 2.782 N/A VAL 103.A N HIS 3.A O no hydrogen 2.883 N/A GLU 104.A N ARG 108.A O no hydrogen 2.898 N/A SER 105.A OG GLY 1.A O no hydrogen 2.522 N/A ARG 108.A NH1 ASP 106.A OD2 no hydrogen 2.595 N/A LEU 110.A N ASP 102.A O no hydrogen 2.761 N/A ARG 111.A N ASP 102.A O no hydrogen 2.936 N/A TYR 113.A N GLY 100.A O no hydrogen 2.529 N/A GLN 115.A N MET 98.A O no hydrogen 3.007 N/A PHE 116.A N ILE 124.A O no hydrogen 2.956 N/A ALA 117.A N GLN 96.A O no hydrogen 3.033 N/A TYR 118.A N CYS 121.A O no hydrogen 2.819 N/A TYR 118.A OH GLN 87.A OE1 no hydrogen 3.413 N/A ASP 119.A N THR 94.A O no hydrogen 2.581 N/A CYS 121.A N TYR 118.A O no hydrogen 3.278 N/A CYS 121.A SG ASP 119.A O no hydrogen 3.849 N/A TYR 123.A N PHE 116.A O no hydrogen 2.988 N/A TYR 123.A OH THR 143.A OG1 no hydrogen 2.618 N/A ILE 124.A N PHE 116.A O no hydrogen 3.476 N/A ALA 125.A N THR 134.A O no hydrogen 3.065 N/A LEU 126.A N TRP 114.A O no hydrogen 3.086 N/A ASN 127.A N THR 132.A O no hydrogen 3.011 N/A ASN 127.A ND2 THR 134.A OG1 no hydrogen 2.516 N/A LEU 130.A N ASN 127.A O no hydrogen 2.828 N/A THR 132.A N ASP 129.A OD1 no hydrogen 2.951 N/A THR 134.A OG1 TRP 133.A O no hydrogen 2.977 N/A ALA 140.A N ASP 137.A OD1 no hydrogen 2.972 N/A THR 143.A OG1 TYR 123.A OH no hydrogen 2.618 N/A ARG 144.A N ALA 140.A O no hydrogen 2.700 N/A ARG 145.A N GLN 141.A O no hydrogen 2.551 N/A ARG 145.A NE GLN 141.A O no hydrogen 3.047 N/A LYS 146.A N ILE 142.A O no hydrogen 2.857 N/A TRP 147.A N THR 143.A O no hydrogen 2.864 N/A GLU 148.A N ARG 144.A O no hydrogen 2.703 N/A GLN 149.A N ARG 145.A O no hydrogen 3.015 N/A ALA 150.A N LYS 146.A O no hydrogen 3.383 N/A GLY 151.A N TRP 147.A O no hydrogen 3.195 N/A ALA 152.A N TRP 147.A O no hydrogen 3.400 N/A ARG 155.A NE ASP 156.A OD1 no hydrogen 2.850 N/A ASP 156.A N ALA 152.A O no hydrogen 3.245 N/A ARG 157.A N ALA 153.A O no hydrogen 2.537 N/A ARG 157.A NE LEU 130.A O no hydrogen 3.002 N/A ALA 158.A N GLU 154.A O no hydrogen 2.723 N/A ALA 158.A N ARG 155.A O no hydrogen 3.162 N/A TYR 159.A N ARG 155.A O no hydrogen 3.151 N/A LEU 160.A N ASP 156.A O no hydrogen 2.990 N/A GLU 161.A N ARG 157.A O no hydrogen 3.143 N/A GLY 162.A N ALA 158.A O no hydrogen 2.837 N/A CYS 164.A N TYR 159.A O no hydrogen 3.038 N/A CYS 164.A SG LEU 5.A O no hydrogen 3.877 N/A GLU 166.A N GLY 162.A O no hydrogen 3.240 N/A TRP 167.A N GLU 163.A O no hydrogen 2.890 N/A LEU 168.A N CYS 164.A O no hydrogen 2.735 N/A ARG 169.A N VAL 165.A O no hydrogen 2.665 N/A ARG 170.A N GLU 166.A O no hydrogen 2.756 N/A ARG 170.A NE GLU 55.A OE2 no hydrogen 3.320 N/A TYR 171.A N TRP 167.A O no hydrogen 2.662 N/A TYR 171.A OH TYR 59.A OH no hydrogen 2.588 N/A LEU 172.A N LEU 168.A O no hydrogen 2.604 N/A LYS 173.A N ARG 169.A O no hydrogen 3.291 N/A ASN 174.A N ARG 170.A O no hydrogen 2.959 N/A ASN 174.A N TYR 171.A O no hydrogen 3.082 N/A GLY 175.A N LEU 172.A O no hydrogen 3.422 N/A THR 178.A N GLY 175.A O no hydrogen 3.186 N/A LEU 179.A N GLY 175.A O no hydrogen 2.711 N/A ARG 181.A NE THR 178.A O no hydrogen 2.919 N/A ARG 181.A NH1 ASP 183.A OD2 no hydrogen 2.866 N/A ARG 181.A NH2 GLY 239.A O no hydrogen 3.461 N/A ASP 183.A N TYR 209.A O no hydrogen 2.681 N/A LYS 186.A N LEU 206.A O no hydrogen 2.693 N/A HIS 188.A N TRP 204.A O no hydrogen 3.140 N/A THR 190.A N ARG 202.A O no hydrogen 2.744 N/A THR 190.A OG1 HIS 192.A NE2 no hydrogen 2.851 N/A HIS 192.A N THR 200.A O no hydrogen 2.779 N/A HIS 192.A NE2 THR 190.A OG1 no hydrogen 2.851 N/A ARG 194.A N ASP 198.A O no hydrogen 2.701 N/A ARG 194.A NE ASP 198.A OD1 no hydrogen 2.830 N/A ARG 194.A NH2 ASP 198.A OD1 no hydrogen 2.837 N/A GLU 196.A N GLU 196.A OE1 no hydrogen 2.684 N/A GLY 197.A N ARG 194.A O no hydrogen 3.055 N/A VAL 199.A N VAL 249.A O no hydrogen 2.857 N/A THR 200.A N HIS 192.A O no hydrogen 3.065 N/A THR 200.A OG1 HIS 192.A O no hydrogen 2.632 N/A LEU 201.A N VAL 247.A O no hydrogen 2.845 N/A ARG 202.A N THR 190.A O no hydrogen 2.995 N/A CYS 203.A N ALA 245.A O no hydrogen 2.725 N/A TRP 204.A N HIS 188.A O no hydrogen 2.813 N/A ALA 205.A N LYS 243.A O no hydrogen 2.894 N/A LEU 206.A N LYS 186.A O no hydrogen 2.879 N/A PHE 208.A N PHE 241.A O no hydrogen 3.375 N/A TYR 209.A N ASP 183.A O no hydrogen 2.928 N/A TYR 209.A OH THR 31.A OG1 no hydrogen 2.812 N/A ALA 211.A N ASN 30.A OD1 no hydrogen 3.078 N/A THR 214.A N GLU 262.A O no hydrogen 2.983 N/A THR 216.A N HIS 260.A O no hydrogen 3.011 N/A THR 216.A OG1 GLN 218.A OE1 no hydrogen 3.524 N/A TRP 217.A NE1 ALA 245.A O no hydrogen 3.015 N/A GLN 218.A N THR 258.A O no hydrogen 2.751 N/A LEU 219.A N GLU 222.A O no hydrogen 3.048 N/A LEU 224.A N TRP 217.A O no hydrogen 3.388 N/A THR 225.A OG1 GLU 223.A OE2 no hydrogen 3.208 N/A MET 228.A N THR 225.A O no hydrogen 3.223 N/A GLU 229.A N SER 246.A O no hydrogen 2.895 N/A VAL 231.A N TRP 244.A O no hydrogen 3.141 N/A ARG 234.A N GLN 242.A O no hydrogen 2.887 N/A ARG 234.A NE GLN 242.A OE1 no hydrogen 2.987 N/A ARG 234.A NH2 GLN 242.A OE1 no hydrogen 3.059 N/A ALA 236.A N THR 240.A O no hydrogen 3.231 N/A THR 240.A N ASP 238.A OD1 no hydrogen 2.867 N/A THR 240.A OG1 ASP 238.A OD1 no hydrogen 2.969 N/A PHE 241.A N PHE 208.A O no hydrogen 2.769 N/A GLN 242.A N ARG 234.A O no hydrogen 2.808 N/A LYS 243.A N ALA 205.A O no hydrogen 2.896 N/A LYS 243.A NZ VAL 231.A O no hydrogen 2.709 N/A LYS 243.A NZ THR 233.A OG1 no hydrogen 2.755 N/A ALA 245.A N CYS 203.A O no hydrogen 2.887 N/A SER 246.A N GLU 229.A O no hydrogen 2.469 N/A SER 246.A OG GLU 229.A O no hydrogen 3.324 N/A VAL 247.A N LEU 201.A O no hydrogen 2.972 N/A VAL 249.A N VAL 199.A O no hydrogen 2.675 N/A GLY 252.A N GLU 254.A OE1 no hydrogen 2.841 N/A LYS 253.A N PRO 250.A O no hydrogen 3.117 N/A GLU 254.A N GLU 254.A OE1 no hydrogen 2.762 N/A TYR 257.A N GLU 254.A O no hydrogen 2.730 N/A TYR 257.A OH GLU 227.A OE2 no hydrogen 3.315 N/A THR 258.A N GLN 218.A O no hydrogen 3.046 N/A CYS 259.A N LEU 272.A O no hydrogen 2.844 N/A CYS 259.A SG THR 216.A O no hydrogen 3.985 N/A CYS 259.A SG HIS 260.A O no hydrogen 3.880 N/A HIS 260.A N THR 216.A O no hydrogen 2.770 N/A HIS 260.A ND1 GLU 262.A OE2 no hydrogen 2.996 N/A VAL 261.A N LEU 270.A O no hydrogen 2.816 N/A GLU 262.A N THR 214.A O no hydrogen 2.948 N/A HIS 263.A NE2 TYR 209.A O no hydrogen 3.296 N/A LEU 266.A N HIS 263.A O no hydrogen 2.831 N/A LEU 270.A N VAL 261.A O no hydrogen 2.891 N/A LEU 272.A N CYS 259.A O no hydrogen 2.745 N/A