Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1ib1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 4.A N ASP 1.A OD1 no hydrogen 3.026 N/A LEU 5.A N ASP 1.A O no hydrogen 3.167 N/A VAL 6.A N LYS 2.A O no hydrogen 3.159 N/A GLN 7.A N ASN 3.A O no hydrogen 2.759 N/A LYS 8.A N GLU 4.A O no hydrogen 2.766 N/A ALA 9.A N LEU 5.A O no hydrogen 2.835 N/A LYS 10.A N VAL 6.A O no hydrogen 2.852 N/A LYS 10.A NZ GLU 38.A OE2 no hydrogen 3.210 N/A LEU 11.A N GLN 7.A O no hydrogen 3.112 N/A ALA 12.A N LYS 8.A O no hydrogen 2.789 N/A GLU 13.A N ALA 9.A O no hydrogen 3.126 N/A GLN 14.A NE2 LYS 10.A O no hydrogen 3.382 N/A ALA 15.A N LEU 11.A O no hydrogen 2.908 N/A GLU 16.A N GLU 13.A O no hydrogen 3.226 N/A ARG 17.A N ALA 12.A O no hydrogen 2.795 N/A ARG 17.A NE ASP 20.A OD2 no hydrogen 3.171 N/A ARG 17.A NH2 ASP 20.A OD2 no hydrogen 3.299 N/A ASP 20.A N ARG 17.A O no hydrogen 3.014 N/A MET 21.A N ARG 17.A O no hydrogen 3.203 N/A ALA 22.A N TYR 18.A O no hydrogen 2.950 N/A ALA 23.A N ASP 19.A O no hydrogen 3.187 N/A CYS 24.A N ASP 20.A O no hydrogen 2.982 N/A CYS 24.A SG ASP 20.A O no hydrogen 3.390 N/A MET 25.A N MET 21.A O no hydrogen 3.096 N/A LYS 26.A N ALA 22.A O no hydrogen 2.765 N/A LYS 26.A NZ GLU 30.A OE1 no hydrogen 2.840 N/A SER 27.A N ALA 23.A O no hydrogen 3.135 N/A SER 27.A OG ALA 23.A O no hydrogen 3.213 N/A VAL 28.A N CYS 24.A O no hydrogen 3.062 N/A THR 29.A N MET 25.A O no hydrogen 3.085 N/A THR 29.A OG1 MET 25.A O no hydrogen 2.799 N/A GLU 30.A N LYS 26.A O no hydrogen 3.060 N/A GLN 31.A N VAL 28.A O no hydrogen 3.185 N/A GLY 32.A N THR 29.A O no hydrogen 3.225 N/A SER 36.A N GLU 39.A OE1 no hydrogen 3.310 N/A GLU 39.A N SER 36.A OG no hydrogen 3.323 N/A ARG 40.A N SER 36.A O no hydrogen 2.834 N/A ASN 41.A N ASN 37.A O no hydrogen 2.900 N/A LEU 42.A N GLU 38.A O no hydrogen 2.912 N/A LEU 43.A N GLU 39.A O no hydrogen 2.973 N/A SER 44.A N ARG 40.A O no hydrogen 3.010 N/A VAL 45.A N ASN 41.A O no hydrogen 2.797 N/A ALA 46.A N LEU 42.A O no hydrogen 2.922 N/A TYR 47.A N LEU 43.A O no hydrogen 3.138 N/A LYS 48.A N SER 44.A O no hydrogen 2.806 N/A ASN 49.A N VAL 45.A O no hydrogen 3.115 N/A ASN 49.A ND2 VAL 45.A O no hydrogen 2.932 N/A VAL 50.A N ALA 46.A O no hydrogen 2.912 N/A VAL 51.A N TYR 47.A O no hydrogen 2.865 N/A GLY 52.A N LYS 48.A O no hydrogen 3.018 N/A ALA 53.A N ASN 49.A O no hydrogen 3.155 N/A ARG 54.A NE GLU 88.A OE1 no hydrogen 3.074 N/A ARG 54.A NH1 ASP 19.A OD1 no hydrogen 3.183 N/A ARG 54.A NH1 VAL 50.A O no hydrogen 3.154 N/A ARG 54.A NH2 ASP 19.A OD1 no hydrogen 3.162 N/A ARG 55.A N VAL 51.A O no hydrogen 2.905 N/A ARG 55.A NE GLU 130.A OE1 no hydrogen 3.075 N/A ARG 55.A NH2 GLU 130.A OE2 no hydrogen 2.925 N/A SER 56.A N GLY 52.A O no hydrogen 2.902 N/A SER 57.A N ALA 53.A O no hydrogen 3.119 N/A SER 57.A OG ALA 53.A O no hydrogen 3.210 N/A TRP 58.A N ARG 54.A O no hydrogen 2.842 N/A TRP 58.A NE1 GLU 86.A OE1 no hydrogen 3.027 N/A ARG 59.A N ARG 55.A O no hydrogen 2.949 N/A VAL 60.A N SER 56.A O no hydrogen 3.173 N/A VAL 61.A N SER 57.A O no hydrogen 3.021 N/A SER 62.A N TRP 58.A O no hydrogen 2.906 N/A SER 62.A OG TRP 58.A O no hydrogen 2.750 N/A SER 63.A N ARG 59.A O no hydrogen 3.029 N/A ILE 64.A N VAL 60.A O no hydrogen 2.963 N/A GLU 65.A N VAL 61.A O no hydrogen 3.002 N/A GLN 66.A N SER 62.A O no hydrogen 3.028 N/A LYS 67.A N SER 63.A O no hydrogen 3.013 N/A THR 68.A N ILE 64.A O no hydrogen 2.881 N/A THR 68.A OG1 ILE 64.A O no hydrogen 2.837 N/A GLN 75.A NE2 GLU 65.A O no hydrogen 2.268 N/A GLN 75.A NE2 GLN 75.A O no hydrogen 3.670 N/A ALA 78.A N LYS 74.A O no hydrogen 3.434 N/A ARG 79.A N GLN 75.A O no hydrogen 3.243 N/A GLU 80.A N GLN 76.A O no hydrogen 3.184 N/A TYR 81.A N MET 77.A O no hydrogen 2.951 N/A ARG 82.A N ALA 78.A O no hydrogen 2.733 N/A ARG 82.A NE GLU 65.A OE1 no hydrogen 3.076 N/A ARG 82.A NH2 GLU 65.A OE1 no hydrogen 3.087 N/A ARG 82.A NH2 GLU 65.A OE2 no hydrogen 3.071 N/A GLU 83.A N ARG 79.A O no hydrogen 3.035 N/A LYS 84.A N GLU 80.A O no hydrogen 2.865 N/A ILE 85.A N TYR 81.A O no hydrogen 2.857 N/A GLU 86.A N ARG 82.A O no hydrogen 2.788 N/A THR 87.A N GLU 83.A O no hydrogen 3.026 N/A THR 87.A OG1 GLU 83.A O no hydrogen 3.226 N/A GLU 88.A N LYS 84.A O no hydrogen 3.390 N/A LEU 89.A N ILE 85.A O no hydrogen 2.877 N/A ARG 90.A N GLU 86.A O no hydrogen 2.740 N/A ARG 90.A NH1 VAL 131.A O no hydrogen 3.423 N/A ASP 91.A N THR 87.A O no hydrogen 2.923 N/A ILE 92.A N GLU 88.A O no hydrogen 3.135 N/A CYS 93.A N LEU 89.A O no hydrogen 3.136 N/A CYS 93.A SG LEU 89.A O no hydrogen 3.538 N/A CYS 93.A SG TYR 124.A O no hydrogen 3.623 N/A ASN 94.A N ARG 90.A O no hydrogen 2.992 N/A ASP 95.A N ASP 91.A O no hydrogen 2.947 N/A VAL 96.A N ILE 92.A O no hydrogen 3.225 N/A LEU 97.A N CYS 93.A O no hydrogen 2.897 N/A SER 98.A N ASN 94.A O no hydrogen 2.872 N/A LEU 99.A N ASP 95.A O no hydrogen 3.035 N/A LEU 100.A N VAL 96.A O no hydrogen 2.711 N/A GLU 101.A N LEU 97.A O no hydrogen 2.973 N/A LYS 102.A N SER 98.A O no hydrogen 2.895 N/A PHE 103.A N LEU 99.A O no hydrogen 2.903 N/A LEU 104.A N LEU 99.A O no hydrogen 3.166 N/A ILE 105.A N LEU 100.A O no hydrogen 2.928 N/A ASN 107.A N PHE 103.A O no hydrogen 3.164 N/A ALA 108.A N ILE 105.A O no hydrogen 3.213 N/A SER 109.A OG GLU 34.A OE1 no hydrogen 3.420 N/A SER 109.A OG GLU 34.A OE2 no hydrogen 3.184 N/A SER 113.A OG GLN 110.A O no hydrogen 3.374 N/A LYS 114.A N GLN 110.A O no hydrogen 2.952 N/A LYS 114.A NZ ALA 108.A O no hydrogen 3.427 N/A VAL 115.A N ALA 111.A O no hydrogen 2.912 N/A PHE 116.A N GLU 112.A O no hydrogen 3.189 N/A TYR 117.A N SER 113.A O no hydrogen 2.988 N/A LEU 118.A N LYS 114.A O no hydrogen 2.975 N/A LYS 119.A N VAL 115.A O no hydrogen 2.852 N/A LYS 119.A NZ ASP 123.A OD2 no hydrogen 3.010 N/A MET 120.A N PHE 116.A O no hydrogen 2.866 N/A LYS 121.A N TYR 117.A O no hydrogen 2.909 N/A LYS 121.A NZ GLU 101.A OE2 no hydrogen 3.017 N/A GLY 122.A N LEU 118.A O no hydrogen 2.968 N/A ASP 123.A N LYS 119.A O no hydrogen 2.758 N/A TYR 124.A N MET 120.A O no hydrogen 3.127 N/A TYR 125.A N LYS 121.A O no hydrogen 3.284 N/A ARG 126.A N GLY 122.A O no hydrogen 2.987 N/A ARG 126.A NH1 TYR 148.A OH no hydrogen 2.798 N/A TYR 127.A N ASP 123.A O no hydrogen 2.982 N/A LEU 128.A N TYR 124.A O no hydrogen 2.936 N/A ALA 129.A N TYR 125.A O no hydrogen 2.763 N/A GLU 130.A N ARG 126.A O no hydrogen 2.862 N/A GLU 130.A N TYR 127.A O no hydrogen 3.166 N/A VAL 131.A N LEU 128.A O no hydrogen 3.375 N/A ALA 132.A N ALA 129.A O no hydrogen 3.300 N/A ASP 136.A N ALA 133.A O no hydrogen 3.318 N/A LYS 137.A N GLY 134.A O no hydrogen 3.303 N/A ILE 140.A N ASP 136.A O no hydrogen 3.336 N/A VAL 141.A N LYS 137.A O no hydrogen 2.938 N/A ASP 142.A N LYS 138.A O no hydrogen 3.222 N/A ASP 142.A N GLY 139.A O no hydrogen 3.039 N/A GLN 143.A N GLY 139.A O no hydrogen 3.039 N/A SER 144.A N ILE 140.A O no hydrogen 3.032 N/A SER 144.A OG GLY 122.A O no hydrogen 2.896 N/A GLN 145.A N VAL 141.A O no hydrogen 3.188 N/A GLN 146.A N ASP 142.A O no hydrogen 2.850 N/A ALA 147.A N GLN 143.A O no hydrogen 3.354 N/A ALA 147.A N SER 144.A O no hydrogen 3.202 N/A TYR 148.A N SER 144.A O no hydrogen 2.987 N/A TYR 148.A OH ASP 123.A OD1 no hydrogen 2.617 N/A GLN 149.A N GLN 145.A O no hydrogen 2.792 N/A GLN 149.A NE2 GLU 153.A OE1 no hydrogen 3.287 N/A GLN 149.A NE2 GLU 153.A OE2 no hydrogen 3.147 N/A GLU 150.A N GLN 146.A O no hydrogen 3.128 N/A ALA 151.A N ALA 147.A O no hydrogen 2.997 N/A PHE 152.A N TYR 148.A O no hydrogen 2.900 N/A GLU 153.A N GLN 149.A O no hydrogen 2.918 N/A ILE 154.A N GLU 150.A O no hydrogen 3.058 N/A SER 155.A N ALA 151.A O no hydrogen 2.782 N/A LYS 156.A N PHE 152.A O no hydrogen 2.965 N/A LYS 157.A N GLU 153.A O no hydrogen 3.357 N/A GLU 158.A N ILE 154.A O no hydrogen 2.824 N/A MET 159.A N SER 155.A O no hydrogen 2.915 N/A THR 162.A N GLU 201.A OE1 no hydrogen 3.093 N/A THR 162.A OG1 GLU 201.A OE1 no hydrogen 3.123 N/A HIS 163.A N GLN 160.A O no hydrogen 2.928 N/A HIS 163.A NE2 GLU 112.A OE1 no hydrogen 3.144 N/A ILE 165.A N HIS 163.A ND1 no hydrogen 3.104 N/A ARG 166.A NH1 MET 159.A O no hydrogen 2.758 N/A LEU 167.A N HIS 163.A O no hydrogen 2.844 N/A GLY 168.A N PRO 164.A O no hydrogen 2.900 N/A LEU 169.A N ILE 165.A O no hydrogen 3.184 N/A ALA 170.A N ARG 166.A O no hydrogen 3.140 N/A LEU 171.A N LEU 167.A O no hydrogen 3.116 N/A ASN 172.A N GLY 168.A O no hydrogen 3.134 N/A ASN 172.A ND2 ASP 123.A OD1 no hydrogen 2.866 N/A PHE 173.A N LEU 169.A O no hydrogen 2.751 N/A SER 174.A N ALA 170.A O no hydrogen 2.929 N/A SER 174.A OG ALA 170.A O no hydrogen 3.110 N/A SER 174.A OG LEU 171.A O no hydrogen 2.755 N/A VAL 175.A N LEU 171.A O no hydrogen 3.021 N/A PHE 176.A N ASN 172.A O no hydrogen 2.946 N/A TYR 177.A N PHE 173.A O no hydrogen 3.182 N/A TYR 178.A N SER 174.A O no hydrogen 2.813 N/A GLU 179.A N VAL 175.A O no hydrogen 2.869 N/A ILE 180.A N PHE 176.A O no hydrogen 2.908 N/A LEU 181.A N PHE 176.A O no hydrogen 3.018 N/A SER 183.A N TYR 177.A O no hydrogen 2.834 N/A SER 183.A OG LEU 181.A O no hydrogen 3.207 N/A ALA 187.A N SER 183.A O no hydrogen 2.890 N/A CYS 188.A N PRO 184.A O no hydrogen 2.825 N/A CYS 188.A SG PRO 184.A O no hydrogen 3.293 N/A SER 189.A N GLU 185.A O no hydrogen 2.999 N/A SER 189.A OG GLU 185.A O no hydrogen 2.993 N/A LEU 190.A N LYS 186.A O no hydrogen 2.955 N/A ALA 191.A N ALA 187.A O no hydrogen 3.191 N/A LYS 192.A N CYS 188.A O no hydrogen 2.764 N/A LYS 192.A NZ ASP 196.A OD1 no hydrogen 3.462 N/A THR 193.A N SER 189.A O no hydrogen 2.829 N/A THR 193.A OG1 SER 189.A O no hydrogen 2.953 N/A ALA 194.A N LEU 190.A O no hydrogen 3.147 N/A PHE 195.A N ALA 191.A O no hydrogen 2.988 N/A ASP 196.A N LYS 192.A O no hydrogen 2.830 N/A GLU 197.A N THR 193.A O no hydrogen 2.861 N/A ALA 198.A N ALA 194.A O no hydrogen 3.057 N/A ILE 199.A N PHE 195.A O no hydrogen 2.870 N/A ALA 200.A N ASP 196.A O no hydrogen 2.801 N/A GLU 201.A N GLU 197.A O no hydrogen 3.058 N/A LEU 202.A N ALA 198.A O no hydrogen 3.064 N/A ASP 203.A N ILE 199.A O no hydrogen 2.897 N/A THR 204.A N ALA 200.A O no hydrogen 3.325 N/A THR 204.A N GLU 201.A O no hydrogen 3.319 N/A THR 204.A OG1 GLU 201.A O no hydrogen 3.037 N/A LEU 205.A N LEU 202.A O no hydrogen 3.228 N/A SER 206.A OG SER 209.A OG no hydrogen 2.995 N/A SER 209.A OG GLU 201.A O no hydrogen 3.012 N/A SER 209.A OG SER 206.A O no hydrogen 3.356 N/A SER 209.A OG SER 206.A OG no hydrogen 2.995 N/A TYR 210.A N THR 162.A OG1 no hydrogen 2.936 N/A LYS 211.A NZ SER 209.A O no hydrogen 2.816 N/A SER 213.A OG THR 162.A O no hydrogen 2.663 N/A THR 214.A OG1 LYS 211.A O no hydrogen 3.415 N/A MET 217.A N SER 213.A O no hydrogen 3.226 N/A MET 217.A N THR 214.A O no hydrogen 3.085 N/A GLN 218.A N THR 214.A O no hydrogen 2.956 N/A LEU 219.A N LEU 215.A O no hydrogen 2.820 N/A LEU 220.A N ILE 216.A O no hydrogen 3.114 N/A ARG 221.A N MET 217.A O no hydrogen 2.926 N/A ASP 222.A N GLN 218.A O no hydrogen 2.836 N/A ASN 223.A N LEU 219.A O no hydrogen 3.113 N/A LEU 224.A N LEU 220.A O no hydrogen 3.096 N/A THR 225.A N ARG 221.A O no hydrogen 2.783 N/A THR 225.A OG1 ARG 221.A O no hydrogen 3.017 N/A LEU 226.A N ASP 222.A O no hydrogen 2.816 N/A TRP 227.A N ASN 223.A O no hydrogen 2.835 N/A