Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3iqw_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG ASP 224.A OD1 no hydrogen 3.558 N/A LEU 6.A N LEU 252.A O no hydrogen 2.897 N/A GLN 7.A N THR 5.A OG1 no hydrogen 3.124 N/A GLN 7.A NE2 ASP 11.A OD1 no hydrogen 3.113 N/A GLN 7.A NE2 ASP 11.A OD2 no hydrogen 3.289 N/A LEU 10.A N LEU 6.A O no hydrogen 3.270 N/A ASP 11.A N GLN 7.A O no hydrogen 2.861 N/A ASP 11.A N SER 8.A O no hydrogen 2.813 N/A GLN 12.A N ILE 9.A O no hydrogen 3.175 N/A GLN 12.A NE2 GLU 152.A O no hydrogen 3.408 N/A LEU 15.A N GLN 12.A O no hydrogen 3.173 N/A ARG 16.A N LEU 154.A O no hydrogen 2.787 N/A ARG 16.A NE TYR 106.A O no hydrogen 3.135 N/A ARG 16.A NE GLU 107.A O no hydrogen 3.229 N/A ARG 16.A NH1 ASN 102.A O no hydrogen 3.019 N/A ARG 16.A NH2 ASN 102.A O no hydrogen 3.181 N/A ARG 16.A NH2 LEU 104.A O no hydrogen 2.888 N/A ARG 16.A NH2 TYR 106.A O no hydrogen 2.911 N/A TRP 17.A N LEU 154.A O no hydrogen 2.888 N/A ILE 18.A N ILE 109.A O no hydrogen 2.812 N/A PHE 19.A N THR 156.A O no hydrogen 3.079 N/A VAL 20.A N PHE 111.A O no hydrogen 2.954 N/A GLY 21.A N VAL 158.A O no hydrogen 3.026 N/A VAL 26.A N LYS 23.A O no hydrogen 3.283 N/A LYS 28.A NZ LYS 23.A O no hydrogen 3.048 N/A THR 29.A OG1 ASP 112.A OD1 no hydrogen 2.410 N/A THR 31.A N GLY 27.A O no hydrogen 3.092 N/A THR 31.A OG1 GLY 27.A O no hydrogen 2.598 N/A SER 32.A N LYS 28.A O no hydrogen 2.924 N/A SER 32.A OG LYS 28.A O no hydrogen 2.945 N/A SER 32.A OG ASP 112.A OD2 no hydrogen 3.237 N/A CYS 33.A N THR 29.A O no hydrogen 2.802 N/A CYS 33.A SG THR 29.A O no hydrogen 3.639 N/A SER 34.A N THR 30.A O no hydrogen 3.153 N/A SER 34.A OG THR 30.A O no hydrogen 2.848 N/A LEU 35.A N THR 31.A O no hydrogen 2.626 N/A ALA 36.A N SER 32.A O no hydrogen 2.893 N/A ILE 37.A N CYS 33.A O no hydrogen 2.959 N/A GLN 38.A N SER 34.A O no hydrogen 3.045 N/A LEU 39.A N LEU 35.A O no hydrogen 2.972 N/A ALA 40.A N ALA 36.A O no hydrogen 2.756 N/A LYS 41.A N GLN 38.A O no hydrogen 2.942 N/A VAL 42.A N LEU 39.A O no hydrogen 2.616 N/A ARG 43.A NH1 GLN 12.A O no hydrogen 3.470 N/A ARG 43.A NH2 LEU 10.A O no hydrogen 2.562 N/A ARG 44.A N GLU 107.A OE2 no hydrogen 2.707 N/A ARG 44.A NH2 SER 105.A O no hydrogen 3.453 N/A VAL 46.A N ASN 77.A O no hydrogen 3.217 N/A LEU 47.A N THR 108.A O no hydrogen 2.828 N/A LEU 48.A N TYR 79.A O no hydrogen 2.808 N/A LEU 49.A N VAL 110.A O no hydrogen 2.982 N/A SER 50.A N MET 81.A O no hydrogen 2.895 N/A THR 51.A N ASP 112.A O no hydrogen 3.277 N/A HIS 55.A ND1 GLU 82.A OE1 no hydrogen 2.114 N/A ASN 56.A ND2 ASP 59.A OD2 no hydrogen 3.145 N/A SER 58.A N GLU 82.A OE2 no hydrogen 2.964 N/A SER 58.A OG GLU 82.A OE1 no hydrogen 2.916 N/A SER 58.A OG GLU 82.A OE2 no hydrogen 3.253 N/A ASP 59.A N HIS 55.A O no hydrogen 3.296 N/A ALA 60.A N ASN 56.A O no hydrogen 2.729 N/A PHE 61.A N LEU 57.A O no hydrogen 3.184 N/A PHE 61.A N SER 58.A O no hydrogen 3.126 N/A SER 62.A N ASP 59.A O no hydrogen 3.382 N/A GLN 63.A N SER 58.A O no hydrogen 3.219 N/A PHE 65.A N SER 58.A OG no hydrogen 3.221 N/A ARG 70.A N ALA 80.A O no hydrogen 3.176 N/A ARG 70.A NE GLU 68.A O no hydrogen 3.166 N/A ARG 70.A NH1 LYS 64.A O no hydrogen 3.177 N/A ARG 70.A NH2 GLU 68.A O no hydrogen 3.495 N/A VAL 72.A N LEU 78.A O no hydrogen 2.796 N/A PHE 75.A N VAL 72.A O no hydrogen 3.061 N/A ASN 77.A ND2 ARG 44.A O no hydrogen 2.432 N/A TYR 79.A N VAL 46.A O no hydrogen 2.905 N/A ALA 80.A N ARG 70.A O no hydrogen 2.953 N/A MET 81.A N LEU 48.A O no hydrogen 2.845 N/A GLU 82.A N GLY 66.A O no hydrogen 2.856 N/A ILE 83.A N SER 50.A O no hydrogen 3.168 N/A GLU 90.A N ASP 89.A OD1 no hydrogen 2.228 N/A ALA 91.A N GLY 87.A O no hydrogen 3.239 N/A MET 92.A N ILE 88.A O no hydrogen 2.601 N/A SER 93.A N ASP 89.A O no hydrogen 2.189 N/A PHE 94.A N GLU 90.A O no hydrogen 2.628 N/A ALA 95.A N ALA 91.A O no hydrogen 3.074 N/A ALA 95.A N MET 92.A O no hydrogen 2.955 N/A GLU 96.A N MET 92.A O no hydrogen 3.304 N/A VAL 97.A N SER 93.A O no hydrogen 3.033 N/A LEU 98.A N PHE 94.A O no hydrogen 3.141 N/A LYS 99.A N ALA 95.A O no hydrogen 2.859 N/A LYS 99.A NZ GLU 144.A OE1 no hydrogen 3.097 N/A GLN 100.A N GLU 96.A O no hydrogen 2.833 N/A VAL 101.A N VAL 97.A O no hydrogen 2.923 N/A ASN 102.A N LEU 98.A O no hydrogen 2.918 N/A SER 103.A N GLN 100.A O no hydrogen 3.259 N/A SER 103.A OG GLN 100.A O no hydrogen 2.809 N/A LEU 104.A N VAL 101.A O no hydrogen 2.841 N/A GLU 107.A N SER 45.A O no hydrogen 3.267 N/A GLU 107.A N SER 45.A OG no hydrogen 3.387 N/A ILE 109.A N ARG 16.A O no hydrogen 2.794 N/A VAL 110.A N LEU 47.A O no hydrogen 2.932 N/A PHE 111.A N ILE 18.A O no hydrogen 2.880 N/A ASP 112.A N LEU 49.A O no hydrogen 2.905 N/A HIS 118.A N PRO 115.A O no hydrogen 2.751 N/A LEU 120.A N THR 116.A O no hydrogen 3.203 N/A ARG 121.A N GLY 117.A O no hydrogen 3.252 N/A ARG 121.A NH2 HIS 118.A ND1 no hydrogen 3.457 N/A LEU 123.A N THR 119.A O no hydrogen 3.202 N/A GLN 124.A N LEU 120.A O no hydrogen 2.757 N/A PHE 125.A N PHE 122.A O no hydrogen 2.503 N/A LEU 129.A N PHE 125.A O no hydrogen 2.693 N/A LYS 134.A N VAL 131.A O no hydrogen 2.492 N/A ASP 136.A N MET 132.A O no hydrogen 3.073 N/A SER 137.A N GLU 133.A O no hydrogen 3.236 N/A SER 137.A OG LYS 134.A O no hydrogen 3.069 N/A LEU 138.A N LEU 135.A O no hydrogen 3.059 N/A ARG 139.A N LEU 135.A O no hydrogen 3.378 N/A ARG 139.A NE ARG 139.A O no hydrogen 2.559 N/A ARG 139.A NE SER 143.A OG no hydrogen 3.249 N/A ARG 139.A NH2 SER 143.A OG no hydrogen 3.090 N/A VAL 140.A N ASP 136.A O no hydrogen 3.119 N/A ILE 142.A N LEU 138.A O no hydrogen 2.900 N/A SER 143.A N ARG 139.A O no hydrogen 2.830 N/A GLU 144.A N VAL 140.A O no hydrogen 3.185 N/A VAL 145.A N THR 141.A O no hydrogen 3.207 N/A ASN 146.A N ILE 142.A O no hydrogen 2.890 N/A ALA 147.A N SER 143.A O no hydrogen 2.817 N/A GLN 148.A N GLU 144.A O no hydrogen 3.123 N/A PHE 149.A N VAL 145.A O no hydrogen 3.016 N/A LYS 150.A N ALA 147.A O no hydrogen 3.107 N/A ASP 151.A N GLN 148.A O no hydrogen 3.373 N/A ARG 153.A N ASP 151.A OD1 no hydrogen 3.157 N/A LEU 154.A N ASP 151.A O no hydrogen 2.943 N/A THR 155.A N ASP 151.A O no hydrogen 3.117 N/A THR 155.A OG1 GLN 148.A O no hydrogen 2.667 N/A THR 156.A N TRP 17.A O no hydrogen 3.186 N/A PHE 157.A N ASP 184.A O no hydrogen 3.029 N/A VAL 158.A N PHE 19.A O no hydrogen 2.813 N/A CYS 159.A N CYS 187.A O no hydrogen 3.017 N/A VAL 160.A N GLY 21.A O no hydrogen 2.817 N/A CYS 161.A N VAL 189.A O no hydrogen 3.007 N/A CYS 161.A SG ILE 162.A O no hydrogen 4.037 N/A CYS 161.A SG VAL 189.A O no hydrogen 4.014 N/A ILE 162.A N SER 167.A OG no hydrogen 3.020 N/A LEU 166.A N GLU 164.A OE1 no hydrogen 3.351 N/A SER 167.A OG ILE 162.A O no hydrogen 3.328 N/A LEU 168.A N GLU 164.A O no hydrogen 3.219 N/A TYR 169.A N PHE 165.A O no hydrogen 3.112 N/A GLU 170.A N LEU 166.A O no hydrogen 3.130 N/A THR 171.A N SER 167.A O no hydrogen 3.015 N/A THR 171.A OG1 SER 167.A O no hydrogen 3.189 N/A GLU 172.A N LEU 168.A O no hydrogen 2.889 N/A ARG 173.A N TYR 169.A O no hydrogen 3.184 N/A MET 174.A N GLU 170.A O no hydrogen 2.797 N/A ILE 175.A N THR 171.A O no hydrogen 3.022 N/A GLN 176.A N GLU 172.A O no hydrogen 3.099 N/A GLU 177.A N ARG 173.A O no hydrogen 2.861 N/A LEU 178.A N MET 174.A O no hydrogen 2.758 N/A ALA 179.A N ILE 175.A O no hydrogen 3.105 N/A ASN 180.A N GLN 176.A O no hydrogen 3.077 N/A TYR 181.A N GLU 177.A O no hydrogen 2.895 N/A GLY 182.A N ALA 179.A O no hydrogen 2.759 N/A ILE 183.A N LEU 178.A O no hydrogen 2.701 N/A THR 185.A OG1 PHE 157.A O no hydrogen 2.719 N/A ILE 188.A N ASN 228.A O no hydrogen 2.727 N/A VAL 189.A N CYS 159.A O no hydrogen 2.726 N/A VAL 190.A N VAL 230.A O no hydrogen 2.952 N/A ASN 191.A N CYS 161.A O no hydrogen 2.744 N/A ASN 191.A ND2 VAL 26.A O no hydrogen 2.880 N/A GLN 192.A NE2 GLY 25.A O no hydrogen 3.601 N/A GLN 192.A NE2 VAL 26.A O no hydrogen 3.314 N/A LEU 193.A N MET 232.A O no hydrogen 3.112 N/A LEU 194.A N GLN 212.A OE1 no hydrogen 2.810 N/A SER 200.A N LYS 197.A O no hydrogen 2.909 N/A THR 206.A N CYS 202.A O no hydrogen 2.794 N/A THR 206.A OG1 CYS 202.A O no hydrogen 2.668 N/A ALA 207.A N GLU 203.A O no hydrogen 2.799 N/A ARG 208.A N GLN 204.A O no hydrogen 2.714 N/A ARG 208.A N CYS 205.A O no hydrogen 3.264 N/A ARG 209.A N CYS 205.A O no hydrogen 3.124 N/A ARG 210.A N THR 206.A O no hydrogen 2.871 N/A MET 211.A N ALA 207.A O no hydrogen 3.065 N/A GLN 212.A N ARG 208.A O no hydrogen 3.179 N/A LYS 213.A N ARG 209.A O no hydrogen 3.010 N/A LYS 213.A N ARG 210.A O no hydrogen 3.239 N/A LYS 214.A N ARG 210.A O no hydrogen 3.279 N/A TYR 215.A N GLN 212.A O no hydrogen 2.847 N/A LEU 216.A N GLN 212.A O no hydrogen 2.916 N/A ASP 217.A N LYS 213.A O no hydrogen 2.950 N/A ILE 219.A N TYR 215.A O no hydrogen 2.838 N/A GLU 220.A N LEU 216.A O no hydrogen 2.825 N/A GLU 221.A N ASP 217.A O no hydrogen 2.913 N/A LEU 222.A N GLN 218.A O no hydrogen 3.074 N/A LEU 222.A N ILE 219.A O no hydrogen 3.218 N/A TYR 223.A N ILE 219.A O no hydrogen 3.057 N/A TYR 223.A OH GLU 172.A OE2 no hydrogen 3.419 N/A ASP 224.A N GLU 220.A O no hydrogen 2.859 N/A GLU 226.A N TYR 223.A O no hydrogen 2.944 N/A PHE 227.A N TYR 223.A O no hydrogen 2.708 N/A ASN 228.A N HIS 186.A O no hydrogen 2.929 N/A ASN 228.A ND2 THR 5.A O no hydrogen 3.301 N/A VAL 230.A N ILE 188.A O no hydrogen 2.805 N/A LYS 231.A NZ GLU 220.A OE2 no hydrogen 3.114 N/A MET 232.A N VAL 190.A O no hydrogen 2.925 N/A LEU 234.A N LEU 193.A O no hydrogen 2.856 N/A GLY 241.A N ALA 60.A O no hydrogen 2.943 N/A LYS 242.A NZ GLU 246.A OE2 no hydrogen 3.393 N/A LEU 245.A N GLY 241.A O no hydrogen 2.967 N/A GLU 246.A N LYS 242.A O no hydrogen 2.800 N/A LYS 247.A N GLU 243.A O no hydrogen 3.043 N/A PHE 248.A N ARG 244.A O no hydrogen 3.069 N/A SER 249.A N LEU 245.A O no hydrogen 2.893 N/A SER 249.A OG GLN 38.A OE1 no hydrogen 2.931 N/A SER 249.A OG LEU 245.A O no hydrogen 3.553 N/A SER 249.A OG GLU 246.A O no hydrogen 2.560 N/A GLU 250.A N GLU 246.A O no hydrogen 3.166 N/A GLU 250.A N LYS 247.A O no hydrogen 3.237 N/A MET 251.A N PHE 248.A O no hydrogen 2.900 N/A LEU 252.A N SER 249.A O no hydrogen 2.851 N/A ILE 253.A N GLU 250.A O no hydrogen 3.007 N/A LYS 254.A N GLU 250.A O no hydrogen 2.811 N/A