Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3fpf_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 2.A N SER 1.A OG no hydrogen 2.638 N/A TYR 3.A OH SER 51.A OG no hydrogen 3.126 N/A TYR 5.A OH ASP 44.A OD2 no hydrogen 3.317 N/A TRP 6.A N TYR 3.A O no hydrogen 3.112 N/A LYS 8.A N ILE 4.A O no hydrogen 3.463 N/A ILE 9.A N TYR 5.A O no hydrogen 2.941 N/A LYS 10.A N TRP 6.A O no hydrogen 3.026 N/A LYS 10.A NZ GLU 60.A O no hydrogen 3.192 N/A ARG 11.A N ASP 7.A O no hydrogen 2.840 N/A ILE 12.A N LYS 8.A O no hydrogen 3.015 N/A ALA 13.A N ILE 9.A O no hydrogen 2.911 N/A SER 14.A N LYS 10.A O no hydrogen 2.965 N/A SER 14.A OG ARG 11.A O no hydrogen 2.712 N/A ARG 15.A N ILE 12.A O no hydrogen 2.926 N/A ARG 15.A NH1 GLU 37.A OE2 no hydrogen 2.816 N/A ARG 15.A NH2 GLU 37.A OE1 no hydrogen 2.876 N/A ARG 15.A NH2 GLU 37.A OE2 no hydrogen 3.417 N/A LEU 16.A N ALA 13.A O no hydrogen 2.930 N/A MET 19.A N LEU 16.A O no hydrogen 2.939 N/A ASN 20.A N GLU 17.A O no hydrogen 2.987 N/A HIS 22.A N MET 19.A O no hydrogen 2.914 N/A GLU 25.A N HIS 22.A O no hydrogen 3.073 N/A MET 26.A N PHE 23.A O no hydrogen 3.192 N/A THR 28.A OG1 GLU 82.A OE2 no hydrogen 3.551 N/A GLY 30.A N ASP 27.A OD1 no hydrogen 2.952 N/A VAL 31.A N ASP 27.A O no hydrogen 3.089 N/A MET 32.A N SER 29.A O no hydrogen 3.322 N/A LEU 35.A N VAL 31.A O no hydrogen 3.266 N/A ASP 36.A N MET 32.A O no hydrogen 2.997 N/A GLU 37.A N PRO 33.A O no hydrogen 3.018 N/A ILE 38.A N LEU 34.A O no hydrogen 3.069 N/A GLU 39.A N LEU 35.A O no hydrogen 2.778 N/A GLU 40.A N ASP 36.A O no hydrogen 2.876 N/A ILE 41.A N ILE 38.A O no hydrogen 3.115 N/A ALA 42.A N ILE 38.A O no hydrogen 2.964 N/A HIS 43.A N GLU 39.A O no hydrogen 2.827 N/A HIS 43.A NE2 ASN 254.A OD1 no hydrogen 2.687 N/A ASP 44.A N ILE 41.A O no hydrogen 3.112 N/A THR 46.A N ASP 44.A OD1 no hydrogen 2.981 N/A THR 46.A OG1 TYR 5.A OH no hydrogen 3.323 N/A THR 46.A OG1 ASP 44.A OD1 no hydrogen 2.694 N/A ILE 47.A N ASP 44.A O no hydrogen 3.150 N/A SER 51.A N ASP 48.A OD1 no hydrogen 2.870 N/A SER 51.A OG TYR 3.A OH no hydrogen 3.126 N/A SER 51.A OG ASP 48.A OD1 no hydrogen 3.455 N/A SER 51.A OG ASP 48.A OD2 no hydrogen 2.485 N/A ALA 52.A N ASP 48.A O no hydrogen 2.985 N/A LYS 53.A N PHE 49.A O no hydrogen 2.974 N/A LYS 53.A NZ ASP 57.A OD2 no hydrogen 3.057 N/A HIS 54.A N GLU 50.A O no hydrogen 2.975 N/A ILE 55.A N SER 51.A O no hydrogen 3.166 N/A LEU 56.A N ALA 52.A O no hydrogen 2.887 N/A ASP 57.A N LYS 53.A O no hydrogen 2.969 N/A ASP 58.A N ILE 55.A O no hydrogen 3.362 N/A GLU 60.A N ASP 58.A OD1 no hydrogen 2.915 N/A MET 61.A N ASP 58.A O no hydrogen 2.894 N/A ASN 62.A N ALA 59.A O no hydrogen 3.147 N/A HIS 63.A NE2 GLU 17.A OE1 no hydrogen 2.693 N/A LEU 65.A N MET 61.A O no hydrogen 2.910 N/A SER 66.A N ASN 62.A O no hydrogen 3.024 N/A SER 66.A OG HIS 63.A O no hydrogen 2.554 N/A LEU 67.A N HIS 63.A O no hydrogen 3.040 N/A ILE 68.A N ALA 64.A O no hydrogen 3.018 N/A ARG 69.A N LEU 65.A O no hydrogen 2.880 N/A ARG 69.A NE ALA 227.A O no hydrogen 3.303 N/A ARG 69.A NH2 ALA 227.A O no hydrogen 2.765 N/A LYS 70.A N SER 66.A O no hydrogen 3.023 N/A PHE 71.A N LEU 67.A O no hydrogen 3.006 N/A TYR 72.A N ILE 68.A O no hydrogen 2.961 N/A TYR 72.A OH TYR 222.A OH no hydrogen 2.705 N/A VAL 73.A N ARG 69.A O no hydrogen 3.057 N/A ASN 74.A N LYS 70.A O no hydrogen 3.133 N/A LEU 75.A N PHE 71.A O no hydrogen 2.838 N/A GLY 76.A N TYR 72.A O no hydrogen 2.988 N/A MET 77.A N VAL 73.A O no hydrogen 3.105 N/A LYS 78.A N ASN 74.A O no hydrogen 3.092 N/A LYS 78.A NZ ASP 24.A O no hydrogen 2.872 N/A LYS 78.A NZ MET 26.A O no hydrogen 2.662 N/A LEU 79.A N LEU 75.A O no hydrogen 2.871 N/A GLU 80.A N GLY 76.A O no hydrogen 3.012 N/A MET 81.A N MET 77.A O no hydrogen 2.926 N/A GLU 82.A N LYS 78.A O no hydrogen 2.933 N/A LYS 83.A N LEU 79.A O no hydrogen 2.993 N/A LYS 83.A NZ GLU 86.A OE2 no hydrogen 2.766 N/A LYS 83.A NZ THR 96.A O no hydrogen 3.007 N/A LYS 83.A NZ SER 99.A OG no hydrogen 2.760 N/A ALA 84.A N GLU 80.A O no hydrogen 2.805 N/A GLN 85.A N MET 81.A O no hydrogen 3.133 N/A GLU 86.A N GLU 82.A O no hydrogen 3.033 N/A VAL 87.A N LYS 83.A O no hydrogen 2.770 N/A ILE 88.A N ALA 84.A O no hydrogen 3.084 N/A GLU 89.A N GLN 85.A O no hydrogen 3.088 N/A SER 90.A N VAL 87.A O no hydrogen 3.239 N/A SER 90.A OG THR 96.A OG1 no hydrogen 2.754 N/A SER 92.A N SER 90.A OG no hydrogen 2.859 N/A THR 96.A N SER 92.A O no hydrogen 3.005 N/A THR 96.A OG1 SER 90.A OG no hydrogen 2.754 N/A THR 96.A OG1 SER 92.A O no hydrogen 3.221 N/A LEU 97.A N PRO 93.A O no hydrogen 2.773 N/A ARG 98.A N TRP 94.A O no hydrogen 2.877 N/A SER 99.A N THR 96.A O no hydrogen 3.167 N/A SER 99.A OG THR 96.A O no hydrogen 2.688 N/A PHE 100.A N LEU 97.A O no hydrogen 2.937 N/A TYR 103.A N PHE 100.A O no hydrogen 2.898 N/A ARG 105.A NH1 GLU 39.A OE1 no hydrogen 3.425 N/A ARG 105.A NH1 GLU 39.A OE2 no hydrogen 2.785 N/A ARG 105.A NH2 GLU 39.A OE1 no hydrogen 2.820 N/A TYR 106.A N PHE 102.A O no hydrogen 3.166 N/A LEU 107.A N TYR 103.A O no hydrogen 3.203 N/A GLU 108.A N PRO 104.A O no hydrogen 3.300 N/A LEU 109.A N ARG 105.A O no hydrogen 2.800 N/A LEU 110.A N TYR 106.A O no hydrogen 2.867 N/A LYS 111.A N LEU 107.A O no hydrogen 3.026 N/A LYS 111.A NZ GLU 108.A OE2 no hydrogen 2.508 N/A ASN 112.A N GLU 108.A O no hydrogen 2.958 N/A GLU 113.A N LEU 109.A O no hydrogen 2.996 N/A ALA 114.A N LEU 110.A O no hydrogen 2.831 N/A ALA 115.A N LYS 111.A O no hydrogen 3.263 N/A LEU 116.A N ASN 112.A O no hydrogen 3.014 N/A GLY 117.A N GLU 113.A O no hydrogen 2.721 N/A ARG 118.A N ALA 115.A O no hydrogen 3.210 N/A PHE 119.A N ALA 114.A O no hydrogen 2.926 N/A ARG 120.A N GLU 123.A OE1 no hydrogen 3.020 N/A ARG 121.A NH2 VAL 143.A O no hydrogen 2.944 N/A GLY 122.A N GLY 145.A O no hydrogen 2.723 N/A GLU 123.A N ARG 120.A O no hydrogen 3.091 N/A ARG 124.A N ASP 189.A OD2 no hydrogen 2.886 N/A ARG 124.A NE ASP 189.A OD2 no hydrogen 3.075 N/A ARG 124.A NH2 ASP 189.A OD1 no hydrogen 2.881 N/A ALA 125.A N ARG 147.A O no hydrogen 2.776 N/A VAL 126.A N VAL 190.A O no hydrogen 2.999 N/A PHE 127.A N ASN 149.A O no hydrogen 2.951 N/A ILE 128.A N MET 192.A O no hydrogen 2.821 N/A GLY 129.A N VAL 151.A O no hydrogen 2.807 N/A GLY 130.A N VAL 151.A O no hydrogen 2.973 N/A GLY 131.A N GLU 152.A OE1 no hydrogen 2.881 N/A LEU 133.A N GLU 80.A OE1 no hydrogen 3.131 N/A LEU 135.A N LEU 133.A O no hydrogen 2.776 N/A ILE 138.A N PRO 134.A O no hydrogen 3.005 N/A LEU 139.A N LEU 135.A O no hydrogen 2.867 N/A LEU 140.A N THR 136.A O no hydrogen 2.881 N/A SER 141.A N GLY 137.A O no hydrogen 3.334 N/A SER 141.A N ILE 138.A O no hydrogen 3.150 N/A SER 141.A OG ASP 171.A O no hydrogen 2.612 N/A HIS 142.A N ILE 138.A O no hydrogen 2.765 N/A VAL 143.A N LEU 139.A O no hydrogen 2.820 N/A TYR 144.A N LEU 139.A O no hydrogen 3.259 N/A GLY 145.A N SER 141.A O no hydrogen 2.972 N/A MET 146.A N LEU 140.A O no hydrogen 2.938 N/A ARG 147.A N GLU 123.A O no hydrogen 2.898 N/A VAL 148.A N GLY 172.A O no hydrogen 2.791 N/A ASN 149.A N ALA 125.A O no hydrogen 3.008 N/A VAL 150.A N ASN 174.A O no hydrogen 2.783 N/A VAL 151.A N PHE 127.A O no hydrogen 2.818 N/A GLU 152.A N ILE 176.A O no hydrogen 3.040 N/A GLU 154.A N GLU 152.A OE2 no hydrogen 2.896 N/A ALA 158.A N GLU 154.A O no hydrogen 2.868 N/A GLU 159.A N PRO 155.A O no hydrogen 2.988 N/A LEU 160.A N ASP 156.A O no hydrogen 3.072 N/A SER 161.A N ILE 157.A O no hydrogen 2.901 N/A SER 161.A OG ILE 157.A O no hydrogen 3.552 N/A SER 161.A OG ALA 158.A O no hydrogen 2.666 N/A ARG 162.A N ALA 158.A O no hydrogen 3.043 N/A ARG 162.A NE VAL 175.A O no hydrogen 3.265 N/A ARG 162.A NH2 VAL 175.A O no hydrogen 2.891 N/A ARG 162.A NH2 THR 177.A OG1 no hydrogen 2.933 N/A LYS 163.A N GLU 159.A O no hydrogen 3.288 N/A VAL 164.A N LEU 160.A O no hydrogen 3.037 N/A ILE 165.A N SER 161.A O no hydrogen 3.026 N/A GLU 166.A N ARG 162.A O no hydrogen 2.861 N/A GLY 167.A N LYS 163.A O no hydrogen 2.878 N/A LEU 168.A N VAL 164.A O no hydrogen 3.054 N/A GLY 169.A N GLU 166.A O no hydrogen 2.964 N/A VAL 170.A N ILE 165.A O no hydrogen 3.305 N/A ASN 174.A N VAL 148.A O no hydrogen 2.982 N/A ILE 176.A N VAL 150.A O no hydrogen 2.735 N/A GLY 178.A N GLU 152.A O no hydrogen 2.981 N/A GLU 180.A N GLU 180.A OE1 no hydrogen 2.811 N/A THR 181.A N ASP 179.A OD1 no hydrogen 2.967 N/A VAL 182.A N ASP 179.A O no hydrogen 3.036 N/A ILE 183.A N GLU 180.A O no hydrogen 3.303 N/A ASP 184.A N THR 181.A O no hydrogen 3.142 N/A GLY 185.A N VAL 182.A O no hydrogen 3.216 N/A LEU 186.A N ILE 183.A O no hydrogen 3.071 N/A ASP 189.A N ARG 124.A O no hydrogen 2.854 N/A VAL 190.A N ARG 124.A O no hydrogen 3.015 N/A LEU 191.A N ARG 216.A O no hydrogen 2.845 N/A MET 192.A N VAL 126.A O no hydrogen 2.794 N/A VAL 193.A N ILE 218.A O no hydrogen 2.830 N/A ALA 194.A N ILE 128.A O no hydrogen 2.967 N/A ALA 197.A N ALA 194.A O no hydrogen 3.040 N/A LYS 200.A N GLU 198.A OE1 no hydrogen 3.120 N/A LYS 200.A NZ ALA 195.A O no hydrogen 2.823 N/A LYS 200.A NZ ALA 197.A O no hydrogen 2.658 N/A ARG 202.A NE GLU 180.A OE2 no hydrogen 2.774 N/A ARG 202.A NH2 GLU 180.A OE1 no hydrogen 2.910 N/A ARG 202.A NH2 GLU 180.A OE2 no hydrogen 3.444 N/A VAL 203.A N PRO 199.A O no hydrogen 2.983 N/A PHE 204.A N LYS 200.A O no hydrogen 2.949 N/A ARG 205.A N ARG 201.A O no hydrogen 3.055 N/A ASN 206.A N ARG 202.A O no hydrogen 2.924 N/A ILE 207.A N VAL 203.A O no hydrogen 2.865 N/A HIS 208.A N PHE 204.A O no hydrogen 2.961 N/A HIS 208.A NE2 GLY 240.A O no hydrogen 2.922 N/A ARG 209.A N ASN 206.A O no hydrogen 3.037 N/A TYR 210.A N ILE 207.A O no hydrogen 2.978 N/A VAL 211.A N ILE 207.A O no hydrogen 3.129 N/A ASP 212.A N THR 215.A OG1 no hydrogen 3.140 N/A THR 213.A OG1 GLU 214.A OE2 no hydrogen 2.499 N/A GLU 214.A N ASP 212.A OD1 no hydrogen 2.790 N/A THR 215.A N ASP 212.A O no hydrogen 3.409 N/A THR 215.A N ASP 212.A OD1 no hydrogen 3.061 N/A THR 215.A OG1 ASP 212.A O no hydrogen 3.262 N/A THR 215.A OG1 ASP 212.A OD1 no hydrogen 3.174 N/A ARG 216.A NE GLY 117.A O no hydrogen 3.235 N/A ARG 216.A NH1 GLU 123.A OE2 no hydrogen 3.061 N/A ARG 216.A NH2 GLY 117.A O no hydrogen 2.880 N/A ARG 216.A NH2 GLU 123.A OE1 no hydrogen 2.677 N/A ARG 216.A NH2 GLU 123.A OE2 no hydrogen 3.301 N/A ILE 217.A N VAL 260.A O no hydrogen 3.251 N/A ILE 218.A N LEU 191.A O no hydrogen 2.823 N/A TYR 219.A N VAL 258.A O no hydrogen 2.889 N/A ARG 220.A N VAL 193.A O no hydrogen 3.125 N/A ARG 220.A NE GLU 113.A OE2 no hydrogen 2.769 N/A ARG 220.A NH1 THR 136.A OG1 no hydrogen 3.126 N/A ARG 220.A NH2 GLU 113.A OE1 no hydrogen 2.872 N/A ARG 220.A NH2 THR 136.A OG1 no hydrogen 3.038 N/A THR 221.A N THR 256.A O no hydrogen 2.792 N/A TYR 222.A N THR 221.A OG1 no hydrogen 2.754 N/A TYR 222.A OH TYR 72.A OH no hydrogen 2.705 N/A THR 223.A OG1 THR 256.A OG1 no hydrogen 2.695 N/A ARG 226.A NE VAL 253.A O no hydrogen 2.781 N/A ARG 226.A NH2 VAL 253.A O no hydrogen 3.463 N/A ALA 227.A N GLY 224.A O no hydrogen 3.086 N/A ILE 228.A N MET 225.A O no hydrogen 2.969 N/A LEU 229.A N ARG 226.A O no hydrogen 3.024 N/A TYR 230.A OH GLU 198.A OE2 no hydrogen 2.389 N/A VAL 233.A N THR 221.A OG1 no hydrogen 2.949 N/A SER 234.A N ASP 237.A OD2 no hydrogen 2.903 N/A ASP 237.A N SER 234.A OG no hydrogen 3.333 N/A ILE 238.A N ASP 235.A O no hydrogen 3.269 N/A THR 239.A N ASP 236.A O no hydrogen 3.091 N/A THR 239.A OG1 ASP 236.A O no hydrogen 2.739 N/A PHE 241.A N ILE 238.A O no hydrogen 2.960 N/A ARG 242.A N PHE 261.A O no hydrogen 2.882 N/A ALA 244.A N LEU 259.A O no hydrogen 2.739 N/A VAL 247.A N SER 257.A O no hydrogen 2.827 N/A VAL 253.A N SER 250.A O no hydrogen 3.240 N/A ASN 254.A ND2 GLU 39.A OE2 no hydrogen 2.955 N/A ASN 255.A ND2 THR 221.A O no hydrogen 3.288 N/A THR 256.A N THR 221.A O no hydrogen 2.988 N/A THR 256.A OG1 THR 223.A OG1 no hydrogen 2.695 N/A SER 257.A N VAL 247.A O no hydrogen 3.070 N/A SER 257.A OG GLU 113.A OE2 no hydrogen 2.646 N/A VAL 258.A N TYR 219.A O no hydrogen 2.928 N/A LEU 259.A N GLY 245.A O no hydrogen 2.844 N/A VAL 260.A N ILE 217.A O no hydrogen 2.777 N/A PHE 261.A N ARG 242.A O no hydrogen 2.995 N/A LYS 262.A NZ HIS 208.A O no hydrogen 2.950 N/A LYS 262.A NZ VAL 211.A O no hydrogen 3.129 N/A CYS 263.A N GLY 240.A O no hydrogen 2.970 N/A CYS 263.A SG GLY 240.A O no hydrogen 3.501 N/A