Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4xpe_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 1.A N SER 4.A OG no hydrogen 3.278 N/A SER 4.A OG THR 1.A O no hydrogen 3.458 N/A ASP 5.A N THR 1.A O no hydrogen 3.051 N/A PHE 6.A N LEU 3.A O no hydrogen 3.425 N/A ALA 9.A N PHE 6.A O no hydrogen 3.137 N/A TRP 10.A NE1 TRP 2.A O no hydrogen 2.979 N/A ALA 11.A N ALA 222.A O no hydrogen 2.860 N/A GLU 12.A N GLU 12.A OE1 no hydrogen 2.796 N/A THR 13.A N TRP 10.A O no hydrogen 3.143 N/A THR 13.A OG1 PRO 7.A O no hydrogen 2.708 N/A GLY 14.A N TRP 10.A O no hydrogen 2.790 N/A LEU 18.A N GLY 219.A O no hydrogen 2.794 N/A ALA 19.A N CYS 129.A O no hydrogen 2.711 N/A VAL 20.A N LEU 218.A O no hydrogen 3.298 N/A GLN 22.A N ALA 19.A O no hydrogen 3.166 N/A GLN 22.A NE2 ASP 174.A OD1 no hydrogen 2.955 N/A LEU 25.A N ARG 131.A O no hydrogen 2.907 N/A ILE 27.A N SER 136.A OG no hydrogen 2.808 N/A LYS 30.A N ARG 93.A O no hydrogen 2.949 N/A LYS 30.A NZ LYS 92.A O no hydrogen 2.944 N/A SER 33.A N LYS 30.A O no hydrogen 3.224 N/A SER 33.A OG LYS 30.A O no hydrogen 3.559 N/A SER 33.A OG ARG 93.A O no hydrogen 2.685 N/A ILE 38.A N ASN 72.A O no hydrogen 2.781 N/A GLN 40.A NE2 TYR 41.A O no hydrogen 2.879 N/A GLN 40.A NE2 LEU 75.A O no hydrogen 2.950 N/A ALA 47.A N SER 44.A OG no hydrogen 3.197 N/A ARG 48.A N SER 44.A O no hydrogen 3.011 N/A LEU 49.A N GLN 45.A O no hydrogen 2.791 N/A GLY 50.A N GLU 46.A O no hydrogen 3.056 N/A ILE 51.A N ALA 47.A O no hydrogen 2.874 N/A LYS 52.A N ARG 48.A O no hydrogen 2.858 N/A LYS 52.A NZ ASP 146.A OD2 no hydrogen 3.391 N/A ILE 55.A N ILE 51.A O no hydrogen 3.233 N/A GLN 56.A N LYS 52.A O no hydrogen 2.971 N/A ARG 57.A N PRO 53.A O no hydrogen 3.021 N/A ARG 57.A NH1 HIS 54.A ND1 no hydrogen 3.538 N/A LEU 58.A N HIS 54.A O no hydrogen 3.030 N/A LEU 59.A N ILE 55.A O no hydrogen 2.944 N/A ASP 60.A N GLN 56.A O no hydrogen 2.884 N/A GLN 61.A N ARG 57.A O no hydrogen 2.846 N/A GLY 62.A N LEU 59.A O no hydrogen 3.034 N/A ILE 63.A N LEU 58.A O no hydrogen 2.863 N/A LEU 64.A N LEU 58.A O no hydrogen 3.182 N/A VAL 65.A N THR 152.A O no hydrogen 2.906 N/A CYS 67.A N GLN 150.A O no hydrogen 3.043 N/A SER 69.A N GLN 150.A OE1 no hydrogen 2.895 N/A SER 69.A OG TRP 71.A O no hydrogen 3.489 N/A SER 69.A OG PRO 138.A O no hydrogen 2.723 N/A TRP 71.A N SER 69.A OG no hydrogen 3.032 N/A ASN 72.A N VAL 36.A O no hydrogen 2.964 N/A ASN 72.A ND2 ILE 38.A O no hydrogen 2.949 N/A THR 73.A N ALA 141.A O no hydrogen 3.084 N/A LEU 75.A N GLN 40.A OE1 no hydrogen 2.829 N/A LEU 76.A N VAL 84.A O no hydrogen 2.788 N/A TYR 81.A OH GLU 46.A OE2 no hydrogen 2.930 N/A GLN 85.A NE2 THR 73.A OG1 no hydrogen 2.842 N/A GLN 85.A NE2 PHE 140.A O no hydrogen 2.899 N/A ASP 86.A N PRO 74.A O no hydrogen 2.905 N/A ARG 88.A N ASP 86.A OD1 no hydrogen 3.105 N/A ARG 88.A NE ASP 86.A OD1 no hydrogen 2.899 N/A ARG 88.A NH2 ASP 86.A OD2 no hydrogen 2.933 N/A ASN 91.A N LEU 87.A O no hydrogen 2.800 N/A ASN 91.A ND2 GLY 159.A O no hydrogen 3.162 N/A LYS 92.A N ARG 88.A O no hydrogen 3.035 N/A LYS 92.A NZ GLU 89.A OE2 no hydrogen 3.034 N/A ARG 93.A N VAL 90.A O no hydrogen 2.866 N/A ARG 93.A NH1 GLU 89.A O no hydrogen 2.855 N/A ARG 93.A NH1 GLU 89.A OE1 no hydrogen 2.811 N/A VAL 94.A N ASN 91.A O no hydrogen 3.235 N/A GLU 95.A N PRO 28.A O no hydrogen 3.035 N/A THR 100.A OG1 GLU 169.A OE2 no hydrogen 2.659 N/A ASN 106.A N ASN 103.A OD1 no hydrogen 2.983 N/A LEU 107.A N ASN 103.A O no hydrogen 2.904 N/A LEU 108.A N PRO 104.A O no hydrogen 2.913 N/A SER 109.A N ASN 106.A O no hydrogen 3.092 N/A SER 109.A OG ASN 106.A O no hydrogen 2.555 N/A GLY 110.A N LEU 107.A O no hydrogen 3.294 N/A LEU 111.A N LEU 108.A O no hydrogen 3.050 N/A SER 114.A OG HIS 115.A ND1 no hydrogen 2.888 N/A HIS 115.A N PRO 112.A O no hydrogen 3.246 N/A HIS 115.A ND1 SER 114.A OG no hydrogen 2.888 N/A HIS 115.A NE2 ASP 184.A O no hydrogen 3.049 N/A GLN 116.A NE2 PRO 113.A O no hydrogen 3.113 N/A TRP 117.A N ALA 198.A O no hydrogen 3.273 N/A TYR 118.A N GLN 231.A O no hydrogen 2.759 N/A THR 119.A N LEU 196.A O no hydrogen 2.829 N/A THR 119.A OG1 THR 208.A OG1 no hydrogen 2.757 N/A VAL 120.A N GLN 228.A O no hydrogen 2.752 N/A LEU 121.A N LEU 194.A O no hydrogen 3.022 N/A LEU 123.A N ASP 192.A O no hydrogen 2.898 N/A LYS 124.A N ARG 221.A O no hydrogen 2.751 N/A CYS 129.A N ALA 126.A O no hydrogen 2.931 N/A CYS 129.A SG ASP 125.A O no hydrogen 3.605 N/A CYS 129.A SG GLY 219.A O no hydrogen 3.950 N/A LEU 130.A N PHE 127.A O no hydrogen 2.976 N/A ARG 131.A NH2 GLN 22.A O no hydrogen 2.876 N/A LEU 132.A N THR 154.A O no hydrogen 2.883 N/A HIS 133.A N LEU 25.A O no hydrogen 2.772 N/A THR 135.A N HIS 133.A ND1 no hydrogen 2.979 N/A THR 135.A OG1 HIS 133.A ND1 no hydrogen 3.206 N/A SER 136.A N HIS 133.A O no hydrogen 2.851 N/A GLN 137.A N HIS 133.A O no hydrogen 3.112 N/A GLN 137.A NE2 LEU 132.A O no hydrogen 3.006 N/A LEU 139.A N SER 136.A O no hydrogen 3.184 N/A PHE 140.A N GLN 137.A O no hydrogen 3.166 N/A ALA 141.A N PRO 138.A O no hydrogen 3.417 N/A PHE 142.A N LEU 151.A O no hydrogen 2.941 N/A TRP 144.A N GLY 149.A O no hydrogen 2.812 N/A GLY 149.A N TRP 144.A O no hydrogen 3.247 N/A GLN 150.A NE2 SER 69.A O no hydrogen 3.153 N/A GLN 150.A NE2 TRP 71.A O no hydrogen 2.897 N/A GLN 150.A NE2 ASN 72.A OD1 no hydrogen 3.033 N/A LEU 151.A N PHE 142.A O no hydrogen 2.855 N/A THR 152.A N VAL 65.A O no hydrogen 2.842 N/A THR 152.A OG1 GLN 137.A O no hydrogen 2.692 N/A TRP 153.A N THR 152.A OG1 no hydrogen 2.827 N/A TRP 153.A NE1 GLN 85.A OE1 no hydrogen 2.849 N/A THR 154.A N ILE 63.A O no hydrogen 2.863 N/A THR 154.A OG1 GLY 62.A O no hydrogen 2.752 N/A THR 154.A OG1 ILE 63.A O no hydrogen 3.427 N/A ARG 155.A NH1 GLY 17.A O no hydrogen 3.223 N/A ARG 155.A NH1 PHE 128.A O no hydrogen 2.622 N/A LEU 156.A N LEU 130.A O no hydrogen 2.918 N/A LYS 161.A N ASN 91.A OD1 no hydrogen 2.823 N/A LYS 161.A NZ ASN 91.A O no hydrogen 2.956 N/A LYS 161.A NZ VAL 94.A O no hydrogen 2.815 N/A LYS 161.A NZ ASP 96.A OD1 no hydrogen 2.735 N/A ASN 162.A ND2 GLU 95.A O no hydrogen 3.492 N/A SER 163.A N PHE 160.A O no hydrogen 3.102 N/A SER 163.A OG PRO 157.A O no hydrogen 2.825 N/A LEU 166.A N ASN 162.A O no hydrogen 2.935 N/A PHE 167.A N SER 163.A O no hydrogen 2.870 N/A ASP 168.A N PRO 164.A O no hydrogen 2.996 N/A GLU 169.A N THR 165.A O no hydrogen 2.954 N/A ALA 170.A N LEU 166.A O no hydrogen 3.006 N/A LEU 171.A N PHE 167.A O no hydrogen 2.910 N/A HIS 172.A N ASP 168.A O no hydrogen 3.023 N/A ARG 173.A N GLU 169.A O no hydrogen 3.096 N/A ARG 173.A NE GLN 22.A OE1 no hydrogen 3.123 N/A ARG 173.A NH2 GLN 22.A OE1 no hydrogen 2.750 N/A ASP 174.A N ALA 170.A O no hydrogen 3.009 N/A LEU 175.A N LEU 171.A O no hydrogen 2.806 N/A ARG 179.A N LEU 175.A O no hydrogen 3.182 N/A ARG 179.A NH1 LEU 187.A O no hydrogen 2.998 N/A ARG 179.A NH2 LEU 187.A O no hydrogen 2.923 N/A ARG 179.A NH2 GLN 189.A OE1 no hydrogen 2.987 N/A ILE 180.A N ALA 176.A O no hydrogen 3.227 N/A GLN 181.A N ASP 177.A O no hydrogen 2.756 N/A GLN 181.A NE2 ASP 177.A OD1 no hydrogen 2.973 N/A HIS 182.A N PHE 178.A O no hydrogen 2.982 N/A HIS 182.A ND1 PHE 178.A O no hydrogen 3.112 N/A LEU 185.A N HIS 182.A O no hydrogen 3.124 N/A ILE 186.A N ALA 197.A O no hydrogen 2.923 N/A LEU 188.A N LEU 195.A O no hydrogen 2.808 N/A TYR 190.A N ASP 193.A O no hydrogen 2.865 N/A VAL 191.A N ASP 168.A OD1 no hydrogen 2.871 N/A ASP 193.A N TYR 190.A O no hydrogen 2.931 N/A LEU 194.A N LEU 121.A O no hydrogen 2.871 N/A LEU 195.A N LEU 188.A O no hydrogen 2.981 N/A LEU 196.A N THR 119.A O no hydrogen 2.801 N/A ALA 197.A N ILE 186.A O no hydrogen 2.776 N/A ALA 198.A N TRP 117.A O no hydrogen 2.888 N/A ASP 203.A N SER 200.A OG no hydrogen 3.052 N/A CYS 204.A N SER 200.A O no hydrogen 2.866 N/A CYS 204.A SG TRP 117.A O no hydrogen 3.653 N/A CYS 204.A SG THR 119.A OG1 no hydrogen 3.602 N/A GLN 205.A N GLU 201.A O no hydrogen 2.905 N/A GLN 206.A N LEU 202.A O no hydrogen 2.978 N/A GLY 207.A N ASP 203.A O no hydrogen 2.796 N/A THR 208.A N CYS 204.A O no hydrogen 2.866 N/A THR 208.A OG1 THR 119.A OG1 no hydrogen 2.757 N/A THR 208.A OG1 CYS 204.A O no hydrogen 2.649 N/A ARG 209.A N GLN 205.A O no hydrogen 2.958 N/A ALA 210.A N GLN 206.A O no hydrogen 3.041 N/A LEU 211.A N GLY 207.A O no hydrogen 2.835 N/A LEU 212.A N THR 208.A O no hydrogen 2.911 N/A GLN 213.A N ARG 209.A O no hydrogen 3.001 N/A THR 214.A N ALA 210.A O no hydrogen 2.966 N/A THR 214.A OG1 ALA 210.A O no hydrogen 2.785 N/A LEU 215.A N LEU 211.A O no hydrogen 2.827 N/A GLY 216.A N LEU 212.A O no hydrogen 2.877 N/A ASN 217.A N GLN 213.A O no hydrogen 2.970 N/A LEU 218.A N THR 214.A O no hydrogen 2.967 N/A GLY 219.A N LEU 215.A O no hydrogen 3.157 N/A GLY 219.A N GLY 216.A O no hydrogen 3.111 N/A TYR 220.A N LEU 215.A O no hydrogen 2.960 N/A TYR 220.A OH ASP 174.A OD2 no hydrogen 2.606 N/A ARG 221.A NE GLY 14.A O no hydrogen 3.324 N/A ARG 221.A NE GLY 15.A O no hydrogen 3.150 N/A ARG 221.A NH1 GLY 216.A O no hydrogen 3.189 N/A ARG 221.A NH1 TYR 220.A O no hydrogen 2.938 N/A ARG 221.A NH2 GLY 14.A O no hydrogen 3.252 N/A ALA 222.A N ALA 9.A O no hydrogen 2.811 N/A SER 223.A N ASP 122.A O no hydrogen 2.911 N/A ALA 224.A N GLU 12.A OE1 no hydrogen 2.872 N/A LYS 225.A N GLU 12.A OE2 no hydrogen 3.322 N/A LYS 226.A N SER 223.A OG no hydrogen 3.166 N/A GLN 228.A N VAL 120.A O no hydrogen 2.988 N/A GLN 228.A NE2 LYS 235.A O no hydrogen 2.877 N/A CYS 230.A N THR 119.A OG1 no hydrogen 2.955 N/A GLN 231.A N TYR 118.A O no hydrogen 2.876 N/A VAL 234.A N LEU 241.A O no hydrogen 3.136 N/A LYS 235.A N GLN 228.A OE1 no hydrogen 2.781 N/A TYR 236.A N TYR 239.A O no hydrogen 2.977 N/A TYR 236.A OH ASP 193.A O no hydrogen 2.834 N/A TYR 239.A N TYR 236.A O no hydrogen 2.987 N/A LEU 241.A N VAL 234.A O no hydrogen 2.776 N/A LYS 242.A N GLN 245.A O no hydrogen 3.453 N/A GLN 245.A N LYS 242.A O no hydrogen 2.733 N/A