Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5fdh_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 5.A N GLY 33.A O no hydrogen 2.921 N/A ASN 7.A N THR 35.A O no hydrogen 2.694 N/A SER 9.A OG ASN 7.A OD1 no hydrogen 3.215 N/A TRP 10.A N ASN 7.A O no hydrogen 3.293 N/A TRP 10.A NE1 GLU 235.A OE2 no hydrogen 3.156 N/A ASN 11.A N LYS 8.A O no hydrogen 3.031 N/A HIS 13.A N TRP 10.A O no hydrogen 2.998 N/A HIS 13.A NE2 GLN 234.A OE1 no hydrogen 2.698 N/A THR 15.A N ASN 11.A O no hydrogen 2.908 N/A THR 15.A OG1 ASN 11.A O no hydrogen 3.135 N/A GLU 16.A N ALA 12.A O no hydrogen 2.864 N/A HIS 17.A N PHE 14.A O no hydrogen 3.234 N/A HIS 17.A NE2 GLU 230.A OE2 no hydrogen 2.760 N/A LYS 18.A N THR 15.A O no hydrogen 2.825 N/A SER 19.A N PHE 14.A O no hydrogen 2.847 N/A SER 19.A OG HIS 17.A O no hydrogen 2.993 N/A VAL 22.A N ASN 212.A O no hydrogen 2.843 N/A VAL 23.A N ASN 36.A OD1 no hydrogen 2.816 N/A VAL 24.A N ALA 210.A O no hydrogen 2.825 N/A LEU 25.A N PHE 34.A O no hydrogen 2.775 N/A TRP 26.A N PHE 208.A O no hydrogen 2.877 N/A TRP 26.A NE1 GLN 31.A OE1 no hydrogen 3.086 N/A ASN 27.A N GLN 32.A O no hydrogen 2.773 N/A GLU 28.A N VAL 206.A O no hydrogen 3.186 N/A ASN 29.A N ASN 205.A OD1 no hydrogen 3.023 N/A ASN 29.A ND2 ASP 204.A O no hydrogen 2.745 N/A LYS 30.A N ASN 27.A OD1 no hydrogen 3.091 N/A GLN 32.A N ASN 27.A O no hydrogen 3.214 N/A GLY 33.A N GLU 3.A O no hydrogen 2.792 N/A PHE 34.A N LEU 25.A O no hydrogen 2.798 N/A THR 35.A N GLN 5.A O no hydrogen 3.009 N/A THR 35.A OG1 VAL 23.A O no hydrogen 2.895 N/A ASN 36.A ND2 ASN 11.A OD1 no hydrogen 3.069 N/A ASN 36.A ND2 GLY 21.A O no hydrogen 3.103 N/A ASN 37.A N THR 35.A OG1 no hydrogen 3.418 N/A LEU 38.A N GLU 6.A OE1 no hydrogen 2.796 N/A ARG 40.A N ASN 37.A OD1 no hydrogen 3.113 N/A ARG 40.A NE ASN 212.A OD1 no hydrogen 2.832 N/A ARG 40.A NH1 ASN 212.A OD1 no hydrogen 3.003 N/A ARG 40.A NH1 ASP 214.A OD1 no hydrogen 2.886 N/A ARG 40.A NH2 ASP 214.A OD1 no hydrogen 2.894 N/A ALA 41.A N ASN 37.A O no hydrogen 2.924 N/A ASN 42.A N LYS 39.A O no hydrogen 3.142 N/A ASN 42.A ND2 LEU 38.A O no hydrogen 2.812 N/A GLN 43.A N ARG 40.A O no hydrogen 3.066 N/A PHE 45.A N ILE 142.A O no hydrogen 2.762 N/A THR 50.A N PRO 47.A O no hydrogen 3.305 N/A THR 50.A OG1 PRO 47.A O no hydrogen 2.682 N/A PHE 51.A N ALA 48.A O no hydrogen 3.034 N/A ASN 54.A N PHE 51.A O no hydrogen 2.990 N/A ASN 54.A ND2 TYR 101.A O no hydrogen 3.633 N/A LEU 56.A N ILE 52.A O no hydrogen 3.239 N/A ILE 57.A N PRO 53.A O no hydrogen 2.992 N/A ALA 58.A N ASN 54.A O no hydrogen 2.987 N/A LEU 59.A N SER 55.A O no hydrogen 2.933 N/A ASP 60.A N LEU 56.A O no hydrogen 2.908 N/A LEU 61.A N ILE 57.A O no hydrogen 3.018 N/A GLY 62.A N LEU 59.A O no hydrogen 3.185 N/A VAL 64.A N ALA 58.A O no hydrogen 3.187 N/A LYS 65.A N GLN 69.A OE1 no hydrogen 2.725 N/A LYS 65.A NZ ASP 66.A OD2 no hydrogen 3.412 N/A GLU 67.A N GLU 67.A OE2 no hydrogen 2.763 N/A HIS 68.A N ASP 66.A OD1 no hydrogen 2.869 N/A GLN 69.A N ASP 66.A O no hydrogen 3.415 N/A GLN 69.A N ASP 66.A OD1 no hydrogen 3.104 N/A PHE 71.A N HIS 87.A O no hydrogen 2.760 N/A TRP 73.A N ASP 86.A OD1 no hydrogen 2.972 N/A TRP 73.A NE1 GLN 76.A O no hydrogen 2.760 N/A GLN 76.A N ASP 74.A OD1 no hydrogen 3.148 N/A ARG 78.A N ASN 84.A OD1 no hydrogen 2.885 N/A ARG 78.A NH1 ASP 74.A OD2 no hydrogen 3.120 N/A ARG 78.A NH2 ASP 74.A OD1 no hydrogen 2.965 N/A TRP 83.A N ILE 80.A O no hydrogen 3.030 N/A TRP 83.A NE1 TYR 95.A O no hydrogen 2.980 N/A ASN 84.A N ALA 81.A O no hydrogen 3.124 N/A ASN 84.A ND2 ARG 78.A O no hydrogen 3.119 N/A HIS 87.A N PHE 71.A O no hydrogen 3.077 N/A HIS 87.A ND1 THR 91.A OG1 no hydrogen 2.871 N/A HIS 87.A NE2 THR 82.A O no hydrogen 2.678 N/A ASN 88.A N THR 91.A OG1 no hydrogen 3.173 N/A THR 91.A N ASN 88.A OD1 no hydrogen 3.096 N/A THR 91.A OG1 HIS 87.A ND1 no hydrogen 2.871 N/A THR 91.A OG1 ASN 88.A O no hydrogen 3.511 N/A THR 91.A OG1 ASN 88.A OD1 no hydrogen 3.527 N/A ALA 92.A N ASN 88.A O no hydrogen 2.922 N/A MET 93.A N LEU 89.A O no hydrogen 3.080 N/A LYS 94.A N ILE 90.A O no hydrogen 3.063 N/A LYS 94.A NZ TYR 95.A OH no hydrogen 3.409 N/A TYR 95.A N THR 91.A O no hydrogen 2.888 N/A SER 96.A N MET 93.A O no hydrogen 3.119 N/A VAL 97.A N ALA 92.A O no hydrogen 2.898 N/A TYR 101.A N VAL 97.A O no hydrogen 3.474 N/A TYR 101.A OH SER 55.A OG no hydrogen 2.830 N/A GLN 102.A N VAL 98.A O no hydrogen 2.875 N/A GLN 102.A NE2 ASP 132.A O no hydrogen 2.971 N/A GLU 103.A N PRO 99.A O no hydrogen 3.186 N/A PHE 104.A N VAL 100.A O no hydrogen 3.151 N/A ALA 105.A N TYR 101.A O no hydrogen 2.965 N/A ARG 106.A N GLN 102.A O no hydrogen 3.063 N/A ARG 106.A NH1 ASP 132.A OD2 no hydrogen 2.918 N/A ARG 106.A NH2 GLU 103.A OE1 no hydrogen 3.035 N/A GLN 107.A N GLU 103.A O no hydrogen 3.114 N/A ILE 108.A N PHE 104.A O no hydrogen 2.902 N/A GLY 109.A N ALA 105.A O no hydrogen 2.821 N/A ARG 112.A NE ILE 108.A O no hydrogen 2.913 N/A ARG 112.A NH1 GLN 107.A O no hydrogen 2.873 N/A ARG 112.A NH1 ILE 108.A O no hydrogen 3.281 N/A MET 113.A N GLY 109.A O no hydrogen 3.071 N/A SER 114.A N GLU 110.A O no hydrogen 3.013 N/A LYS 115.A N ALA 111.A O no hydrogen 3.048 N/A MET 116.A N ARG 112.A O no hydrogen 3.106 N/A LEU 117.A N MET 113.A O no hydrogen 2.977 N/A HIS 118.A N SER 114.A O no hydrogen 3.056 N/A ALA 119.A N LYS 115.A O no hydrogen 2.852 N/A PHE 120.A N MET 116.A O no hydrogen 2.892 N/A ASP 121.A N HIS 118.A O no hydrogen 3.213 N/A TYR 122.A N LEU 117.A O no hydrogen 3.028 N/A ASN 124.A N ARG 141.A O no hydrogen 3.023 N/A ASN 124.A ND2 GLY 139.A O no hydrogen 2.876 N/A GLU 125.A N TYR 122.A O no hydrogen 3.130 N/A SER 128.A OG ASP 126.A OD1 no hydrogen 2.918 N/A SER 128.A OG ASP 126.A OD2 no hydrogen 2.706 N/A SER 133.A N ASN 130.A O no hydrogen 3.250 N/A PHE 134.A N ASN 130.A O no hydrogen 2.978 N/A LEU 136.A N SER 133.A O no hydrogen 2.837 N/A ASP 137.A N SER 133.A O no hydrogen 2.840 N/A GLY 138.A N PHE 134.A O no hydrogen 2.807 N/A GLY 139.A N SER 128.A O no hydrogen 2.943 N/A ARG 141.A N ASN 124.A OD1 no hydrogen 2.814 N/A ARG 141.A NH1 GLY 138.A O no hydrogen 2.804 N/A ARG 141.A NH1 ILE 140.A O no hydrogen 2.939 N/A ARG 141.A NH2 GLY 138.A O no hydrogen 3.519 N/A ILE 142.A N PHE 45.A O no hydrogen 2.775 N/A SER 143.A N GLU 146.A OE1 no hydrogen 3.072 N/A SER 143.A OG THR 145.A OG1 no hydrogen 3.333 N/A THR 145.A N ALA 41.A O no hydrogen 3.158 N/A THR 145.A OG1 ASN 42.A OD1 no hydrogen 2.869 N/A THR 145.A OG1 SER 143.A OG no hydrogen 3.333 N/A GLU 146.A N SER 143.A OG no hydrogen 3.159 N/A GLN 147.A N SER 143.A O no hydrogen 2.904 N/A GLN 147.A NE2 THR 50.A OG1 no hydrogen 2.865 N/A ILE 148.A N ALA 144.A O no hydrogen 3.193 N/A SER 149.A N THR 145.A O no hydrogen 3.083 N/A SER 149.A OG THR 145.A O no hydrogen 3.186 N/A PHE 150.A N GLU 146.A O no hydrogen 3.142 N/A LEU 151.A N GLN 147.A O no hydrogen 2.914 N/A ARG 152.A N ILE 148.A O no hydrogen 2.901 N/A ARG 152.A NE GLU 28.A OE2 no hydrogen 2.714 N/A ARG 152.A NH1 GLU 28.A OE1 no hydrogen 3.043 N/A ARG 152.A NH1 GLU 28.A OE2 no hydrogen 3.526 N/A LYS 153.A N SER 149.A O no hydrogen 3.363 N/A LEU 154.A N PHE 150.A O no hydrogen 3.064 N/A TYR 155.A N LEU 151.A O no hydrogen 2.821 N/A HIS 156.A N ARG 152.A O no hydrogen 3.102 N/A HIS 156.A NE2 GLU 28.A OE1 no hydrogen 2.697 N/A ASN 157.A N LEU 154.A O no hydrogen 3.071 N/A LYS 158.A N LYS 153.A O no hydrogen 2.763 N/A LEU 159.A N GLN 166.A OE1 no hydrogen 3.023 N/A VAL 161.A N LEU 159.A O no hydrogen 2.894 N/A SER 162.A OG SER 165.A OG no hydrogen 2.894 N/A ARG 164.A NH1 LYS 65.A O no hydrogen 2.807 N/A ARG 164.A NH2 LYS 65.A O no hydrogen 3.490 N/A SER 165.A N SER 162.A OG no hydrogen 3.070 N/A SER 165.A OG SER 162.A OG no hydrogen 2.894 N/A GLN 166.A N SER 162.A O no hydrogen 3.391 N/A GLN 166.A NE2 ASN 157.A O no hydrogen 3.292 N/A GLN 166.A NE2 SER 162.A O no hydrogen 3.192 N/A ARG 167.A N GLU 163.A O no hydrogen 2.868 N/A ARG 167.A NE GLU 163.A OE2 no hydrogen 2.760 N/A ARG 167.A NH2 GLU 163.A OE2 no hydrogen 3.122 N/A ILE 168.A N ARG 164.A O no hydrogen 2.876 N/A VAL 169.A N SER 165.A O no hydrogen 3.115 N/A LYS 170.A N GLN 166.A O no hydrogen 3.003 N/A LYS 170.A NZ LEU 154.A O no hydrogen 2.941 N/A LYS 170.A NZ TYR 155.A O no hydrogen 2.852 N/A LYS 170.A NZ ASN 157.A OD1 no hydrogen 2.696 N/A GLN 171.A N ARG 167.A O no hydrogen 2.966 N/A ALA 172.A N ILE 168.A O no hydrogen 2.926 N/A MET 173.A N VAL 169.A O no hydrogen 2.913 N/A LEU 174.A N GLN 171.A O no hydrogen 3.089 N/A THR 175.A N ILE 183.A O no hydrogen 2.957 N/A THR 175.A OG1 MET 173.A O no hydrogen 2.888 N/A GLU 176.A N ILE 183.A O no hydrogen 3.211 N/A ASN 178.A N TYR 181.A O no hydrogen 3.066 N/A ASP 180.A N ASN 178.A OD1 no hydrogen 2.815 N/A TYR 181.A N ASN 178.A OD1 no hydrogen 2.972 N/A TYR 181.A OH GLU 176.A OE2 no hydrogen 2.839 N/A ILE 182.A N GLU 201.A O no hydrogen 3.044 N/A ILE 183.A N GLU 176.A O no hydrogen 2.738 N/A ARG 184.A N TRP 199.A O no hydrogen 3.245 N/A ARG 184.A NE GLU 201.A OE1 no hydrogen 2.977 N/A ARG 184.A NH1 LYS 170.A O no hydrogen 2.855 N/A ALA 185.A N MET 173.A O no hydrogen 2.895 N/A LYS 186.A N VAL 197.A O no hydrogen 2.789 N/A LYS 186.A NZ SER 96.A OG no hydrogen 2.758 N/A LYS 186.A NZ THR 187.A O no hydrogen 2.865 N/A GLY 188.A N TRP 195.A O no hydrogen 2.959 N/A SER 190.A N ILE 193.A O no hydrogen 3.227 N/A ILE 193.A N SER 190.A O no hydrogen 2.988 N/A GLY 194.A N MET 213.A O no hydrogen 2.953 N/A TRP 195.A N GLY 188.A O no hydrogen 2.765 N/A TRP 195.A NE1 LEU 46.A O no hydrogen 2.795 N/A TRP 196.A N MET 211.A O no hydrogen 3.045 N/A VAL 197.A N LYS 186.A O no hydrogen 3.128 N/A GLY 198.A N PHE 209.A O no hydrogen 2.894 N/A TRP 199.A N ARG 184.A O no hydrogen 2.921 N/A TRP 199.A NE1 GLU 201.A OE1 no hydrogen 2.934 N/A VAL 200.A N TRP 207.A O no hydrogen 2.732 N/A GLU 201.A N ILE 182.A O no hydrogen 2.748 N/A LEU 202.A N ASN 205.A O no hydrogen 2.916 N/A ASN 205.A ND2 ASN 27.A OD1 no hydrogen 2.766 N/A VAL 206.A N ASN 205.A OD1 no hydrogen 2.786 N/A TRP 207.A N VAL 200.A O no hydrogen 2.844 N/A PHE 208.A N TRP 26.A O no hydrogen 2.919 N/A PHE 209.A N GLY 198.A O no hydrogen 2.785 N/A ALA 210.A N VAL 24.A O no hydrogen 2.950 N/A MET 211.A N TRP 196.A O no hydrogen 2.773 N/A ASN 212.A N VAL 22.A O no hydrogen 3.055 N/A MET 213.A N GLY 194.A O no hydrogen 2.874 N/A ASP 214.A N GLN 20.A O no hydrogen 2.976 N/A MET 215.A N LYS 192.A O no hydrogen 2.719 N/A THR 217.A OG1 ASP 219.A OD2 no hydrogen 2.920 N/A LEU 223.A N GLY 220.A O no hydrogen 3.149 N/A ARG 224.A N LEU 221.A O no hydrogen 3.372 N/A ARG 224.A NE LEU 221.A O no hydrogen 2.797 N/A ARG 224.A NH1 LEU 221.A O no hydrogen 3.536 N/A ARG 224.A NH2 GLY 188.A O no hydrogen 2.883 N/A GLN 225.A N GLN 225.A OE1 no hydrogen 2.937 N/A ALA 226.A N GLY 222.A O no hydrogen 3.115 N/A ILE 227.A N LEU 223.A O no hydrogen 2.812 N/A THR 228.A N ARG 224.A O no hydrogen 3.497 N/A THR 228.A OG1 ARG 224.A O no hydrogen 2.718 N/A LYS 229.A N GLN 225.A O no hydrogen 2.948 N/A LYS 229.A NZ GLU 176.A OE1 no hydrogen 2.792 N/A GLU 230.A N ALA 226.A O no hydrogen 3.054 N/A VAL 231.A N ILE 227.A O no hydrogen 3.126 N/A LEU 232.A N THR 228.A O no hydrogen 2.920 N/A LYS 233.A N LYS 229.A O no hydrogen 2.894 N/A LYS 233.A NZ GLU 241.A OE1 no hydrogen 3.391 N/A GLN 234.A N GLU 230.A O no hydrogen 3.022 N/A GLN 234.A NE2 SER 9.A OG no hydrogen 3.022 N/A GLU 235.A N VAL 231.A O no hydrogen 3.003 N/A LYS 236.A N LYS 233.A O no hydrogen 3.148 N/A ILE 237.A N LEU 232.A O no hydrogen 2.859 N/A ILE 238.A N LEU 232.A O no hydrogen 3.446 N/A