Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3wht_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 1.A NH1 GLU 62.A OE2 no hydrogen 2.681 N/A ARG 1.A NH1 GLU 64.A OE2 no hydrogen 2.864 N/A ARG 1.A NH2 GLU 64.A OE2 no hydrogen 3.508 N/A ARG 2.A N GLN 206.A O no hydrogen 2.826 N/A ARG 2.A NH1 GLU 4.A OE2 no hydrogen 2.974 N/A GLU 4.A N THR 204.A O no hydrogen 2.833 N/A TYR 7.A N GLU 4.A O no hydrogen 3.207 N/A TYR 7.A OH LYS 55.A O no hydrogen 2.793 N/A SER 8.A N TYR 5.A O no hydrogen 3.250 N/A SER 8.A OG GLU 4.A O no hydrogen 2.821 N/A PHE 9.A N PHE 202.A O no hydrogen 2.863 N/A LEU 14.A N SER 34.A O no hydrogen 2.962 N/A GLN 16.A N THR 20.A O no hydrogen 2.717 N/A GLN 16.A NE2 THR 20.A OG1 no hydrogen 2.656 N/A GLY 19.A N GLN 16.A O no hydrogen 2.869 N/A THR 20.A N ASP 18.A OD1 no hydrogen 3.298 N/A THR 20.A OG1 ASP 18.A OD1 no hydrogen 2.778 N/A TRP 24.A N VAL 21.A O no hydrogen 3.143 N/A TRP 24.A NE1 SER 8.A O no hydrogen 3.131 N/A ALA 25.A N TRP 51.A O no hydrogen 2.758 N/A ALA 27.A N SER 49.A O no hydrogen 2.850 N/A ASN 29.A N ARG 47.A O no hydrogen 2.713 N/A ASN 29.A ND2 GLN 46.A OE1 no hydrogen 2.921 N/A ALA 30.A N ALA 27.A O no hydrogen 3.457 N/A ILE 31.A N ARG 38.A O no hydrogen 2.768 N/A SER 33.A N GLN 36.A O no hydrogen 2.878 N/A SER 33.A OG GLN 36.A O no hydrogen 2.717 N/A ILE 37.A N VAL 199.A O no hydrogen 2.875 N/A ARG 38.A N ILE 31.A O no hydrogen 2.905 N/A ARG 38.A NE ASP 198.A OD1 no hydrogen 2.644 N/A ARG 38.A NH1 ASP 198.A OD1 no hydrogen 3.507 N/A ARG 38.A NH1 ASP 198.A OD2 no hydrogen 2.885 N/A VAL 39.A N HIS 197.A O no hydrogen 2.815 N/A SER 42.A N ASP 196.A OD1 no hydrogen 2.918 N/A SER 42.A OG ASP 196.A OD1 no hydrogen 3.241 N/A SER 42.A OG ASP 196.A OD2 no hydrogen 3.099 N/A LYS 44.A NZ GLY 192.A O no hydrogen 2.907 N/A SER 45.A N GLY 191.A O no hydrogen 2.878 N/A GLN 46.A N THR 190.A OG1 no hydrogen 2.824 N/A GLN 46.A NE2 LYS 44.A O no hydrogen 3.057 N/A GLY 48.A N ALA 188.A O no hydrogen 3.061 N/A SER 49.A N ALA 27.A O no hydrogen 3.102 N/A VAL 50.A N ILE 186.A O no hydrogen 2.842 N/A TRP 51.A N ALA 25.A O no hydrogen 2.854 N/A THR 52.A N PHE 184.A O no hydrogen 2.875 N/A THR 52.A OG1 THR 54.A O no hydrogen 2.948 N/A THR 52.A OG1 PHE 184.A O no hydrogen 3.470 N/A LYS 53.A N PHE 23.A O no hydrogen 2.866 N/A ALA 56.A N GLY 182.A O no hydrogen 2.705 N/A TRP 61.A N TYR 147.A O no hydrogen 2.879 N/A GLU 62.A N PHE 205.A O no hydrogen 2.873 N/A VAL 63.A N ILE 145.A O no hydrogen 2.832 N/A GLU 64.A N LEU 203.A O no hydrogen 2.831 N/A VAL 65.A N ALA 143.A O no hydrogen 2.818 N/A THR 66.A N SER 201.A O no hydrogen 2.916 N/A PHE 67.A N VAL 141.A O no hydrogen 2.853 N/A ARG 68.A N ASP 198.A O no hydrogen 2.827 N/A ARG 68.A NH1 PRO 138.A O no hydrogen 3.467 N/A ARG 68.A NH2 PRO 138.A O no hydrogen 3.448 N/A THR 70.A N ASP 196.A O no hydrogen 2.937 N/A GLY 71.A N ASN 136.A OD1 no hydrogen 2.879 N/A ASP 78.A N ALA 189.A O no hydrogen 2.742 N/A LEU 80.A N PHE 108.A O no hydrogen 3.150 N/A ALA 81.A N SER 187.A O no hydrogen 2.744 N/A ILE 82.A N ILE 106.A O no hydrogen 2.870 N/A TRP 83.A N GLY 185.A O no hydrogen 2.930 N/A TRP 83.A NE1 SER 187.A OG.A no hydrogen 2.867 N/A TRP 83.A NE1 SER 187.A OG.B no hydrogen 3.108 N/A TYR 84.A N VAL 104.A O no hydrogen 2.950 N/A TYR 84.A OH PRO 179.A O no hydrogen 2.795 N/A ALA 85.A N HIS 183.A O no hydrogen 3.015 N/A GLU 86.A N ASN 102.A O no hydrogen 2.792 N/A GLN 88.A NE2 THR 52.A O no hydrogen 3.214 N/A GLY 92.A N GLY 96.A O no hydrogen 3.297 N/A VAL 94.A N SER 97.A O no hydrogen 2.785 N/A SER 97.A N VAL 94.A O no hydrogen 2.849 N/A SER 97.A OG SER 187.A OG.A no hydrogen 3.217 N/A SER 97.A OG SER 187.A OG.B no hydrogen 2.533 N/A ALA 98.A N LEU 90.A O no hydrogen 2.751 N/A TRP 101.A NE1 GLY 103.A O no hydrogen 3.081 N/A ASN 102.A ND2 GLU 86.A OE1 no hydrogen 2.861 N/A GLY 103.A N ASN 120.A O no hydrogen 2.871 N/A VAL 104.A N TYR 84.A O no hydrogen 2.896 N/A GLY 105.A N ILE 118.A O no hydrogen 2.829 N/A ILE 106.A N ILE 82.A O no hydrogen 2.711 N/A PHE 107.A N VAL 116.A O no hydrogen 2.829 N/A PHE 108.A N LEU 80.A O no hydrogen 2.726 N/A ASP 109.A N ALA 114.A O no hydrogen 2.818 N/A SER 110.A N ASP 78.A O no hydrogen 3.033 N/A ASN 112.A ND2 ASP 109.A O no hydrogen 3.040 N/A ALA 114.A N ASP 109.A O no hydrogen 3.067 N/A ILE 115.A N CYS 130.A O no hydrogen 2.804 N/A VAL 116.A N PHE 107.A O no hydrogen 2.918 N/A ILE 117.A N ALA 128.A O no hydrogen 2.905 N/A ILE 118.A N GLY 105.A O no hydrogen 2.883 N/A ASN 120.A N GLY 103.A O no hydrogen 2.903 N/A ASN 120.A ND2 ILE 124.A O no hydrogen 3.003 N/A GLY 122.A N TRP 101.A O no hydrogen 2.782 N/A LEU 127.A N ILE 117.A O no hydrogen 2.807 N/A CYS 130.A N ILE 115.A O no hydrogen 2.893 N/A GLN 131.A NE2 PRO 113.A O no hydrogen 3.610 N/A ARG 132.A N PRO 113.A O no hydrogen 3.325 N/A ARG 132.A NE GLN 131.A O no hydrogen 2.945 N/A ARG 132.A NH1 PHE 169.A O no hydrogen 3.249 N/A ARG 132.A NH2 PHE 169.A O no hydrogen 3.280 N/A ARG 135.A N ASP 133.A OD1 no hydrogen 3.179 N/A ARG 135.A NE ASP 195.A OD2 no hydrogen 2.733 N/A ARG 135.A NH1 GLY 73.A O no hydrogen 3.155 N/A ARG 135.A NH2 GLY 73.A O no hydrogen 2.987 N/A ARG 135.A NH2 ASP 195.A OD1 no hydrogen 2.892 N/A ARG 135.A NH2 ASP 195.A OD2 no hydrogen 3.524 N/A ASN 136.A N VAL 69.A O no hydrogen 2.804 N/A ASN 136.A ND2 GLY 71.A O no hydrogen 2.920 N/A LYS 137.A NZ ARG 135.A O no hydrogen 2.758 N/A TYR 139.A N GLY 159.A O no hydrogen 2.912 N/A VAL 141.A N PHE 67.A O no hydrogen 2.942 N/A ARG 142.A N ASN 157.A O no hydrogen 2.944 N/A ARG 142.A NE THR 66.A OG1 no hydrogen 2.730 N/A ARG 142.A NH2 LYS 164.A O no hydrogen 3.013 N/A ALA 143.A N VAL 65.A O no hydrogen 2.811 N/A LYS 144.A N MET 155.A O no hydrogen 2.873 N/A ILE 145.A N VAL 63.A O no hydrogen 2.830 N/A THR 146.A N THR 153.A O no hydrogen 2.907 N/A THR 146.A OG1 GLU 62.A OE1 no hydrogen 2.501 N/A TYR 147.A N TRP 61.A O no hydrogen 2.805 N/A TYR 147.A OH MET 176.A O no hydrogen 2.644 N/A TYR 148.A N THR 151.A O no hydrogen 2.986 N/A GLN 149.A N ASN 60.A OD1 no hydrogen 2.927 N/A THR 151.A N TYR 148.A O no hydrogen 3.051 N/A THR 151.A OG1 GLU 174.A OE1 no hydrogen 3.289 N/A LEU 152.A N VAL 173.A O no hydrogen 2.868 N/A THR 153.A N THR 146.A O no hydrogen 2.889 N/A VAL 154.A N ALA 171.A O no hydrogen 2.842 N/A MET 155.A N LYS 144.A O no hydrogen 2.816 N/A ILE 156.A N GLU 168.A O no hydrogen 2.813 N/A ASN 157.A N ARG 142.A O no hydrogen 2.815 N/A ASN 157.A ND2 ASP 163.A O no hydrogen 2.825 N/A ASN 158.A ND2 ASP 133.A O no hydrogen 3.017 N/A ASN 158.A ND2 ASN 158.A O no hydrogen 2.595 N/A GLY 159.A N ASN 157.A OD1 no hydrogen 3.118 N/A ASP 163.A N THR 161.A OG1 no hydrogen 3.204 N/A ASN 165.A N ASP 163.A OD1 no hydrogen 3.125 N/A ASP 166.A N ASP 163.A O no hydrogen 3.093 N/A TYR 167.A N ASN 165.A O no hydrogen 3.036 N/A TYR 167.A OH GLU 64.A OE1 no hydrogen 2.846 N/A GLU 168.A N ILE 156.A O no hydrogen 2.797 N/A CYS 170.A N VAL 154.A O no hydrogen 2.990 N/A ALA 171.A N VAL 154.A O no hydrogen 3.291 N/A VAL 173.A N LEU 152.A O no hydrogen 2.723 N/A MET 176.A N ASN 150.A O no hydrogen 2.823 N/A GLY 182.A N ALA 56.A O no hydrogen 3.128 N/A HIS 183.A N ALA 85.A O no hydrogen 2.771 N/A HIS 183.A ND1 THR 52.A O no hydrogen 2.796 N/A PHE 184.A N THR 52.A OG1 no hydrogen 3.117 N/A GLY 185.A N TRP 83.A O no hydrogen 3.039 N/A ILE 186.A N VAL 50.A O no hydrogen 2.809 N/A SER 187.A N ALA 81.A O no hydrogen 2.970 N/A SER 187.A OG.A PHE 95.A O no hydrogen 2.668 N/A SER 187.A OG.A SER 97.A OG no hydrogen 3.217 N/A SER 187.A OG.B SER 97.A OG no hydrogen 2.533 N/A ALA 188.A N GLY 48.A O no hydrogen 2.994 N/A ALA 189.A N GLY 79.A O no hydrogen 3.305 N/A THR 190.A N GLN 46.A O no hydrogen 3.028 N/A THR 190.A OG1 LEU 43.A O no hydrogen 2.688 N/A GLY 191.A N LEU 193.A O no hydrogen 3.039 N/A ASP 195.A N ALA 77.A O no hydrogen 3.146 N/A ASP 196.A N THR 70.A O no hydrogen 2.846 N/A HIS 197.A N ALA 40.A O no hydrogen 2.903 N/A ASP 198.A N ARG 68.A O no hydrogen 2.829 N/A VAL 199.A N ILE 37.A O no hydrogen 2.806 N/A LEU 200.A N THR 66.A O no hydrogen 2.805 N/A SER 201.A N THR 66.A O no hydrogen 3.424 N/A PHE 202.A N PHE 9.A O no hydrogen 2.958 N/A LEU 203.A N GLU 64.A O no hydrogen 2.937 N/A THR 204.A N SER 8.A OG no hydrogen 2.885 N/A THR 204.A OG1 TYR 7.A O no hydrogen 2.700 N/A PHE 205.A N GLU 62.A O no hydrogen 2.733 N/A GLN 206.A N ARG 2.A O no hydrogen 2.903 N/A GLN 206.A NE2 GLU 4.A OE2 no hydrogen 3.064 N/A LEU 207.A N ASN 60.A O no hydrogen 2.948 N/A