Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4er8_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 6.A NH1 PHE 98.A O no hydrogen 2.896 N/A ARG 6.A NH2 PHE 98.A O no hydrogen 2.722 N/A TYR 7.A N GLU 100.A OE2 no hydrogen 3.016 N/A TYR 8.A OH SER 74.A OG no hydrogen 2.734 N/A GLY 11.A N ASP 70.A O no hydrogen 3.134 N/A GLY 12.A N ILE 9.A O no hydrogen 3.202 N/A THR 13.A OG1 THR 65.A OG1 no hydrogen 2.650 N/A TRP 14.A N TRP 64.A O no hydrogen 2.953 N/A TRP 14.A NE1 TYR 7.A O no hydrogen 2.861 N/A PHE 15.A N HIS 101.A O no hydrogen 2.790 N/A PHE 16.A N CYS 62.A O no hydrogen 2.784 N/A THR 17.A N TRP 99.A O no hydrogen 3.167 N/A THR 17.A OG1 HIS 61.A ND1 no hydrogen 2.702 N/A THR 17.A OG1 ALA 159.A O no hydrogen 2.507 N/A VAL 18.A N MET 60.A O no hydrogen 2.846 N/A LEU 20.A N GLU 58.A O no hydrogen 2.897 N/A ARG 21.A N ILE 93.A O no hydrogen 2.660 N/A ARG 21.A NH1 ASN 92.A OD1 no hydrogen 3.205 N/A ARG 23.A NH2 ILE 163.A O no hydrogen 3.073 N/A ARG 24.A N ASN 22.A OD1 no hydrogen 3.127 N/A SER 25.A N ASN 22.A O no hydrogen 3.069 N/A LEU 27.A N SER 25.A OG no hydrogen 3.215 N/A LEU 28.A N PRO 57.A O no hydrogen 2.942 N/A THR 29.A N GLN 26.A O no hydrogen 3.094 N/A THR 30.A N GLN 26.A O no hydrogen 2.814 N/A THR 30.A OG1 GLN 26.A O no hydrogen 3.166 N/A GLN 31.A N LEU 27.A O no hydrogen 2.965 N/A TYR 32.A N THR 29.A O no hydrogen 2.731 N/A LEU 35.A N GLN 31.A O no hydrogen 3.171 N/A ARG 36.A N TYR 32.A O no hydrogen 2.753 N/A HIS 37.A N GLN 33.A O no hydrogen 2.720 N/A ALA 38.A N MET 34.A O no hydrogen 2.760 N/A ILE 39.A N LEU 35.A O no hydrogen 3.076 N/A ILE 40.A N ARG 36.A O no hydrogen 3.128 N/A LYS 41.A N HIS 37.A O no hydrogen 2.975 N/A VAL 42.A N ALA 38.A O no hydrogen 3.156 N/A LYS 43.A N ILE 39.A O no hydrogen 2.807 N/A LYS 43.A NZ PHE 48.A O no hydrogen 2.592 N/A ARG 44.A N ILE 40.A O no hydrogen 3.070 N/A ARG 46.A N VAL 42.A O no hydrogen 2.866 N/A GLU 49.A N THR 65.A O no hydrogen 2.941 N/A ASN 51.A N ILE 63.A O no hydrogen 2.850 N/A ASN 51.A ND2 THR 65.A OG1 no hydrogen 2.532 N/A ALA 52.A N ILE 63.A O no hydrogen 3.324 N/A TRP 53.A N THR 136.A OG1 no hydrogen 3.216 N/A VAL 54.A N HIS 61.A O no hydrogen 2.994 N/A VAL 55.A N PHE 134.A O no hydrogen 2.978 N/A LEU 56.A N HIS 59.A O no hydrogen 2.719 N/A HIS 59.A ND1 GLU 58.A OE1 no hydrogen 2.678 N/A HIS 59.A NE2 HIS 61.A NE2 no hydrogen 2.874 N/A MET 60.A N VAL 18.A O no hydrogen 2.762 N/A HIS 61.A N VAL 54.A O no hydrogen 3.336 N/A HIS 61.A ND1 THR 17.A OG1 no hydrogen 2.702 N/A HIS 61.A NE2 HIS 59.A NE2 no hydrogen 2.874 N/A CYS 62.A N PHE 16.A O no hydrogen 2.872 N/A ILE 63.A N ALA 52.A O no hydrogen 2.774 N/A TRP 64.A N TRP 14.A O no hydrogen 2.913 N/A THR 65.A N GLU 49.A O no hydrogen 2.982 N/A THR 65.A OG1 THR 13.A OG1 no hydrogen 2.650 N/A LEU 66.A N GLY 12.A O no hydrogen 3.048 N/A GLY 69.A N GLU 68.A OE1 no hydrogen 3.120 N/A ASP 70.A N PRO 67.A O no hydrogen 3.239 N/A ASP 72.A N ASP 70.A OD2 no hydrogen 2.900 N/A PHE 73.A N ASP 71.A O no hydrogen 3.166 N/A SER 74.A OG TYR 8.A OH no hydrogen 2.734 N/A SER 75.A N ASP 72.A OD2 no hydrogen 2.749 N/A SER 75.A OG ASP 72.A OD1 no hydrogen 2.482 N/A SER 75.A OG ASP 72.A OD2 no hydrogen 2.979 N/A ARG 76.A NE ARG 46.A O no hydrogen 3.250 N/A ARG 76.A NE PRO 47.A O no hydrogen 3.448 N/A ARG 76.A NH1 ASP 70.A OD2 no hydrogen 2.785 N/A ARG 76.A NH1 ASP 72.A O no hydrogen 2.783 N/A ARG 76.A NH2 PRO 47.A O no hydrogen 3.080 N/A ARG 76.A NH2 ASP 70.A OD1 no hydrogen 2.150 N/A TRP 77.A N PHE 73.A O no hydrogen 2.954 N/A ARG 78.A N SER 74.A O no hydrogen 2.812 N/A GLU 79.A N SER 75.A O no hydrogen 2.818 N/A ILE 80.A N ARG 76.A O no hydrogen 3.065 N/A LYS 81.A N TRP 77.A O no hydrogen 3.154 N/A LYS 81.A NZ GLN 95.A O no hydrogen 3.024 N/A LYS 81.A NZ ARG 97.A O no hydrogen 2.555 N/A LYS 82.A N ARG 78.A O no hydrogen 3.079 N/A LYS 82.A NZ GLU 79.A OE2 no hydrogen 3.289 N/A GLN 83.A N GLU 79.A O no hydrogen 2.774 N/A PHE 84.A N ILE 80.A O no hydrogen 3.119 N/A THR 85.A N LYS 81.A O no hydrogen 2.934 N/A THR 85.A OG1 LYS 81.A O no hydrogen 2.920 N/A HIS 86.A N LYS 82.A O no hydrogen 2.842 N/A ALA 87.A N GLN 83.A O no hydrogen 2.782 N/A CYS 88.A N PHE 84.A O no hydrogen 3.243 N/A CYS 88.A SG PHE 84.A O no hydrogen 2.994 N/A CYS 88.A SG THR 85.A O no hydrogen 3.769 N/A GLY 89.A N HIS 86.A O no hydrogen 2.860 N/A TRP 94.A NE1 LYS 81.A O no hydrogen 3.046 N/A GLN 95.A N ASN 19.A O no hydrogen 2.701 N/A TRP 99.A N THR 17.A O no hydrogen 3.082 N/A HIS 101.A N PHE 15.A O no hydrogen 2.868 N/A HIS 101.A NE2 ASP 108.A OD2 no hydrogen 2.948 N/A ILE 103.A N THR 13.A O no hydrogen 3.066 N/A TYR 109.A N ASN 105.A O no hydrogen 3.147 N/A TYR 109.A OH ASN 51.A OD1 no hydrogen 3.031 N/A ARG 110.A N THR 106.A O no hydrogen 3.034 N/A HIS 111.A N LYS 107.A O no hydrogen 2.924 N/A HIS 112.A N ASP 108.A O no hydrogen 2.968 N/A HIS 112.A ND1 ASP 108.A O no hydrogen 2.823 N/A VAL 113.A N TYR 109.A O no hydrogen 2.730 N/A ASP 114.A N ARG 110.A O no hydrogen 2.893 N/A TYR 115.A N HIS 111.A O no hydrogen 2.872 N/A TYR 115.A OH GLU 161.A OE2 no hydrogen 2.909 N/A ILE 116.A N HIS 112.A O no hydrogen 3.014 N/A TYR 117.A N VAL 113.A O no hydrogen 3.049 N/A TYR 117.A OH THR 136.A OG1 no hydrogen 2.395 N/A TYR 117.A OH ASP 140.A OD2 no hydrogen 2.413 N/A ILE 118.A N ASP 114.A O no hydrogen 2.691 N/A ASN 119.A N ILE 116.A O no hydrogen 3.060 N/A ASN 119.A ND2 GLU 161.A OE2 no hydrogen 3.262 N/A VAL 121.A N ILE 118.A O no hydrogen 2.822 N/A LYS 122.A N ILE 118.A O no hydrogen 3.081 N/A LYS 122.A NZ THR 155.A O no hydrogen 2.942 N/A HIS 123.A N ASN 119.A O no hydrogen 2.864 N/A HIS 123.A NE2 GLU 161.A OE2 no hydrogen 3.087 N/A GLY 124.A N VAL 121.A O no hydrogen 2.929 N/A TRP 125.A N PRO 120.A O no hydrogen 3.021 N/A VAL 126.A N PRO 120.A O no hydrogen 3.446 N/A ASP 131.A N GLN 128.A O no hydrogen 2.740 N/A TRP 132.A N VAL 129.A O no hydrogen 3.464 N/A TRP 132.A NE1 VAL 55.A O no hydrogen 2.933 N/A THR 136.A N TRP 53.A O no hydrogen 3.030 N/A THR 136.A OG1 TRP 53.A O no hydrogen 3.533 N/A THR 136.A OG1 TYR 117.A OH no hydrogen 2.395 N/A PHE 137.A N SER 135.A OG no hydrogen 3.115 N/A HIS 138.A NE2 TRP 132.A O no hydrogen 3.084 N/A ARG 139.A NH1 ILE 50.A O no hydrogen 3.110 N/A ARG 139.A NH2 ASN 51.A O no hydrogen 3.034 N/A ARG 139.A NH2 ASP 140.A OD1 no hydrogen 2.552 N/A ASP 140.A N THR 136.A O no hydrogen 2.854 N/A VAL 141.A N PHE 137.A O no hydrogen 2.758 N/A ALA 142.A N HIS 138.A O no hydrogen 2.985 N/A ALA 142.A N ARG 139.A O no hydrogen 3.246 N/A ARG 143.A N ARG 139.A O no hydrogen 3.285 N/A LEU 145.A N ASP 140.A O no hydrogen 3.268 N/A TYR 146.A OH ASP 114.A OD1 no hydrogen 2.917 N/A TRP 150.A N PRO 147.A O no hydrogen 2.687 N/A ARG 162.A NH1 GLU 58.A O no hydrogen 3.410 N/A ARG 162.A NH1 GLU 58.A OE2 no hydrogen 2.516 N/A ARG 162.A NH2 LEU 20.A O no hydrogen 2.634 N/A