Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4in1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 7.A N PRO 3.A O no hydrogen 3.270 N/A SER 8.A N PRO 4.A O no hydrogen 2.880 N/A SER 8.A OG THR 5.A O no hydrogen 2.593 N/A ARG 9.A N LEU 6.A O no hydrogen 3.074 N/A ARG 9.A NH1 TRP 20.A O no hydrogen 2.899 N/A ARG 9.A NH1 VAL 21.A O no hydrogen 3.022 N/A ARG 9.A NH1 THR 70.A O no hydrogen 3.334 N/A ARG 9.A NH2 THR 70.A O no hydrogen 2.747 N/A VAL 10.A N TRP 7.A O no hydrogen 2.958 N/A THR 11.A N GLY 18.A O no hydrogen 2.829 N/A THR 11.A OG1 ARG 9.A O no hydrogen 3.024 N/A LYS 12.A NZ GLY 14.A O no hydrogen 3.446 N/A LYS 12.A NZ GLY 16.A O no hydrogen 2.762 N/A PHE 13.A N GLY 16.A O no hydrogen 2.902 N/A SER 15.A N VAL 32.A O no hydrogen 3.186 N/A SER 15.A OG VAL 32.A O no hydrogen 3.562 N/A GLY 16.A N PHE 13.A O no hydrogen 2.845 N/A TRP 17.A N CYS 132.A O no hydrogen 2.831 N/A GLY 18.A N THR 11.A O no hydrogen 2.764 N/A PHE 19.A N ILE 27.A O no hydrogen 2.806 N/A TRP 20.A N ARG 9.A O no hydrogen 3.003 N/A VAL 21.A N VAL 25.A O no hydrogen 2.804 N/A SER 22.A N VAL 25.A O no hydrogen 3.376 N/A THR 24.A N SER 22.A OG no hydrogen 3.155 N/A VAL 25.A N SER 22.A OG no hydrogen 3.025 N/A PHE 26.A N PHE 59.A O no hydrogen 2.987 N/A ILE 27.A N PHE 19.A O no hydrogen 2.863 N/A THR 28.A N THR 57.A O no hydrogen 2.909 N/A THR 28.A OG1 TRP 17.A O no hydrogen 2.703 N/A THR 29.A OG1 HIS 150.A O no hydrogen 2.590 N/A THR 30.A N GLU 55.A O no hydrogen 2.897 N/A THR 30.A OG1 GLY 54.A O no hydrogen 2.631 N/A THR 30.A OG1 THR 57.A OG1 no hydrogen 2.737 N/A HIS 31.A N GLU 55.A OE1 no hydrogen 3.020 N/A HIS 31.A ND1 GLU 55.A OE2 no hydrogen 2.562 N/A VAL 32.A N THR 29.A O no hydrogen 2.971 N/A VAL 33.A N THR 30.A O no hydrogen 3.135 N/A PHE 40.A N GLU 43.A O no hydrogen 2.964 N/A GLU 43.A N PHE 40.A O no hydrogen 2.939 N/A LEU 45.A N LYS 38.A O no hydrogen 3.094 N/A SER 47.A N PRO 44.A O no hydrogen 2.895 N/A SER 47.A OG PRO 44.A O no hydrogen 2.779 N/A ILE 48.A N LEU 45.A O no hydrogen 3.034 N/A ALA 49.A N ARG 60.A O no hydrogen 3.020 N/A HIS 51.A N GLN 58.A O no hydrogen 2.801 N/A ALA 53.A N PHE 56.A O no hydrogen 2.842 N/A PHE 56.A N ALA 53.A O no hydrogen 2.982 N/A THR 57.A N THR 28.A O no hydrogen 3.028 N/A THR 57.A OG1 THR 30.A OG1 no hydrogen 2.737 N/A GLN 58.A N HIS 51.A O no hydrogen 2.797 N/A PHE 59.A N PHE 26.A O no hydrogen 2.784 N/A ARG 60.A N ALA 49.A O no hydrogen 2.959 N/A PHE 61.A N THR 24.A O no hydrogen 2.772 N/A SER 62.A OG SER 47.A O no hydrogen 3.128 N/A MET 65.A N PRO 23.A O no hydrogen 2.739 N/A ARG 66.A N PRO 23.A O no hydrogen 3.068 N/A ARG 66.A NE ASP 68.A OD1 no hydrogen 2.795 N/A ARG 66.A NE ASP 68.A OD2 no hydrogen 3.440 N/A ARG 66.A NH1 SER 8.A O no hydrogen 2.995 N/A ARG 66.A NH2 SER 8.A OG no hydrogen 3.015 N/A ARG 66.A NH2 ASP 68.A OD2 no hydrogen 2.903 N/A LEU 69.A N ARG 66.A O no hydrogen 2.956 N/A MET 72.A N VAL 21.A O no hydrogen 2.906 N/A GLU 75.A N VAL 146.A O no hydrogen 2.804 N/A CYS 78.A N GLN 118.A OE1 no hydrogen 2.837 N/A GLY 81.A N MET 102.A O no hydrogen 2.777 N/A THR 82.A N PRO 79.A O no hydrogen 3.055 N/A CYS 84.A N VAL 100.A O no hydrogen 2.772 N/A SER 85.A N VAL 137.A O no hydrogen 2.797 N/A VAL 86.A N LEU 98.A O no hydrogen 2.788 N/A LEU 87.A N PRO 135.A O no hydrogen 2.964 N/A ILE 88.A N VAL 86.A O no hydrogen 3.053 N/A LYS 89.A NZ TRP 7.A O no hydrogen 3.000 N/A LYS 89.A NZ VAL 10.A O no hydrogen 2.895 N/A ARG 90.A N GLU 94.A O no hydrogen 2.868 N/A ARG 90.A NE ASP 131.A OD1 no hydrogen 2.889 N/A ARG 90.A NH2 GLY 126.A O no hydrogen 3.001 N/A ARG 90.A NH2 ASP 131.A OD2 no hydrogen 2.712 N/A GLY 93.A N ARG 90.A O no hydrogen 2.891 N/A GLU 94.A N SER 92.A OG no hydrogen 3.157 N/A LEU 96.A N ILE 88.A O no hydrogen 2.679 N/A LEU 98.A N VAL 86.A O no hydrogen 3.028 N/A ALA 99.A N THR 124.A OG1 no hydrogen 2.857 N/A VAL 100.A N CYS 84.A O no hydrogen 2.852 N/A ARG 101.A N MET 121.A O no hydrogen 2.940 N/A ARG 101.A NH1 GLY 81.A O no hydrogen 2.955 N/A MET 102.A N THR 82.A O no hydrogen 2.905 N/A GLY 103.A N SER 119.A O no hydrogen 2.705 N/A ALA 106.A N GLY 117.A O no hydrogen 2.922 N/A MET 108.A N VAL 115.A O no hydrogen 2.933 N/A ARG 109.A NH1 GLY 112.A O no hydrogen 3.135 N/A ILE 110.A N ARG 113.A O no hydrogen 2.668 N/A ARG 113.A N ILE 110.A O no hydrogen 3.031 N/A VAL 115.A N MET 108.A O no hydrogen 2.751 N/A HIS 116.A NE2 ALA 166.A O no hydrogen 2.720 N/A GLY 117.A N ALA 106.A O no hydrogen 2.955 N/A GLN 118.A N CYS 162.A O no hydrogen 2.847 N/A GLN 118.A NE2 CYS 78.A O no hydrogen 2.861 N/A GLN 118.A NE2 GLY 103.A O no hydrogen 2.841 N/A SER 119.A N ALA 104.A O no hydrogen 3.451 N/A GLY 120.A N VAL 160.A O no hydrogen 2.935 N/A MET 121.A N ARG 101.A O no hydrogen 2.858 N/A LEU 122.A N ASN 158.A O.A no hydrogen 2.897 N/A LEU 122.A N ASN 158.A O.B no hydrogen 2.938 N/A LEU 123.A N ALA 99.A O no hydrogen 2.769 N/A ILE 128.A N ASP 131.A OD2 no hydrogen 2.717 N/A ASP 131.A N ILE 128.A O no hydrogen 2.964 N/A GLY 133.A N HIS 150.A O no hydrogen 2.825 N/A ALA 134.A N ASP 131.A O no hydrogen 3.164 N/A TYR 136.A N GLY 148.A O no hydrogen 2.742 N/A TYR 136.A OH HIS 150.A ND1 no hydrogen 2.874 N/A VAL 137.A N SER 85.A O no hydrogen 2.846 N/A HIS 138.A N VAL 145.A O no hydrogen 3.016 N/A HIS 138.A NE2 GLU 75.A OE1 no hydrogen 2.693 N/A ARG 140.A N ASP 143.A O no hydrogen 2.721 N/A ARG 140.A NE GLU 75.A OE2 no hydrogen 2.811 N/A ARG 140.A NH2 GLU 75.A OE2 no hydrogen 2.737 N/A ASN 142.A ND2 ASN 142.A O no hydrogen 3.109 N/A ASP 143.A N ARG 140.A O no hydrogen 3.179 N/A VAL 145.A N HIS 138.A O no hydrogen 2.776 N/A VAL 146.A N VAL 73.A O no hydrogen 3.043 N/A CYS 147.A N TYR 136.A O no hydrogen 2.869 N/A CYS 147.A SG TYR 136.A O no hydrogen 3.548 N/A VAL 149.A N ALA 163.A O no hydrogen 3.098 N/A HIS 150.A N ALA 134.A O no hydrogen 2.757 N/A HIS 150.A ND1 TYR 136.A OH no hydrogen 2.874 N/A ALA 151.A N VAL 161.A O no hydrogen 2.854 N/A ALA 152.A N VAL 161.A O no hydrogen 3.166 N/A THR 154.A N THR 159.A O no hydrogen 2.865 N/A THR 154.A OG1 SER 156.A OG no hydrogen 3.232 N/A THR 154.A OG1 THR 159.A O no hydrogen 3.373 N/A SER 156.A OG THR 154.A OG1 no hydrogen 3.232 N/A SER 156.A OG ASN 158.A OD1.A no hydrogen 3.436 N/A GLY 157.A N THR 154.A O no hydrogen 2.827 N/A ASN 158.A N.A SER 156.A OG no hydrogen 3.085 N/A ASN 158.A N.B SER 156.A OG no hydrogen 3.080 N/A THR 159.A N THR 154.A OG1 no hydrogen 3.153 N/A VAL 160.A N GLY 120.A O no hydrogen 2.997 N/A VAL 161.A N ALA 152.A O no hydrogen 2.853 N/A CYS 162.A N GLN 118.A O no hydrogen 2.867 N/A CYS 162.A SG GLN 118.A O no hydrogen 3.742 N/A ALA 163.A N VAL 149.A O no hydrogen 2.721 N/A ALA 166.A N GLU 76.A O no hydrogen 2.620 N/A ASN 172.A ND2 GLU 170.A OE2 no hydrogen 2.795 N/A