Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3rgr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 5.A N GLU 8.A OE1 no hydrogen 2.942 N/A GLU 8.A N THR 5.A OG1 no hydrogen 3.123 N/A VAL 9.A N THR 5.A O no hydrogen 2.783 N/A GLN 10.A N.A ALA 6.A O no hydrogen 3.062 N/A GLN 10.A N.B ALA 6.A O no hydrogen 3.061 N/A GLN 10.A NE2.A VAL 74.A O no hydrogen 2.838 N/A GLN 10.A NE2.B VAL 74.A O no hydrogen 3.015 N/A GLY 11.A N GLN 7.A O.A no hydrogen 3.243 N/A GLY 11.A N GLN 7.A O.B no hydrogen 3.090 N/A GLY 11.A N GLN 7.A O.C no hydrogen 3.073 N/A GLY 11.A N GLN 7.A O.D no hydrogen 3.274 N/A LEU 12.A N GLU 8.A O no hydrogen 2.888 N/A MET 13.A N VAL 9.A O no hydrogen 2.925 N/A ALA 14.A N GLN 10.A O.A no hydrogen 2.942 N/A ALA 14.A N GLN 10.A O.B no hydrogen 3.162 N/A ARG 15.A N.A GLY 11.A O no hydrogen 2.823 N/A ARG 15.A N.B GLY 11.A O no hydrogen 2.833 N/A TYR 16.A N LEU 12.A O no hydrogen 2.898 N/A TYR 16.A OH TYR 57.A OH no hydrogen 2.570 N/A ILE 17.A N MET 13.A O no hydrogen 3.182 N/A GLU 18.A N ALA 14.A O no hydrogen 3.041 N/A LEU 19.A N ARG 15.A O.A no hydrogen 2.952 N/A LEU 19.A N ARG 15.A O.B no hydrogen 2.964 N/A VAL 20.A N TYR 16.A O no hydrogen 2.916 N/A ASP 21.A N ILE 17.A O no hydrogen 2.896 N/A VAL 22.A N GLU 18.A O no hydrogen 3.017 N/A GLY 23.A N LEU 19.A O no hydrogen 2.926 N/A GLY 23.A N VAL 20.A O no hydrogen 3.060 N/A ASP 24.A N.A LEU 19.A O no hydrogen 3.060 N/A ASP 24.A N.B LEU 19.A O no hydrogen 3.039 N/A ILE 25.A N.B GLY 23.A O no hydrogen 3.103 N/A GLU 26.A N.B GLU 26.A OE1.B no hydrogen 2.735 N/A ALA 27.A N ASP 24.A OD1.A no hydrogen 3.198 N/A ALA 27.A N ASP 24.A OD1.B no hydrogen 3.002 N/A ILE 28.A N ASP 24.A O.A no hydrogen 2.967 N/A ILE 28.A N ASP 24.A O.B no hydrogen 2.902 N/A VAL 29.A N ILE 25.A O.A no hydrogen 2.747 N/A VAL 29.A N ILE 25.A O.B no hydrogen 3.035 N/A GLN 30.A N GLU 26.A O.A no hydrogen 3.059 N/A GLN 30.A N GLU 26.A O.B no hydrogen 3.165 N/A MET 31.A N ILE 28.A O no hydrogen 2.983 N/A TYR 32.A N VAL 29.A O no hydrogen 3.003 N/A TYR 32.A OH TYR 57.A OH no hydrogen 2.797 N/A ALA 33.A N.A ILE 113.A O no hydrogen 2.875 N/A ALA 33.A N.B ILE 113.A O no hydrogen 2.795 N/A ALA 36.A N.A ALA 33.A O.B no hydrogen 2.758 N/A ALA 36.A N.B ALA 33.A O.A no hydrogen 3.366 N/A ALA 36.A N.B ALA 33.A O.B no hydrogen 2.627 N/A THR 37.A N GLN 114.A O no hydrogen 2.995 N/A VAL 38.A N ILE 47.A O no hydrogen 2.988 N/A GLU 39.A N ALA 116.A O no hydrogen 2.847 N/A PHE 42.A N ALA 118.A O no hydrogen 2.863 N/A GLN 44.A N.A PRO 41.A O no hydrogen 2.956 N/A GLN 44.A N.B PRO 41.A O no hydrogen 2.972 N/A ILE 47.A N VAL 38.A O no hydrogen 2.946 N/A HIS 48.A N.A GLN 52.A OE1 no hydrogen 2.984 N/A HIS 48.A N.B GLN 52.A OE1 no hydrogen 3.054 N/A HIS 48.A N.C GLN 52.A OE1 no hydrogen 3.026 N/A GLY 49.A N ALA 36.A O.A no hydrogen 2.938 N/A GLY 49.A N ALA 36.A O.B no hydrogen 2.963 N/A ARG 50.A N.A ASP 34.A O.A no hydrogen 3.208 N/A ARG 50.A N.B ASP 34.A O.A no hydrogen 3.216 N/A ARG 50.A NE.A TYR 32.A O no hydrogen 2.567 N/A ARG 50.A NH1.A ASP 34.A OD1.B no hydrogen 2.975 N/A ARG 50.A NH2.A TYR 32.A O no hydrogen 2.634 N/A ILE 53.A N GLY 49.A O no hydrogen 2.942 N/A ALA 54.A N ARG 50.A O.A no hydrogen 2.888 N/A ALA 54.A N ARG 50.A O.B no hydrogen 2.791 N/A ALA 55.A N GLU 51.A O no hydrogen 2.987 N/A PHE 56.A N GLN 52.A O no hydrogen 2.950 N/A TYR 57.A N ILE 53.A O no hydrogen 3.028 N/A TYR 57.A OH TYR 16.A OH no hydrogen 2.570 N/A TYR 57.A OH TYR 32.A OH no hydrogen 2.797 N/A ARG 58.A N.A ALA 54.A O no hydrogen 2.976 N/A ARG 58.A N.B ALA 54.A O no hydrogen 2.902 N/A ARG 58.A NH1.A GLU 51.A OE2 no hydrogen 3.309 N/A ARG 58.A NH2.B GLU 51.A OE2 no hydrogen 3.139 N/A GLN 59.A N.A ALA 55.A O no hydrogen 2.976 N/A GLN 59.A N.B ALA 55.A O no hydrogen 3.199 N/A GLY 60.A N PHE 56.A O no hydrogen 3.046 N/A LEU 61.A N TYR 57.A O no hydrogen 2.713 N/A GLY 62.A N ARG 58.A O.A no hydrogen 3.182 N/A GLY 62.A N ARG 58.A O.B no hydrogen 2.679 N/A GLY 64.A N LEU 61.A O no hydrogen 2.965 N/A LYS 65.A NZ.A GLY 63.A O no hydrogen 2.792 N/A ARG 67.A N.A GLU 89.A O no hydrogen 3.019 N/A ARG 67.A N.B GLU 89.A O no hydrogen 3.015 N/A ARG 67.A NE.A ASP 21.A OD1 no hydrogen 2.564 N/A ARG 67.A NE.A ASP 21.A OD2 no hydrogen 3.502 N/A ARG 67.A NH2.A ASP 21.A OD1 no hydrogen 3.420 N/A ARG 67.A NH2.A ASP 21.A OD2 no hydrogen 3.194 N/A ALA 68.A N ASP 21.A OD1 no hydrogen 2.892 N/A CYS 69.A N.A ARG 87.A O no hydrogen 3.064 N/A CYS 69.A N.B ARG 87.A O no hydrogen 3.048 N/A CYS 69.A SG.A LEU 70.A O no hydrogen 3.952 N/A CYS 69.A SG.B LEU 70.A O no hydrogen 3.500 N/A THR 71.A N PRO 85.A O no hydrogen 2.949 N/A ARG 75.A N ALA 83.A O no hydrogen 2.869 N/A ARG 75.A NH1 PRO 73.A O no hydrogen 2.836 N/A SER 77.A N.A CYS 81.A O no hydrogen 2.843 N/A SER 77.A N.B CYS 81.A O no hydrogen 2.849 N/A SER 77.A OG.A ASN 79.A OD1 no hydrogen 2.365 N/A SER 77.A OG.A CYS 81.A O no hydrogen 3.238 N/A ASN 79.A N SER 77.A OG.A no hydrogen 3.033 N/A CYS 81.A N SER 77.A OG.A no hydrogen 3.025 N/A CYS 81.A SG ASN 79.A O no hydrogen 3.711 N/A CYS 81.A SG ASN 79.A OD1 no hydrogen 3.799 N/A GLY 82.A N MET 105.A O no hydrogen 3.029 N/A ALA 83.A N ARG 75.A O no hydrogen 2.812 N/A MET 84.A N ASP 103.A O no hydrogen 2.860 N/A PHE 86.A N VAL 101.A O no hydrogen 2.884 N/A ARG 87.A N CYS 69.A O.A no hydrogen 3.057 N/A ARG 87.A N CYS 69.A O.B no hydrogen 2.871 N/A ARG 87.A NE ASP 100.A OD1 no hydrogen 2.695 N/A VAL 88.A N LEU 99.A O no hydrogen 2.893 N/A GLU 89.A N ARG 67.A O.A no hydrogen 2.782 N/A GLU 89.A N ARG 67.A O.B no hydrogen 3.103 N/A MET 90.A N.A CYS 97.A O.A no hydrogen 3.065 N/A MET 90.A N.A CYS 97.A O.B no hydrogen 2.805 N/A MET 90.A N.B CYS 97.A O.A no hydrogen 3.069 N/A MET 90.A N.B CYS 97.A O.B no hydrogen 2.824 N/A TRP 92.A N GLN 95.A O no hydrogen 2.948 N/A GLN 95.A NE2 PRO 96.A O no hydrogen 3.240 N/A GLN 95.A NE2 VAL 127.A O no hydrogen 2.947 N/A CYS 97.A N.A MET 90.A O.A no hydrogen 2.686 N/A CYS 97.A N.A MET 90.A O.B no hydrogen 2.824 N/A CYS 97.A N.B MET 90.A O.A no hydrogen 2.720 N/A CYS 97.A N.B MET 90.A O.B no hydrogen 2.861 N/A CYS 97.A SG.B MET 90.A O.A no hydrogen 3.568 N/A CYS 97.A SG.B MET 90.A O.B no hydrogen 3.972 N/A ALA 98.A N SER 126.A O.A no hydrogen 2.957 N/A ALA 98.A N SER 126.A O.B no hydrogen 2.843 N/A LEU 99.A N VAL 88.A O no hydrogen 2.807 N/A ASP 100.A N ASN 124.A O no hydrogen 3.041 N/A VAL 101.A N PHE 86.A O no hydrogen 2.962 N/A ILE 102.A N TYR 119.A O no hydrogen 3.052 N/A ASP 103.A N MET 84.A O no hydrogen 3.035 N/A VAL 104.A N GLN 117.A O no hydrogen 2.868 N/A MET 105.A N GLY 82.A O no hydrogen 2.905 N/A ARG 106.A N.A THR 115.A O no hydrogen 2.941 N/A ARG 106.A N.B THR 115.A O no hydrogen 2.951 N/A ARG 106.A N.C THR 115.A O no hydrogen 2.943 N/A PHE 107.A N GLY 80.A O no hydrogen 2.828 N/A ASP 108.A N ARG 112.A O no hydrogen 2.822 N/A HIS 110.A N ASP 108.A OD1 no hydrogen 2.856 N/A GLY 111.A N ASP 108.A O no hydrogen 3.066 N/A ARG 112.A N ASP 108.A OD1 no hydrogen 2.974 N/A ILE 113.A N MET 31.A O no hydrogen 2.819 N/A GLN 114.A N ARG 106.A O.A no hydrogen 2.713 N/A GLN 114.A N ARG 106.A O.B no hydrogen 2.839 N/A GLN 114.A N ARG 106.A O.C no hydrogen 2.721 N/A GLN 114.A NE2 ASP 35.A O.A no hydrogen 3.565 N/A GLN 114.A NE2 ASP 35.A OD1.A no hydrogen 3.204 N/A GLN 114.A NE2 GLN 114.A O no hydrogen 3.684 N/A THR 115.A N ARG 106.A O.A no hydrogen 3.138 N/A THR 115.A N ARG 106.A O.B no hydrogen 3.320 N/A THR 115.A N ARG 106.A O.C no hydrogen 3.148 N/A ALA 116.A N THR 37.A O no hydrogen 3.038 N/A GLN 117.A N VAL 104.A O no hydrogen 2.891 N/A GLN 117.A NE2 GLU 39.A OE2 no hydrogen 3.078 N/A ALA 118.A N GLU 39.A O no hydrogen 2.822 N/A TYR 119.A N ILE 102.A O no hydrogen 2.699 N/A TRP 120.A NE1 ASP 40.A OD1 no hydrogen 2.805 N/A SER 121.A N.A ASN 124.A OD1 no hydrogen 2.992 N/A SER 121.A N.B ASN 124.A OD1 no hydrogen 3.067 N/A GLU 122.A N.A GLU 122.A OE1.A no hydrogen 2.665 N/A GLU 122.A N.B GLU 122.A OE1.B no hydrogen 2.741 N/A ASN 124.A N SER 121.A O.A no hydrogen 2.755 N/A ASN 124.A N SER 121.A O.B no hydrogen 3.005 N/A LEU 125.A N GLU 122.A O.A no hydrogen 2.968 N/A LEU 125.A N GLU 122.A O.B no hydrogen 3.152 N/A SER 126.A N.A ALA 98.A O no hydrogen 2.846 N/A SER 126.A N.B ALA 98.A O no hydrogen 2.829 N/A