Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4kub_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 3.A N HIS 58.A ND1 no hydrogen 3.273 N/A SER 5.A N VAL 57.A O no hydrogen 2.889 N/A ARG 7.A N VAL 55.A O no hydrogen 3.176 N/A ARG 7.A NH1 PRO 8.A O no hydrogen 3.229 N/A ARG 7.A NH1 ASP 13.A OD2 no hydrogen 2.773 N/A ARG 7.A NH2 ASP 13.A OD1 no hydrogen 2.878 N/A ARG 7.A NH2 ASP 13.A OD2 no hydrogen 3.525 N/A ALA 9.A N SER 53.A O no hydrogen 2.966 N/A GLU 10.A N ASP 13.A OD2 no hydrogen 2.806 N/A ASP 13.A N GLU 10.A O no hydrogen 2.898 N/A LEU 14.A N THR 11.A O no hydrogen 3.032 N/A THR 16.A N.B ASP 13.A O no hydrogen 3.123 N/A THR 16.A OG1.A GLU 15.A OE1 no hydrogen 3.121 N/A THR 16.A OG1.B ASP 13.A O no hydrogen 3.491 N/A VAL 17.A N ASP 13.A O no hydrogen 3.021 N/A ALA 18.A N LEU 14.A O no hydrogen 2.880 N/A GLY 19.A N GLU 15.A O no hydrogen 3.353 N/A GLY 19.A N THR 16.A O.A no hydrogen 3.029 N/A GLY 19.A N THR 16.A O.B no hydrogen 3.031 N/A PHE 20.A N VAL 17.A O no hydrogen 2.873 N/A GLN 22.A N GLU 26.A OE1 no hydrogen 2.838 N/A GLN 22.A NE2 PHE 20.A O no hydrogen 3.168 N/A GLU 26.A N ASP 23.A OD1 no hydrogen 2.875 N/A LEU 27.A N ASP 23.A O no hydrogen 3.075 N/A PHE 28.A N ARG 24.A O no hydrogen 2.976 N/A TYR 29.A N ASP 25.A O no hydrogen 2.920 N/A CYS 30.A N GLU 26.A O no hydrogen 3.325 N/A CYS 30.A N LEU 27.A O no hydrogen 3.303 N/A CYS 30.A SG GLU 26.A O no hydrogen 3.435 N/A CYS 30.A SG LEU 27.A O no hydrogen 3.866 N/A TYR 31.A N LEU 27.A O no hydrogen 2.864 N/A TYR 31.A OH GLN 42.A O no hydrogen 2.811 N/A ALA 34.A N TYR 31.A O no hydrogen 2.968 N/A ILE 35.A N GLN 42.A OE1 no hydrogen 2.865 N/A GLN 42.A N SER 39.A OG no hydrogen 3.147 N/A GLN 42.A NE2 ILE 35.A O no hydrogen 2.988 N/A LEU 43.A N SER 39.A O no hydrogen 3.081 N/A ALA 44.A N VAL 40.A O no hydrogen 2.774 N/A ALA 45.A N ALA 41.A O no hydrogen 2.943 N/A ALA 46.A N GLN 42.A O no hydrogen 3.131 N/A ILE 47.A N LEU 43.A O no hydrogen 2.985 N/A ALA 48.A N ALA 44.A O no hydrogen 2.979 N/A GLU 49.A N ALA 45.A O no hydrogen 3.234 N/A GLU 49.A N ALA 46.A O no hydrogen 3.078 N/A ARG 50.A N ILE 47.A O no hydrogen 3.219 N/A ARG 50.A NH2 ASN 67.A OD1 no hydrogen 2.963 N/A ARG 51.A N.A PHE 68.A O no hydrogen 3.198 N/A ARG 51.A N.B PHE 68.A O no hydrogen 3.199 N/A ARG 51.A NH1.A ARG 50.A O no hydrogen 2.997 N/A ARG 51.A NH1.B TYR 109.A OH no hydrogen 2.886 N/A THR 54.A N ALA 66.A O no hydrogen 2.950 N/A THR 54.A OG1 GLY 52.A O no hydrogen 2.731 N/A VAL 55.A N ARG 7.A O no hydrogen 2.924 N/A ALA 56.A N GLY 64.A O no hydrogen 2.920 N/A VAL 57.A N SER 5.A O no hydrogen 2.828 N/A HIS 58.A N GLN 61.A O no hydrogen 2.975 N/A GLN 61.A N HIS 58.A O no hydrogen 2.922 N/A GLN 61.A NE2.A HIS 58.A O no hydrogen 3.086 N/A LEU 63.A N ALA 56.A O no hydrogen 2.782 N/A GLY 64.A N ALA 56.A O no hydrogen 3.369 N/A PHE 65.A N MET 83.A O no hydrogen 2.944 N/A ALA 66.A N THR 54.A O no hydrogen 3.138 N/A ASN 67.A N GLY 80.A O no hydrogen 3.037 N/A ASN 67.A ND2 SER 53.A OG no hydrogen 3.287 N/A ASN 67.A ND2 ASN 81.A OD1 no hydrogen 2.898 N/A PHE 68.A N ARG 51.A O.A no hydrogen 2.840 N/A PHE 68.A N ARG 51.A O.B no hydrogen 2.854 N/A TYR 69.A N ALA 78.A O no hydrogen 2.923 N/A GLN 72.A N PHE 76.A O no hydrogen 2.887 N/A GLY 74.A N TYR 109.A O no hydrogen 2.803 N/A ASP 75.A N GLN 72.A O no hydrogen 2.972 N/A PHE 76.A N GLN 72.A O no hydrogen 3.158 N/A CYS 77.A N LEU 113.A O no hydrogen 3.256 N/A ALA 78.A N GLN 70.A O no hydrogen 2.849 N/A LEU 79.A N.A LYS 115.A O no hydrogen 3.051 N/A LEU 79.A N.B LYS 115.A O no hydrogen 3.054 N/A GLY 80.A N ASN 67.A O no hydrogen 2.843 N/A ASN 81.A ND2 CYS 30.A O no hydrogen 3.004 N/A MET 83.A N PHE 65.A O no hydrogen 3.031 N/A ALA 85.A N LEU 63.A O no hydrogen 2.869 N/A ALA 88.A N ALA 85.A O no hydrogen 2.911 N/A ARG 89.A N PRO 86.A O no hydrogen 3.395 N/A ARG 89.A NE VAL 84.A O no hydrogen 2.882 N/A ARG 89.A NH1 GLU 26.A OE1 no hydrogen 3.322 N/A ARG 89.A NH1 GLU 26.A OE2 no hydrogen 2.742 N/A ARG 89.A NH2 GLU 26.A OE1 no hydrogen 2.841 N/A ARG 89.A NH2 VAL 84.A O no hydrogen 3.034 N/A TYR 96.A N GLY 92.A O no hydrogen 2.966 N/A LEU 97.A N VAL 93.A O no hydrogen 2.904 N/A ILE 98.A N ALA 94.A O no hydrogen 2.820 N/A GLY 99.A N ARG 95.A O no hydrogen 3.064 N/A VAL 100.A N TYR 96.A O no hydrogen 3.016 N/A MET 101.A N LEU 97.A O no hydrogen 2.845 N/A GLU 102.A N ILE 98.A O no hydrogen 2.851 N/A ASN 103.A N GLY 99.A O no hydrogen 3.049 N/A LEU 104.A N VAL 100.A O no hydrogen 2.937 N/A ALA 105.A N MET 101.A O no hydrogen 2.842 N/A ARG 106.A N GLU 102.A O no hydrogen 3.021 N/A ARG 106.A NH1 LEU 159.A O.A no hydrogen 2.898 N/A ARG 106.A NH2 ASN 103.A OD1 no hydrogen 2.302 N/A GLU 107.A N ASN 103.A O no hydrogen 2.772 N/A GLN 108.A N LEU 104.A O no hydrogen 2.872 N/A TYR 109.A N ALA 105.A O no hydrogen 3.070 N/A LYS 110.A NZ GLU 107.A O no hydrogen 2.944 N/A ALA 111.A N ALA 105.A O no hydrogen 3.089 N/A ARG 112.A N ASP 75.A O no hydrogen 2.920 N/A ARG 112.A NH1 LYS 110.A O no hydrogen 2.993 N/A MET 114.A N LYS 157.A O no hydrogen 2.941 N/A LYS 115.A N CYS 77.A O no hydrogen 2.872 N/A ILE 116.A N.A MET 155.A O no hydrogen 2.971 N/A ILE 116.A N.B MET 155.A O no hydrogen 2.953 N/A CYS 118.A N ILE 153.A O.A no hydrogen 2.939 N/A CYS 118.A N ILE 153.A O.B no hydrogen 2.916 N/A CYS 118.A SG PHE 119.A O no hydrogen 3.707 N/A CYS 118.A SG ASN 122.A O no hydrogen 3.699 N/A ASN 120.A N ALA 151.A O no hydrogen 2.837 N/A ASN 122.A N PHE 119.A O no hydrogen 3.056 N/A ALA 123.A N ALA 121.A O no hydrogen 3.007 N/A GLY 125.A N ASN 122.A OD1 no hydrogen 3.129 N/A LEU 126.A N ASN 122.A O no hydrogen 3.014 N/A LEU 127.A N ALA 123.A O no hydrogen 2.898 N/A LEU 128.A N ALA 124.A O no hydrogen 2.922 N/A TYR 129.A N.A GLY 125.A O no hydrogen 3.032 N/A TYR 129.A N.C GLY 125.A O no hydrogen 3.059 N/A THR 130.A N LEU 126.A O no hydrogen 3.088 N/A THR 130.A OG1 LEU 126.A O no hydrogen 2.779 N/A GLN 131.A N LEU 127.A O no hydrogen 2.907 N/A LEU 132.A N LEU 128.A O no hydrogen 3.063 N/A GLY 133.A N THR 130.A O no hydrogen 3.016 N/A TYR 134.A N TYR 129.A O.A no hydrogen 2.986 N/A TYR 134.A N TYR 129.A O.C no hydrogen 2.916 N/A TYR 134.A OH GLU 102.A OE2 no hydrogen 2.695 N/A GLN 135.A N ASP 156.A O no hydrogen 2.939 N/A ARG 137.A N GLN 154.A O no hydrogen 2.756 N/A ARG 137.A NE ASP 156.A OD1 no hydrogen 2.802 N/A ALA 138.A N GLN 154.A O no hydrogen 3.331 N/A ALA 140.A N LEU 152.A O no hydrogen 2.916 N/A ARG 142.A N VAL 150.A O no hydrogen 2.960 N/A ARG 142.A NH1 GLU 141.A O no hydrogen 2.928 N/A ASP 144.A N ARG 148.A O no hydrogen 2.909 N/A ASP 146.A N ASP 144.A OD1 no hydrogen 2.874 N/A GLY 147.A N ASP 144.A O no hydrogen 2.852 N/A ARG 148.A N ASP 144.A OD1 no hydrogen 3.028 N/A ARG 149.A NE GLU 141.A OE2 no hydrogen 2.966 N/A ARG 149.A NH1 GLU 141.A OE2 no hydrogen 3.081 N/A VAL 150.A N ARG 142.A O no hydrogen 2.867 N/A ALA 151.A N ASN 120.A OD1 no hydrogen 2.927 N/A LEU 152.A N ALA 140.A O no hydrogen 2.848 N/A ILE 153.A N.A CYS 118.A O no hydrogen 2.815 N/A ILE 153.A N.B CYS 118.A O no hydrogen 2.814 N/A GLN 154.A N ALA 138.A O no hydrogen 2.821 N/A MET 155.A N ILE 116.A O.A no hydrogen 2.883 N/A MET 155.A N ILE 116.A O.B no hydrogen 2.868 N/A ASP 156.A N GLN 135.A O no hydrogen 2.981 N/A LYS 157.A N MET 114.A O no hydrogen 2.971 N/A LYS 157.A NZ GLU 102.A OE1 no hydrogen 3.234 N/A LYS 157.A NZ GLU 102.A OE2 no hydrogen 2.907 N/A LYS 157.A NZ LEU 132.A O no hydrogen 2.817 N/A LEU 159.A N.A ARG 112.A O no hydrogen 2.873 N/A LEU 159.A N.B ARG 112.A O no hydrogen 2.844 N/A