Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4ca1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 6.A N LEU 19.A O.A no hydrogen 2.806 N/A PHE 6.A N LEU 19.A O.B no hydrogen 2.780 N/A CYS 8.A N ILE 17.A O no hydrogen 3.250 N/A CYS 8.A SG HIS 27.A NE2 no hydrogen 3.481 N/A LYS 9.A N GLU 28.A OE2 no hydrogen 2.771 N/A ALA 11.A N CYS 8.A O no hydrogen 2.848 N/A SER 13.A N TYR 10.A O no hydrogen 3.050 N/A GLY 14.A N ALA 11.A O no hydrogen 2.935 N/A CYS 15.A N TYR 10.A O no hydrogen 3.185 N/A CYS 15.A SG HIS 27.A NE2 no hydrogen 3.548 N/A LEU 19.A N.A PHE 6.A O no hydrogen 2.924 N/A LEU 19.A N.B PHE 6.A O no hydrogen 2.976 N/A GLU 23.A N PRO 20.A O no hydrogen 3.148 N/A LYS 24.A N HIS 21.A O no hydrogen 3.101 N/A LYS 24.A NZ GLU 28.A OE2 no hydrogen 2.620 N/A HIS 27.A N GLU 23.A O no hydrogen 3.101 N/A GLU 28.A N LYS 24.A O no hydrogen 2.995 N/A GLU 29.A N ALA 25.A O no hydrogen 2.987 N/A LEU 30.A N HIS 27.A O no hydrogen 3.055 N/A CYS 31.A N GLU 28.A O no hydrogen 3.453 N/A CYS 31.A SG HIS 27.A NE2 no hydrogen 3.551 N/A ARG 34.A N CYS 31.A O no hydrogen 3.315 N/A TYR 36.A N GLY 49.A O no hydrogen 2.711 N/A CYS 38.A N TRP 47.A O no hydrogen 3.061 N/A CYS 38.A SG HIS 57.A NE2 no hydrogen 3.430 N/A CYS 38.A SG HIS 62.A NE2 no hydrogen 3.426 N/A CYS 40.A SG.A PRO 41.A O no hydrogen 3.897 N/A CYS 40.A SG.A HIS 62.A ND1 no hydrogen 3.855 N/A CYS 45.A SG HIS 57.A NE2 no hydrogen 3.459 N/A CYS 45.A SG HIS 62.A NE2 no hydrogen 3.726 N/A GLY 49.A N TYR 36.A O no hydrogen 2.941 N/A ALA 53.A N SER 50.A O no hydrogen 2.919 N/A VAL 54.A N LEU 51.A O no hydrogen 3.165 N/A HIS 57.A N ALA 53.A O no hydrogen 2.934 N/A HIS 57.A NE2 HIS 62.A NE2 no hydrogen 3.034 N/A LEU 58.A N VAL 54.A O no hydrogen 2.979 N/A MET 59.A N MET 55.A O no hydrogen 2.917 N/A HIS 60.A N PRO 56.A O no hydrogen 2.864 N/A GLN 61.A N HIS 57.A O no hydrogen 2.846 N/A HIS 62.A N LEU 58.A O no hydrogen 3.004 N/A HIS 62.A NE2 HIS 57.A NE2 no hydrogen 3.034 N/A ILE 65.A N HIS 62.A O no hydrogen 3.045 N/A LEU 68.A N.A MET 91.A O no hydrogen 2.880 N/A LEU 68.A N.B MET 91.A O no hydrogen 2.787 N/A GLY 70.A N SER 93.A O.A no hydrogen 2.935 N/A GLY 70.A N SER 93.A O.B no hydrogen 2.956 N/A ILE 73.A N VAL 184.A O no hydrogen 2.887 N/A PHE 75.A N.A ILE 182.A O no hydrogen 2.741 N/A PHE 75.A N.B ILE 182.A O no hydrogen 2.768 N/A ALA 77.A N LEU 180.A O no hydrogen 2.885 N/A ASP 79.A N ASN 179.A OD1 no hydrogen 3.123 N/A ILE 80.A N GLY 178.A O no hydrogen 2.927 N/A ASN 81.A ND2 GLN 172.A OE1 no hydrogen 2.987 N/A LEU 82.A N ASP 79.A O no hydrogen 3.214 N/A VAL 86.A N LYS 105.A O no hydrogen 3.391 N/A TRP 88.A N LEU 103.A O no hydrogen 2.907 N/A TRP 88.A NE1 THR 78.A O no hydrogen 2.901 N/A MET 90.A N.A LEU 101.A O no hydrogen 2.974 N/A MET 90.A N.B LEU 101.A O no hydrogen 2.984 N/A MET 91.A N THR 66.A O no hydrogen 2.783 N/A GLN 92.A N PHE 99.A O no hydrogen 2.722 N/A GLN 92.A NE2 GLY 70.A O no hydrogen 2.892 N/A SER 93.A N.A LEU 68.A O.A no hydrogen 2.873 N/A SER 93.A N.A LEU 68.A O.B no hydrogen 2.924 N/A SER 93.A N.B LEU 68.A O.A no hydrogen 2.884 N/A SER 93.A N.B LEU 68.A O.B no hydrogen 2.832 N/A CYS 94.A N PHE 97.A O no hydrogen 3.102 N/A CYS 94.A SG GLY 70.A O no hydrogen 3.893 N/A PHE 97.A N CYS 94.A O no hydrogen 2.935 N/A PHE 99.A N GLN 92.A O no hydrogen 2.845 N/A MET 100.A N GLN 117.A O no hydrogen 2.680 N/A LEU 101.A N MET 90.A O.A no hydrogen 2.757 N/A LEU 101.A N MET 90.A O.B no hydrogen 2.761 N/A VAL 102.A N ILE 115.A O no hydrogen 2.970 N/A LEU 103.A N TRP 88.A O no hydrogen 2.888 N/A GLU 104.A N PHE 113.A O no hydrogen 2.781 N/A LYS 105.A N VAL 86.A O no hydrogen 2.853 N/A LYS 105.A NZ ILE 80.A O no hydrogen 2.790 N/A LYS 105.A NZ LEU 82.A O no hydrogen 2.903 N/A GLN 106.A N GLN 111.A O no hydrogen 2.714 N/A GLN 106.A NE2 GLU 104.A OE2 no hydrogen 2.691 N/A LYS 108.A N HIS 109.A O no hydrogen 2.753 N/A GLN 111.A N GLN 106.A O no hydrogen 2.874 N/A PHE 112.A N PHE 166.A O no hydrogen 2.790 N/A PHE 113.A N GLU 104.A O no hydrogen 2.937 N/A ALA 114.A N LEU 164.A O no hydrogen 2.844 N/A ILE 115.A N VAL 102.A O no hydrogen 3.035 N/A GLN 117.A N MET 100.A O no hydrogen 2.896 N/A GLN 117.A NE2 PRO 39.A O no hydrogen 3.488 N/A LEU 118.A N ARG 148.A O no hydrogen 2.751 N/A ILE 119.A N.A HIS 98.A O no hydrogen 2.932 N/A ILE 119.A N.B HIS 98.A O no hydrogen 2.952 N/A THR 121.A N GLN 124.A OE1 no hydrogen 2.932 N/A ARG 122.A NH2 GLU 152.A OE2 no hydrogen 2.736 N/A GLN 124.A N THR 121.A OG1 no hydrogen 2.943 N/A ALA 125.A N THR 121.A O no hydrogen 2.873 N/A GLU 126.A N ARG 122.A O no hydrogen 2.981 N/A ASN 127.A N GLN 124.A O no hydrogen 3.047 N/A ASN 127.A ND2 GLN 124.A O no hydrogen 3.677 N/A PHE 128.A N ALA 125.A O no hydrogen 2.986 N/A ALA 129.A N SER 187.A O.A no hydrogen 2.832 N/A ALA 129.A N SER 187.A O.B no hydrogen 2.862 N/A TYR 130.A N ALA 145.A O no hydrogen 2.858 N/A ARG 131.A N THR 185.A O no hydrogen 2.853 N/A ARG 131.A NH2 THR 185.A OG1 no hydrogen 3.043 N/A LEU 132.A N TRP 143.A O no hydrogen 2.857 N/A GLU 133.A N.A ASN 183.A O.A no hydrogen 2.907 N/A GLU 133.A N.A ASN 183.A O.B no hydrogen 2.928 N/A GLU 133.A N.B ASN 183.A O.A no hydrogen 2.960 N/A GLU 133.A N.B ASN 183.A O.B no hydrogen 3.000 N/A LEU 134.A N LEU 141.A O no hydrogen 2.823 N/A ASN 135.A ND2 GLU 133.A OE1.A no hydrogen 3.211 N/A ASN 135.A ND2 GLU 133.A OE1.B no hydrogen 2.438 N/A GLY 136.A N ARG 139.A O no hydrogen 2.892 N/A ARG 139.A N GLY 136.A O no hydrogen 3.353 N/A ARG 139.A NH1 HIS 137.A O no hydrogen 2.956 N/A ARG 140.A NE ASN 135.A OD1 no hydrogen 2.891 N/A LEU 141.A N LEU 134.A O no hydrogen 3.010 N/A TRP 143.A N LEU 132.A O no hydrogen 2.884 N/A TRP 143.A NE1 TYR 130.A OH no hydrogen 3.004 N/A ALA 145.A N TYR 130.A O no hydrogen 3.040 N/A ARG 148.A N VAL 116.A O no hydrogen 3.045 N/A SER 149.A N.A GLU 152.A OE1 no hydrogen 2.806 N/A SER 149.A N.B GLU 152.A OE1 no hydrogen 2.772 N/A SER 149.A OG.A GLU 152.A OE1 no hydrogen 3.421 N/A SER 149.A OG.B GLY 120.A O no hydrogen 2.467 N/A ILE 150.A N.A LEU 118.A O no hydrogen 3.087 N/A GLU 152.A N SER 149.A OG.A no hydrogen 3.162 N/A GLY 153.A N SER 149.A O.A no hydrogen 2.936 N/A GLY 153.A N SER 149.A O.B no hydrogen 2.996 N/A ILE 158.A N ILE 154.A O no hydrogen 2.928 N/A MET 159.A N ALA 155.A O no hydrogen 2.927 N/A ASN 160.A N THR 156.A O no hydrogen 2.958 N/A SER 161.A N ILE 158.A O no hydrogen 3.029 N/A ASP 162.A N ALA 157.A O no hydrogen 2.847 N/A CYS 163.A SG LEU 164.A O no hydrogen 3.744 N/A LEU 164.A N ALA 114.A O no hydrogen 3.068 N/A PHE 166.A N PHE 112.A O no hydrogen 2.976 N/A THR 168.A N.A GLN 110.A O no hydrogen 3.363 N/A THR 168.A OG1.A GLN 110.A O no hydrogen 3.533 N/A ILE 170.A N.A ASP 167.A OD1 no hydrogen 2.765 N/A ILE 170.A N.B ASP 167.A OD1 no hydrogen 2.802 N/A ALA 171.A N ASP 167.A O no hydrogen 2.995 N/A GLN 172.A N THR 168.A O.A no hydrogen 2.950 N/A GLN 172.A N THR 168.A O.B no hydrogen 2.882 N/A GLN 172.A NE2 ASN 81.A OD1 no hydrogen 2.828 N/A GLN 172.A NE2 THR 168.A O.A no hydrogen 3.114 N/A GLN 172.A NE2 THR 168.A O.B no hydrogen 3.119 N/A LEU 173.A N SER 169.A O.A no hydrogen 3.130 N/A LEU 173.A N SER 169.A O.B no hydrogen 3.405 N/A PHE 174.A N ILE 170.A O.A no hydrogen 3.263 N/A PHE 174.A N ILE 170.A O.B no hydrogen 3.280 N/A PHE 174.A N ALA 171.A O no hydrogen 3.229 N/A ALA 175.A N ALA 171.A O no hydrogen 2.829 N/A GLU 176.A N ASN 179.A O no hydrogen 2.850 N/A ASN 179.A N GLU 176.A O no hydrogen 3.005 N/A LEU 180.A N ALA 77.A O no hydrogen 2.858 N/A ILE 182.A N PHE 75.A O.A no hydrogen 2.899 N/A ILE 182.A N PHE 75.A O.B no hydrogen 2.723 N/A ASN 183.A N.A GLU 133.A O.A no hydrogen 2.933 N/A ASN 183.A N.A GLU 133.A O.B no hydrogen 2.932 N/A ASN 183.A N.B GLU 133.A O.A no hydrogen 2.940 N/A ASN 183.A N.B GLU 133.A O.B no hydrogen 2.940 N/A ASN 183.A ND2.A GLU 133.A OE1.A no hydrogen 3.512 N/A ASN 183.A ND2.A GLU 133.A OE1.B no hydrogen 2.809 N/A ASN 183.A ND2.B GLU 133.A O.B no hydrogen 3.247 N/A VAL 184.A N ILE 73.A O no hydrogen 2.850 N/A THR 185.A N ARG 131.A O no hydrogen 2.938 N/A THR 185.A OG1 ASP 72.A OD1 no hydrogen 2.606 N/A ILE 186.A N.A GLU 71.A O no hydrogen 2.834 N/A ILE 186.A N.B GLU 71.A O no hydrogen 2.839 N/A SER 187.A N.A ALA 129.A O no hydrogen 2.916 N/A SER 187.A N.B ALA 129.A O no hydrogen 2.935 N/A CYS 189.A N ASN 127.A O no hydrogen 2.916 N/A CYS 189.A SG GLU 126.A O no hydrogen 3.827 N/A