Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4mbb_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 5.A OG GLN 74.A OE1 no hydrogen 2.718 N/A HIS 7.A N GLN 74.A OE1 no hydrogen 3.367 N/A TRP 12.A N PRO 9.A O no hydrogen 3.073 N/A TRP 12.A NE1 VAL 32.A O no hydrogen 2.772 N/A ASP 14.A N ARG 11.A O no hydrogen 2.931 N/A TYR 15.A OH GLU 168.A OE1 no hydrogen 2.585 N/A LEU 16.A N HIS 165.A NE2 no hydrogen 2.903 N/A GLY 19.A N ALA 29.A O no hydrogen 2.824 N/A GLN 20.A N CYS 162.A O no hydrogen 2.633 N/A ARG 21.A NE THR 25.A O no hydrogen 2.728 N/A ARG 21.A NH1 GLU 62.A OE1 no hydrogen 3.509 N/A ARG 21.A NH1 ASP 122.A OD1 no hydrogen 3.495 N/A ARG 21.A NH1 ASP 122.A OD2 no hydrogen 2.790 N/A ARG 21.A NH2 THR 25.A O no hydrogen 2.904 N/A ARG 21.A NH2 ASP 122.A OD1 no hydrogen 2.784 N/A MET 22.A N PHE 27.A O no hydrogen 3.052 N/A THR 25.A N MET 22.A O no hydrogen 2.967 N/A THR 25.A OG1 MET 22.A O no hydrogen 2.794 N/A ARG 26.A NH1 ASN 118.A O no hydrogen 3.323 N/A ARG 26.A NH1 ASN 121.A OD1 no hydrogen 3.061 N/A ARG 26.A NH1 LYS 123.A O no hydrogen 2.817 N/A ARG 26.A NH2 ASN 118.A O no hydrogen 2.348 N/A PHE 27.A N THR 25.A OG1 no hydrogen 2.953 N/A ILE 28.A N ILE 125.A O no hydrogen 3.060 N/A PHE 30.A N VAL 127.A O no hydrogen 3.288 N/A LYS 31.A N PRO 17.A O no hydrogen 3.008 N/A LYS 31.A NZ TRP 12.A O no hydrogen 2.718 N/A LYS 31.A NZ TYR 15.A O no hydrogen 3.067 N/A VAL 32.A N THR 130.A O no hydrogen 3.098 N/A LEU 34.A N PHE 48.A O no hydrogen 2.749 N/A GLN 35.A N TYR 76.A O no hydrogen 2.922 N/A GLN 35.A NE2 SER 37.A OG no hydrogen 3.173 N/A SER 37.A OG ASN 6.A OD1.B no hydrogen 2.666 N/A PHE 38.A N GLN 35.A O no hydrogen 3.061 N/A GLU 39.A N LYS 36.A O no hydrogen 2.955 N/A LYS 40.A NZ ASN 6.A OD1.A no hydrogen 3.022 N/A LYS 41.A N PHE 38.A O no hydrogen 3.145 N/A LYS 41.A NZ ASN 6.A OD1.A no hydrogen 2.618 N/A LEU 42.A N GLU 39.A O no hydrogen 3.007 N/A ALA 43.A N GLU 46.A OE2 no hydrogen 2.984 N/A GLU 46.A N ALA 43.A O no hydrogen 2.860 N/A CYS 47.A N PRO 44.A O no hydrogen 3.084 N/A CYS 47.A SG ALA 43.A O no hydrogen 3.712 N/A SER 49.A N ASP 52.A OD2 no hydrogen 2.904 N/A ASP 52.A N SER 49.A OG no hydrogen 3.006 N/A LEU 53.A N SER 49.A O no hydrogen 3.063 N/A PHE 54.A N PRO 50.A O no hydrogen 3.178 N/A ASN 55.A N LEU 51.A O no hydrogen 2.943 N/A LYS 56.A N ASP 52.A O no hydrogen 2.930 N/A ILE 57.A N LEU 53.A O no hydrogen 2.985 N/A ARG 58.A N PHE 54.A O no hydrogen 3.004 N/A ARG 58.A NH1 ASN 55.A OD1 no hydrogen 2.964 N/A ARG 58.A NH2 ASN 55.A OD1 no hydrogen 2.950 N/A GLU 59.A N ASN 55.A O no hydrogen 2.937 N/A GLN 60.A N LYS 56.A O no hydrogen 3.109 N/A GLN 60.A N ILE 57.A O no hydrogen 3.120 N/A ASN 61.A N ARG 58.A O no hydrogen 2.960 N/A GLU 62.A N ILE 57.A O no hydrogen 3.140 N/A GLY 65.A N LEU 124.A O no hydrogen 2.697 N/A LEU 66.A N LEU 124.A O no hydrogen 3.331 N/A ILE 67.A N PRO 87.A O no hydrogen 2.923 N/A ILE 68.A N GLY 126.A O no hydrogen 2.728 N/A ASP 69.A N LEU 89.A O no hydrogen 2.836 N/A LEU 70.A N HIS 128.A O no hydrogen 2.919 N/A THR 71.A N ASP 69.A OD1 no hydrogen 2.843 N/A THR 71.A OG1 ASP 69.A OD1 no hydrogen 2.684 N/A THR 73.A OG1 TYR 76.A OH no hydrogen 2.647 N/A GLN 74.A NE2 HIS 7.A O no hydrogen 2.959 N/A GLN 74.A NE2 TYR 76.A OH no hydrogen 3.209 N/A ARG 75.A NH1 TYR 77.A O no hydrogen 3.087 N/A TYR 76.A OH THR 73.A OG1 no hydrogen 2.647 N/A TYR 77.A OH HIS 128.A NE2 no hydrogen 2.700 N/A ASP 81.A N LYS 78.A O no hydrogen 2.610 N/A LEU 82.A N PRO 79.A O no hydrogen 3.183 N/A TYR 88.A OH ASP 69.A OD2 no hydrogen 2.673 N/A LEU 89.A N ILE 67.A O no hydrogen 2.813 N/A LYS 90.A NZ ASP 69.A OD2 no hydrogen 2.864 N/A LYS 90.A NZ THR 71.A O no hydrogen 2.835 N/A ILE 91.A N ASP 69.A O no hydrogen 2.872 N/A THR 93.A N LEU 70.A O no hydrogen 3.102 N/A THR 93.A OG1 ILE 91.A O no hydrogen 3.139 N/A THR 103.A N ASP 100.A OD1 no hydrogen 2.734 N/A THR 103.A OG1 ASP 100.A OD1 no hydrogen 2.621 N/A ILE 104.A N ASP 100.A O no hydrogen 2.975 N/A PHE 105.A N ASP 101.A O no hydrogen 2.933 N/A LYS 106.A N GLU 102.A O no hydrogen 3.004 N/A PHE 107.A N THR 103.A O no hydrogen 2.980 N/A LYS 108.A N ILE 104.A O no hydrogen 2.945 N/A LYS 108.A NZ ASP 146.A OD2 no hydrogen 2.757 N/A LYS 108.A NZ ASN 184.A OD1 no hydrogen 2.761 N/A HIS 109.A N PHE 105.A O no hydrogen 2.902 N/A ALA 110.A N LYS 106.A O no hydrogen 3.031 N/A VAL 111.A N PHE 107.A O no hydrogen 3.049 N/A ASN 112.A N LYS 108.A O no hydrogen 2.768 N/A GLY 113.A N HIS 109.A O no hydrogen 3.033 N/A PHE 114.A N ALA 110.A O no hydrogen 3.025 N/A LEU 115.A N VAL 111.A O no hydrogen 2.949 N/A LYS 116.A N ASN 112.A O no hydrogen 2.975 N/A GLU 117.A N GLY 113.A O no hydrogen 3.110 N/A GLU 117.A N PHE 114.A O no hydrogen 3.056 N/A ASN 118.A N LEU 115.A O no hydrogen 3.258 N/A ASN 118.A ND2 PHE 114.A O no hydrogen 2.918 N/A ASN 121.A N ASN 118.A O no hydrogen 3.409 N/A ASN 121.A ND2 ASN 118.A OD1 no hydrogen 2.981 N/A LYS 123.A N ASN 121.A OD1 no hydrogen 2.961 N/A LEU 124.A N GLU 63.A O no hydrogen 2.834 N/A ILE 125.A N ARG 26.A O no hydrogen 2.714 N/A GLY 126.A N LEU 66.A O no hydrogen 2.826 N/A VAL 127.A N ILE 28.A O no hydrogen 2.946 N/A HIS 128.A N ILE 68.A O no hydrogen 3.006 N/A HIS 128.A ND1 SER 129.A O no hydrogen 2.955 N/A HIS 128.A NE2 TYR 77.A OH no hydrogen 2.700 N/A SER 129.A OG THR 136.A OG1 no hydrogen 2.713 N/A HIS 131.A NE2 GLU 10.A O no hydrogen 2.881 N/A ASN 134.A ND2 GLU 168.A OE2 no hydrogen 3.223 N/A ARG 135.A NH1 THR 93.A O no hydrogen 2.905 N/A ARG 135.A NH2 THR 130.A OG1 no hydrogen 2.931 N/A THR 136.A OG1 SER 129.A OG no hydrogen 2.713 N/A GLY 137.A N LEU 133.A O no hydrogen 3.024 N/A TYR 138.A N ASN 134.A O no hydrogen 2.849 N/A TYR 138.A OH ASP 175.A OD1 no hydrogen 2.528 N/A LEU 139.A N ARG 135.A O no hydrogen 3.086 N/A ILE 140.A N THR 136.A O no hydrogen 3.025 N/A CYS 141.A N GLY 137.A O no hydrogen 2.953 N/A CYS 141.A SG GLY 137.A O no hydrogen 3.297 N/A ARG 142.A N TYR 138.A O no hydrogen 2.792 N/A ARG 142.A NE TYR 138.A OH no hydrogen 3.152 N/A ARG 142.A NH1 ASP 146.A OD1 no hydrogen 2.842 N/A ARG 142.A NH2 ASP 175.A O no hydrogen 2.944 N/A ARG 142.A NH2 ASP 175.A OD1 no hydrogen 2.826 N/A TYR 143.A N LEU 139.A O no hydrogen 3.006 N/A TYR 143.A OH ASN 112.A OD1 no hydrogen 2.612 N/A LEU 144.A N ILE 140.A O no hydrogen 3.054 N/A ILE 145.A N CYS 141.A O no hydrogen 2.902 N/A ASP 146.A N ARG 142.A O no hydrogen 2.974 N/A VAL 147.A N TYR 143.A O no hydrogen 2.851 N/A GLU 148.A N LEU 144.A O no hydrogen 3.046 N/A GLY 149.A N ILE 145.A O no hydrogen 3.184 N/A VAL 150.A N LEU 144.A O no hydrogen 3.071 N/A ASP 154.A N ARG 151.A O no hydrogen 2.784 N/A ALA 155.A N ARG 151.A O no hydrogen 2.989 N/A ILE 156.A N PRO 152.A O no hydrogen 3.015 N/A GLU 157.A N ASP 153.A O no hydrogen 2.957 N/A LEU 158.A N ASP 154.A O no hydrogen 2.900 N/A PHE 159.A N ALA 155.A O no hydrogen 2.789 N/A ASN 160.A N ILE 156.A O no hydrogen 2.813 N/A ARG 161.A N GLU 157.A O no hydrogen 3.019 N/A ARG 161.A NE GLU 157.A OE2 no hydrogen 3.359 N/A ARG 161.A NH2 GLU 157.A OE2 no hydrogen 2.665 N/A CYS 162.A N LEU 158.A O no hydrogen 3.055 N/A CYS 162.A SG ARG 21.A O no hydrogen 3.911 N/A CYS 162.A SG LEU 158.A O no hydrogen 3.418 N/A ARG 163.A N PHE 159.A O no hydrogen 2.872 N/A ARG 163.A NE GLY 132.A O no hydrogen 2.754 N/A ARG 163.A NH1 LEU 16.A O no hydrogen 2.922 N/A ARG 163.A NH1 ARG 163.A O no hydrogen 2.957 N/A ARG 163.A NH2 LEU 16.A O no hydrogen 2.843 N/A ARG 163.A NH2 HIS 131.A O no hydrogen 2.933 N/A GLY 164.A N ASN 160.A O no hydrogen 2.986 N/A LEU 167.A N ASN 160.A OD1 no hydrogen 2.896 N/A GLU 168.A N ASN 134.A OD1 no hydrogen 2.939 N/A ARG 169.A N ASN 134.A OD1 no hydrogen 3.270 N/A GLN 170.A NE2 GLU 168.A O no hydrogen 2.989 N/A ASN 171.A ND2 HIS 96.A O no hydrogen 2.998 N/A TYR 172.A OH GLN 97.A O no hydrogen 3.402 N/A ILE 173.A N ARG 169.A O no hydrogen 3.066 N/A GLU 174.A N GLN 170.A O no hydrogen 3.036 N/A ASP 175.A N ASN 171.A O no hydrogen 3.065 N/A LEU 176.A N TYR 172.A O no hydrogen 2.984 N/A GLN 177.A N ILE 173.A O no hydrogen 2.898 N/A GLN 177.A NE2 ASP 153.A OD1 no hydrogen 2.897 N/A ASN 178.A N GLU 174.A O no hydrogen 2.817 N/A ASN 178.A ND2 GLU 174.A OE1.A no hydrogen 2.754 N/A ASN 178.A ND2 GLU 174.A OE2.A no hydrogen 3.201 N/A ASN 178.A ND2 GLU 174.A OE2.B no hydrogen 3.126 N/A GLY 179.A N ASP 175.A O no hydrogen 2.794 N/A ARG 182.A N ASP 146.A OD2 no hydrogen 2.829 N/A ARG 182.A NE ASP 101.A OD1 no hydrogen 3.011 N/A ARG 182.A NH1 ASP 175.A OD1 no hydrogen 3.320 N/A ARG 182.A NH1 ASP 175.A OD2 no hydrogen 3.227 N/A ARG 182.A NH1 PRO 180.A O no hydrogen 2.767 N/A ARG 182.A NH2 ASP 175.A OD2 no hydrogen 2.956 N/A