Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4mk6_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 3.A N SER 1.A OG no hydrogen 3.412 N/A GLU 5.A N ASN 2.A O no hydrogen 3.009 N/A THR 9.A N SER 6.A OG no hydrogen 3.228 N/A LYS 10.A N SER 6.A O no hydrogen 3.215 N/A LYS 11.A N LEU 7.A O no hydrogen 2.861 N/A ALA 12.A N ILE 8.A O no hydrogen 2.919 N/A ILE 13.A N THR 9.A O no hydrogen 2.943 N/A ALA 14.A N LYS 10.A O no hydrogen 3.341 N/A GLY 15.A N LYS 11.A O no hydrogen 3.010 N/A GLY 16.A N ALA 12.A O no hydrogen 2.903 N/A LEU 17.A N ILE 13.A O no hydrogen 3.061 N/A LEU 19.A N GLY 16.A O no hydrogen 2.964 N/A CYS 20.A N LEU 17.A O no hydrogen 3.001 N/A CYS 20.A SG LEU 17.A O no hydrogen 3.205 N/A GLN 21.A N GLU 18.A O no hydrogen 3.158 N/A HIS 22.A N LEU 19.A O no hydrogen 2.851 N/A LYS 23.A N LEU 19.A O no hydrogen 2.851 N/A LYS 23.A NZ ASP 32.A OD2 no hydrogen 2.687 N/A PHE 25.A N ASN 95.A OD1 no hydrogen 2.898 N/A GLU 26.A N GLU 26.A OE1 no hydrogen 2.772 N/A LYS 27.A N ARG 24.A O no hydrogen 2.942 N/A ILE 28.A N ARG 24.A O no hydrogen 3.253 N/A ILE 28.A N PHE 25.A O no hydrogen 3.270 N/A SER 29.A N ASP 32.A OD1 no hydrogen 3.236 N/A ILE 33.A N SER 29.A O no hydrogen 3.179 N/A THR 34.A N ILE 30.A O no hydrogen 2.828 N/A THR 34.A OG1 ILE 30.A O no hydrogen 3.336 N/A THR 34.A OG1 ALA 31.A O no hydrogen 3.185 N/A ASN 35.A N ALA 31.A O no hydrogen 2.910 N/A ILE 36.A N ASP 32.A O no hydrogen 3.106 N/A CYS 37.A N ILE 33.A O no hydrogen 3.036 N/A CYS 37.A SG ALA 12.A O no hydrogen 3.486 N/A CYS 37.A SG ILE 33.A O no hydrogen 3.190 N/A GLY 38.A N ASN 35.A O no hydrogen 3.226 N/A LEU 39.A N THR 34.A O no hydrogen 2.753 N/A THR 43.A N ASN 40.A OD1 no hydrogen 2.906 N/A THR 43.A OG1 ASN 40.A OD1 no hydrogen 2.622 N/A PHE 44.A N ASN 40.A O no hydrogen 3.405 N/A TYR 45.A N ARG 41.A O no hydrogen 3.134 N/A TYR 46.A N THR 43.A O no hydrogen 3.305 N/A HIS 47.A N PHE 44.A O no hydrogen 2.943 N/A HIS 47.A NE2 ALA 4.A O no hydrogen 2.825 N/A PHE 48.A N PHE 44.A O no hydrogen 2.918 N/A THR 49.A N ASP 53.A OD2 no hydrogen 3.242 N/A THR 49.A OG1 ASP 50.A OD1.A no hydrogen 2.533 N/A LYS 51.A N ASP 50.A OD2.B no hydrogen 2.442 N/A LYS 51.A NZ PHE 25.A O no hydrogen 2.648 N/A LYS 51.A NZ GLU 26.A O no hydrogen 3.376 N/A LYS 51.A NZ ILE 28.A O no hydrogen 2.866 N/A TYR 52.A N ASP 50.A OD2.A no hydrogen 2.889 N/A ASP 53.A N ASP 50.A OD2.A no hydrogen 2.874 N/A LEU 54.A N ASP 50.A O.A no hydrogen 3.099 N/A LEU 54.A N ASP 50.A O.B no hydrogen 3.128 N/A LEU 55.A N LYS 51.A O no hydrogen 2.931 N/A THR 56.A N TYR 52.A O no hydrogen 2.895 N/A THR 56.A OG1 TYR 52.A O no hydrogen 2.786 N/A TRP 57.A N ASP 53.A O no hydrogen 2.871 N/A THR 58.A N LEU 54.A O no hydrogen 2.762 N/A THR 58.A OG1 LEU 54.A O no hydrogen 2.769 N/A TYR 59.A N LEU 55.A O no hydrogen 3.009 N/A TYR 59.A OH THR 96.A OG1 no hydrogen 2.580 N/A GLU 60.A N THR 56.A O no hydrogen 3.044 N/A ASN 61.A N TRP 57.A O no hydrogen 2.772 N/A ASP 62.A N TYR 59.A O no hydrogen 3.242 N/A CYS 66.A N ASP 62.A O no hydrogen 2.962 N/A CYS 66.A SG ASP 62.A O no hydrogen 3.875 N/A LEU 67.A N PHE 63.A O no hydrogen 3.038 N/A ALA 68.A N PHE 64.A O no hydrogen 3.050 N/A ASP 69.A N HIS 65.A O no hydrogen 3.191 N/A ILE 71.A N ALA 68.A O no hydrogen 3.225 N/A THR 72.A N ASN 75.A OD1 no hydrogen 2.550 N/A GLY 74.A N THR 72.A OG1 no hydrogen 2.927 N/A ASN 75.A N THR 72.A OG1 no hydrogen 3.091 N/A ASN 75.A ND2 GLY 70.A O no hydrogen 3.053 N/A HIS 79.A N ASN 75.A O no hydrogen 2.652 N/A VAL 80.A N TRP 76.A O no hydrogen 2.906 N/A LYS 82.A N LYS 78.A O no hydrogen 3.114 N/A GLU 84.A N LEU 81.A O no hydrogen 3.054 N/A SER 85.A N LYS 82.A O no hydrogen 3.056 N/A LYS 87.A N LEU 83.A O no hydrogen 3.039 N/A GLU 88.A N GLU 84.A O no hydrogen 2.886 N/A ASN 89.A N SER 85.A O no hydrogen 3.306 N/A ASN 89.A N ILE 86.A O no hydrogen 3.145 N/A ALA 90.A N LYS 87.A O no hydrogen 2.986 N/A TYR 93.A N ASN 89.A O no hydrogen 3.130 N/A TYR 93.A OH ASP 62.A OD2 no hydrogen 2.304 N/A LYS 94.A N ALA 90.A O no hydrogen 2.790 N/A ASN 95.A N ASP 91.A O no hydrogen 3.012 N/A ASN 95.A ND2 CYS 20.A O no hydrogen 2.838 N/A ASN 95.A ND2 LYS 23.A O no hydrogen 2.827 N/A THR 96.A N PHE 92.A O no hydrogen 3.089 N/A THR 96.A OG1 TYR 59.A OH no hydrogen 2.580 N/A THR 96.A OG1 PHE 92.A O no hydrogen 2.964 N/A THR 96.A OG1 TYR 93.A O no hydrogen 3.445 N/A VAL 97.A N TYR 93.A O no hydrogen 2.908 N/A SER 98.A N LYS 94.A O no hydrogen 3.213 N/A SER 98.A OG LYS 94.A O no hydrogen 2.610 N/A ALA 99.A N ASN 95.A O no hydrogen 3.155 N/A ASP 100.A N THR 96.A O no hydrogen 3.032 N/A SER 102.A N ASP 100.A OD1 no hydrogen 3.313 N/A SER 102.A OG ASP 100.A OD1 no hydrogen 2.533 N/A ILE 103.A N ASP 100.A O no hydrogen 3.494 N/A SER 105.A N ALA 101.A O no hydrogen 2.929 N/A PHE 106.A N SER 102.A O no hydrogen 2.931 N/A CYS 107.A N ILE 103.A O no hydrogen 3.173 N/A PHE 108.A N LEU 104.A O no hydrogen 2.829 N/A SER 109.A N SER 105.A O no hydrogen 2.899 N/A SER 109.A OG SER 105.A O no hydrogen 2.705 N/A SER 109.A OG SER 141.A O no hydrogen 3.545 N/A SER 109.A OG SER 145.A OG no hydrogen 2.652 N/A LYS 110.A N PHE 106.A O no hydrogen 3.093 N/A LEU 111.A N CYS 107.A O no hydrogen 3.329 N/A THR 112.A N PHE 108.A O no hydrogen 2.989 N/A THR 112.A OG1 PHE 108.A O no hydrogen 2.881 N/A THR 112.A OG1 SER 109.A O no hydrogen 3.313 N/A ASN 113.A N SER 109.A O no hydrogen 2.893 N/A SER 114.A N LYS 110.A O no hydrogen 3.120 N/A SER 114.A OG LYS 110.A O no hydrogen 3.199 N/A LEU 115.A N LEU 111.A O no hydrogen 2.917 N/A PHE 116.A N THR 112.A O no hydrogen 2.995 N/A LEU 118.A N LEU 115.A O no hydrogen 2.976 N/A PHE 119.A N PHE 116.A O no hydrogen 3.018 N/A GLU 120.A N ASP 117.A O no hydrogen 3.276 N/A LYS 121.A N LEU 118.A O no hydrogen 3.074 N/A ILE 122.A N LEU 118.A O no hydrogen 3.229 N/A ASP 123.A N PHE 119.A O no hydrogen 2.743 N/A ALA 126.A N ASP 123.A O no hydrogen 3.190 N/A THR 127.A N ASP 123.A OD1 no hydrogen 3.125 N/A THR 127.A OG1 ASP 123.A OD1 no hydrogen 3.551 N/A VAL 128.A N ASP 123.A OD2 no hydrogen 3.078 N/A ASP 132.A N ASN 129.A OD1 no hydrogen 2.773 N/A ARG 133.A N ASN 129.A O no hydrogen 3.022 N/A ARG 133.A NE VAL 128.A O no hydrogen 3.265 N/A ARG 133.A NH2 ASP 123.A OD2 no hydrogen 2.980 N/A VAL 134.A N GLU 130.A O no hydrogen 2.936 N/A PHE 135.A N ALA 131.A O no hydrogen 3.016 N/A TYR 136.A N ASP 132.A O no hydrogen 3.011 N/A ALA 137.A N ARG 133.A O no hydrogen 2.833 N/A GLU 138.A N VAL 134.A O no hydrogen 2.995 N/A PHE 139.A N PHE 135.A O no hydrogen 3.058 N/A PHE 140.A N TYR 136.A O no hydrogen 2.887 N/A SER 141.A N ALA 137.A O no hydrogen 2.839 N/A SER 141.A OG GLU 138.A O no hydrogen 2.619 N/A TYR 142.A N GLU 138.A O no hydrogen 2.787 N/A GLY 143.A N PHE 139.A O no hydrogen 3.125 N/A CYS 144.A N PHE 140.A O no hydrogen 2.988 N/A CYS 144.A SG PHE 140.A O no hydrogen 3.449 N/A SER 145.A N SER 141.A O no hydrogen 3.180 N/A SER 145.A OG SER 105.A O no hydrogen 3.001 N/A SER 145.A OG SER 109.A OG no hydrogen 2.652 N/A GLY 146.A N TYR 142.A O no hydrogen 2.917 N/A VAL 147.A N GLY 143.A O no hydrogen 2.896 N/A LEU 148.A N CYS 144.A O no hydrogen 2.954 N/A ILE 149.A N SER 145.A O no hydrogen 2.823 N/A LYS 150.A N GLY 146.A O no hydrogen 3.096 N/A TRP 151.A N VAL 147.A O no hydrogen 3.035 N/A TRP 151.A NE1 GLU 158.A O no hydrogen 2.905 N/A ILE 152.A N LEU 148.A O no hydrogen 3.033 N/A THR 153.A N ILE 149.A O no hydrogen 2.794 N/A THR 153.A OG1 ILE 149.A O no hydrogen 2.974 N/A ARG 154.A N LYS 150.A O no hydrogen 2.944 N/A GLY 155.A N ILE 152.A O no hydrogen 3.055 N/A PHE 156.A N TRP 151.A O no hydrogen 2.839 N/A GLU 158.A N GLU 158.A OE1 no hydrogen 2.581 N/A THR 162.A N ALA 159.A O no hydrogen 2.901 N/A ILE 163.A N ALA 159.A O no hydrogen 3.230 N/A ALA 164.A N PRO 160.A O no hydrogen 2.851 N/A ASN 165.A N GLU 161.A O no hydrogen 3.124 N/A GLN 166.A N THR 162.A O no hydrogen 3.147 N/A LEU 167.A N ILE 163.A O no hydrogen 3.006 N/A PHE 168.A N ALA 164.A O no hydrogen 3.176 N/A ARG 169.A N ASN 165.A O no hydrogen 2.950 N/A LEU 170.A N GLN 166.A O no hydrogen 2.965 N/A ALA 171.A N LEU 167.A O no hydrogen 3.084 N/A LYS 172.A N PHE 168.A O no hydrogen 2.741 N/A ASP 173.A N ARG 169.A O no hydrogen 2.798 N/A THR 174.A N LEU 170.A O no hydrogen 2.934 N/A THR 174.A OG1 LEU 170.A O no hydrogen 2.532 N/A GLU 175.A N ALA 171.A O no hydrogen 3.158 N/A PHE 176.A N LYS 172.A O no hydrogen 3.248 N/A LEU 177.A N ASP 173.A O no hydrogen 2.971 N/A ALA 178.A N THR 174.A O no hydrogen 2.868 N/A ASN 179.A N GLU 175.A O no hydrogen 3.069 N/A ASN 179.A N PHE 176.A O no hydrogen 3.238 N/A SER 180.A N LEU 177.A O no hydrogen 2.925 N/A SER 180.A OG PHE 176.A O no hydrogen 2.895 N/A ARG 182.A NH1 SER 180.A O no hydrogen 2.557 N/A