Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6ljg_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 5.A N SER 3.A OG no hydrogen 2.909 N/A ARG 6.A N SER 3.A O no hydrogen 3.021 N/A ARG 6.A NE TYR 9.A O no hydrogen 2.841 N/A ARG 6.A NH1 TYR 9.A O no hydrogen 3.017 N/A ARG 6.A NH1 GLU 14.A OE1 no hydrogen 2.695 N/A ARG 6.A NH2 GLU 14.A OE1 no hydrogen 2.768 N/A ASN 8.A ND2 GLN 122.A O no hydrogen 3.060 N/A TYR 9.A OH GLN 70.A OE1 no hydrogen 2.620 N/A GLU 12.A N HIS 10.A ND1 no hydrogen 2.882 N/A GLU 14.A N HIS 10.A O no hydrogen 2.970 N/A ALA 15.A N GLN 11.A O no hydrogen 2.965 N/A GLY 16.A N GLU 12.A O no hydrogen 2.915 N/A ILE 17.A N SER 13.A O no hydrogen 2.963 N/A ASN 18.A N GLU 14.A O no hydrogen 3.267 N/A ASN 18.A ND2 ARG 76.A O no hydrogen 3.074 N/A ARG 19.A N ALA 15.A O no hydrogen 2.948 N/A ARG 19.A NH1 SER 110.A OG no hydrogen 2.701 N/A ARG 19.A NH2 SER 110.A O no hydrogen 3.288 N/A GLN 20.A N GLY 16.A O no hydrogen 2.885 N/A GLN 20.A NE2 GLU 24.A OE2 no hydrogen 2.889 N/A ILE 21.A N ILE 17.A O no hydrogen 2.812 N/A ASN 22.A N ASN 18.A O no hydrogen 3.231 N/A ASN 22.A ND2 ASP 81.A O no hydrogen 2.915 N/A MET 23.A N ARG 19.A O no hydrogen 3.117 N/A GLU 24.A N GLN 20.A O no hydrogen 2.856 N/A LEU 25.A N ILE 21.A O no hydrogen 2.984 N/A TYR 26.A N ASN 22.A O no hydrogen 2.887 N/A ALA 27.A N MET 23.A O no hydrogen 2.979 N/A CYS 28.A N GLU 24.A O no hydrogen 2.846 N/A CYS 28.A SG SER 56.A O no hydrogen 3.452 N/A CYS 28.A SG SER 56.A OG no hydrogen 3.461 N/A TYR 29.A N LEU 25.A O no hydrogen 2.919 N/A THR 30.A N TYR 26.A O no hydrogen 3.024 N/A THR 30.A OG1 TYR 26.A O no hydrogen 3.448 N/A TYR 31.A N ALA 27.A O no hydrogen 2.945 N/A TYR 31.A OH GLU 104.A OE2 no hydrogen 2.449 N/A GLN 32.A N CYS 28.A O no hydrogen 2.883 N/A SER 33.A N TYR 29.A O no hydrogen 2.913 N/A MET 34.A N THR 30.A O no hydrogen 2.999 N/A ALA 35.A N TYR 31.A O no hydrogen 2.900 N/A TYR 36.A N GLN 32.A O no hydrogen 3.219 N/A TYR 37.A N SER 33.A O no hydrogen 2.896 N/A TYR 37.A OH GLY 91.A O no hydrogen 2.641 N/A PHE 38.A N MET 34.A O no hydrogen 2.981 N/A ASP 39.A N TYR 36.A O no hydrogen 3.263 N/A ARG 40.A N TYR 37.A O no hydrogen 3.032 N/A ARG 40.A NE ASP 42.A OD1 no hydrogen 2.933 N/A ARG 40.A NH2 ASP 42.A OD1 no hydrogen 3.368 N/A ARG 40.A NH2 ASP 42.A OD2 no hydrogen 2.899 N/A VAL 43.A N ARG 40.A O no hydrogen 2.971 N/A ALA 44.A N ARG 40.A O no hydrogen 2.718 N/A LEU 45.A N PHE 38.A O no hydrogen 2.999 N/A GLY 47.A N ASP 165.A OD2 no hydrogen 3.302 N/A PHE 48.A N ASP 165.A OD1 no hydrogen 2.915 N/A SER 49.A N LEU 45.A O no hydrogen 2.972 N/A SER 49.A OG ALA 35.A O no hydrogen 2.548 N/A LYS 50.A N PRO 46.A O no hydrogen 2.965 N/A LYS 50.A NZ ASP 169.A O no hydrogen 3.294 N/A LYS 50.A NZ SER 170.A O no hydrogen 3.557 N/A PHE 51.A N GLY 47.A O no hydrogen 2.912 N/A PHE 52.A N PHE 48.A O no hydrogen 2.989 N/A LYS 53.A N SER 49.A O no hydrogen 2.911 N/A LYS 53.A NZ ASP 57.A OD1 no hydrogen 2.800 N/A LYS 53.A NZ ASP 57.A OD2 no hydrogen 3.450 N/A ASN 54.A N.A LYS 50.A O no hydrogen 2.916 N/A ASN 54.A N.B LYS 50.A O no hydrogen 2.916 N/A SER 55.A N PHE 51.A O no hydrogen 3.011 N/A SER 55.A OG PHE 51.A O no hydrogen 2.953 N/A SER 56.A N PHE 52.A O no hydrogen 2.832 N/A SER 56.A OG CYS 28.A O no hydrogen 2.989 N/A ASP 57.A N LYS 53.A O no hydrogen 2.970 N/A GLU 58.A N ASN 54.A O.A no hydrogen 2.947 N/A GLU 58.A N ASN 54.A O.B no hydrogen 2.956 N/A GLU 59.A N SER 55.A O no hydrogen 2.976 N/A ARG 60.A N.A SER 56.A O no hydrogen 3.017 N/A ARG 60.A N.B SER 56.A O no hydrogen 3.018 N/A ARG 60.A NE.A GLU 64.A OE2 no hydrogen 3.203 N/A ARG 60.A NH1.B ASP 57.A OD1 no hydrogen 3.008 N/A ARG 60.A NH2.A GLU 64.A OE2 no hydrogen 3.385 N/A GLU 61.A N ASP 57.A O no hydrogen 2.970 N/A HIS 62.A N GLU 58.A O no hydrogen 2.922 N/A ALA 63.A N GLU 59.A O no hydrogen 2.922 N/A GLU 64.A N ARG 60.A O.A no hydrogen 2.981 N/A GLU 64.A N ARG 60.A O.B no hydrogen 2.998 N/A LYS 65.A N GLU 61.A O no hydrogen 3.016 N/A LYS 65.A NZ HIS 133.A ND1 no hydrogen 3.282 N/A LEU 66.A N HIS 62.A O no hydrogen 3.173 N/A MET 67.A N ALA 63.A O no hydrogen 2.981 N/A LYS 68.A N GLU 64.A O no hydrogen 2.846 N/A TYR 69.A N LYS 65.A O no hydrogen 2.843 N/A TYR 69.A OH GLN 125.A OE1 no hydrogen 2.590 N/A GLN 70.A N LEU 66.A O no hydrogen 2.803 N/A GLN 70.A NE2 GLU 14.A O no hydrogen 3.045 N/A GLN 70.A NE2 ASN 18.A OD1 no hydrogen 2.996 N/A ASN 71.A N MET 67.A O no hydrogen 3.215 N/A LYS 72.A N LYS 68.A O no hydrogen 2.951 N/A ARG 73.A N TYR 69.A O no hydrogen 3.044 N/A ARG 73.A NH1 TYR 69.A OH no hydrogen 2.840 N/A ARG 73.A NH1 ASP 123.A OD1 no hydrogen 2.882 N/A ARG 73.A NH1 ASP 123.A OD2 no hydrogen 3.173 N/A ARG 73.A NH2 GLN 7.A O no hydrogen 3.006 N/A ARG 73.A NH2 ASN 8.A O no hydrogen 3.013 N/A ARG 73.A NH2 ASP 123.A OD1 no hydrogen 3.417 N/A ARG 73.A NH2 ASP 123.A OD2 no hydrogen 3.381 N/A GLY 74.A N ASN 71.A O no hydrogen 3.145 N/A ARG 76.A N GLU 14.A OE2 no hydrogen 2.955 N/A VAL 78.A N ASN 18.A OD1 no hydrogen 3.211 N/A ARG 87.A NE GLU 89.A O no hydrogen 3.027 N/A ARG 87.A NH2 GLU 89.A OE1 no hydrogen 3.057 N/A TRP 90.A NE1 SER 33.A OG no hydrogen 2.965 N/A GLY 91.A N GLU 89.A OE2 no hydrogen 3.017 N/A THR 92.A N ASP 95.A OD2 no hydrogen 3.007 N/A GLY 93.A N GLU 161.A OE2 no hydrogen 2.772 N/A ASP 95.A N THR 92.A OG1 no hydrogen 2.996 N/A ALA 96.A N THR 92.A O no hydrogen 2.997 N/A MET 97.A N GLY 93.A O no hydrogen 2.972 N/A GLN 98.A N.A LEU 94.A O no hydrogen 2.913 N/A GLN 98.A N.B LEU 94.A O no hydrogen 2.937 N/A VAL 99.A N ASP 95.A O no hydrogen 3.028 N/A ALA 100.A N ALA 96.A O no hydrogen 2.823 N/A LEU 101.A N MET 97.A O no hydrogen 2.929 N/A GLN 102.A N GLN 98.A O.A no hydrogen 3.209 N/A GLN 102.A N GLN 98.A O.B no hydrogen 3.303 N/A LEU 103.A N VAL 99.A O no hydrogen 2.868 N/A GLU 104.A N ALA 100.A O no hydrogen 2.821 N/A LYS 105.A N LEU 101.A O no hydrogen 2.947 N/A THR 106.A N GLN 102.A O no hydrogen 2.936 N/A THR 106.A OG1 GLN 102.A O no hydrogen 2.817 N/A VAL 107.A N LEU 103.A O no hydrogen 2.949 N/A ASN 108.A N GLU 104.A O no hydrogen 2.848 N/A GLN 109.A N LYS 105.A O no hydrogen 2.903 N/A GLN 109.A NE2 GLN 109.A O no hydrogen 3.289 N/A GLN 109.A NE2 ASP 113.A OD1 no hydrogen 2.961 N/A SER 110.A N THR 106.A O no hydrogen 3.076 N/A SER 110.A OG GLN 20.A OE1 no hydrogen 2.592 N/A LEU 111.A N VAL 107.A O no hydrogen 2.932 N/A LEU 112.A N ASN 108.A O no hydrogen 2.820 N/A ASP 113.A N GLN 109.A O no hydrogen 2.859 N/A LEU 114.A N SER 110.A O no hydrogen 2.962 N/A HIS 115.A N LEU 111.A O no hydrogen 2.836 N/A HIS 115.A NE2 GLU 131.A OE2 no hydrogen 2.569 N/A LYS 116.A N LEU 112.A O no hydrogen 3.092 N/A VAL 117.A N ASP 113.A O no hydrogen 3.123 N/A ALA 118.A N LEU 114.A O no hydrogen 2.991 N/A GLY 119.A N HIS 115.A O no hydrogen 2.882 N/A SER 120.A N LYS 116.A O no hydrogen 2.849 N/A SER 120.A OG VAL 117.A O no hydrogen 2.788 N/A HIS 121.A N ALA 118.A O no hydrogen 3.160 N/A HIS 121.A NE2 GLU 12.A OE2 no hydrogen 2.668 N/A GLN 122.A N GLY 119.A O no hydrogen 2.834 N/A ASP 123.A N ALA 118.A O no hydrogen 2.950 N/A MET 126.A N ASP 123.A OD1 no hydrogen 3.124 N/A CYS 127.A N ASP 123.A O no hydrogen 2.994 N/A CYS 127.A SG HIS 115.A O no hydrogen 3.870 N/A CYS 127.A SG ASP 123.A O no hydrogen 3.477 N/A ASP 128.A N ALA 124.A O no hydrogen 3.149 N/A PHE 129.A N GLN 125.A O no hydrogen 2.847 N/A LEU 130.A N MET 126.A O no hydrogen 2.960 N/A GLU 131.A N CYS 127.A O no hydrogen 2.895 N/A THR 132.A N ASP 128.A O no hydrogen 2.769 N/A THR 132.A OG1 ASP 128.A O no hydrogen 2.865 N/A THR 132.A OG1 ASP 128.A OD1 no hydrogen 3.516 N/A HIS 133.A N PHE 129.A O no hydrogen 2.964 N/A TYR 134.A N LEU 130.A O no hydrogen 2.987 N/A TYR 134.A OH HIS 62.A O no hydrogen 2.697 N/A LEU 135.A N LEU 130.A O no hydrogen 2.834 N/A GLU 136.A N GLU 131.A O no hydrogen 3.310 N/A GLN 138.A N TYR 134.A O no hydrogen 3.073 N/A GLN 138.A NE2 GLU 104.A O no hydrogen 3.152 N/A GLN 138.A NE2 GLU 104.A OE1 no hydrogen 2.881 N/A VAL 139.A N LEU 135.A O no hydrogen 3.144 N/A ASN 140.A N GLU 136.A O no hydrogen 3.038 N/A ALA 141.A N GLU 137.A O no hydrogen 2.786 N/A ILE 142.A N GLN 138.A O no hydrogen 2.874 N/A LYS 143.A N VAL 139.A O no hydrogen 3.103 N/A LYS 143.A NZ ASP 147.A OD1 no hydrogen 3.051 N/A LYS 143.A NZ ASP 147.A OD2 no hydrogen 3.217 N/A GLU 144.A N ASN 140.A O no hydrogen 2.938 N/A ILE 145.A N ALA 141.A O no hydrogen 2.974 N/A SER 146.A N ILE 142.A O no hydrogen 2.942 N/A SER 146.A OG ILE 142.A O no hydrogen 2.769 N/A ASP 147.A N LYS 143.A O no hydrogen 2.871 N/A HIS 148.A N GLU 144.A O no hydrogen 3.029 N/A HIS 148.A ND1 TYR 164.A OH no hydrogen 2.505 N/A ILE 149.A N ILE 145.A O no hydrogen 2.898 N/A THR 150.A N SER 146.A O no hydrogen 3.008 N/A THR 150.A OG1 SER 146.A O no hydrogen 3.343 N/A GLN 151.A N ASP 147.A O no hydrogen 2.945 N/A LEU 152.A N HIS 148.A O no hydrogen 2.835 N/A LYS 153.A N ILE 149.A O no hydrogen 2.925 N/A ARG 154.A N THR 150.A O no hydrogen 2.969 N/A ARG 154.A NH1 GLN 151.A OE1 no hydrogen 2.881 N/A VAL 155.A N GLN 151.A O no hydrogen 2.917 N/A GLY 156.A N LEU 152.A O no hydrogen 3.246 N/A TYR 162.A N GLY 158.A O no hydrogen 3.100 N/A GLU 163.A N LEU 159.A O no hydrogen 2.872 N/A TYR 164.A N GLY 160.A O no hydrogen 3.015 N/A TYR 164.A OH HIS 148.A ND1 no hydrogen 2.505 N/A ASP 165.A N GLU 161.A O no hydrogen 2.934 N/A ARG 166.A N TYR 162.A O no hydrogen 3.110 N/A ARG 166.A NH1 GLU 163.A OE1 no hydrogen 2.786 N/A ARG 167.A N GLU 163.A O no hydrogen 3.188 N/A LEU 168.A N TYR 164.A O no hydrogen 3.031 N/A ASP 169.A N ASP 165.A O no hydrogen 2.982 N/A SER 170.A N ARG 167.A O no hydrogen 3.299 N/A SER 170.A OG ARG 167.A O no hydrogen 2.764 N/A