Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5k0l_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A N GLN 6.A OE1 no hydrogen 3.182 N/A THR 3.A OG1 GLU 5.A OE1 no hydrogen 3.448 N/A LYS 4.A NZ TRP 37.A O no hydrogen 2.642 N/A GLN 6.A N THR 3.A OG1 no hydrogen 3.121 N/A ARG 7.A N THR 3.A O no hydrogen 2.980 N/A ARG 7.A NE GLU 36.A OE2 no hydrogen 2.590 N/A ARG 7.A NH1 GLU 36.A OE1 no hydrogen 3.028 N/A ARG 7.A NH1 GLU 36.A OE2 no hydrogen 3.432 N/A ARG 7.A NH2 ASP 2.A OD2 no hydrogen 2.846 N/A ILE 8.A N LYS 4.A O no hydrogen 2.946 N/A LEU 9.A N GLU 5.A O no hydrogen 3.199 N/A ARG 10.A N GLN 6.A O no hydrogen 2.891 N/A TYR 11.A N ARG 7.A O no hydrogen 2.860 N/A VAL 12.A N ILE 8.A O no hydrogen 3.023 N/A GLN 13.A N LEU 9.A O no hydrogen 2.929 N/A GLN 14.A N ARG 10.A O no hydrogen 2.934 N/A ASN 15.A N TYR 11.A O no hydrogen 2.989 N/A ASN 15.A ND2 TYR 11.A O no hydrogen 2.813 N/A ALA 16.A N VAL 12.A O no hydrogen 2.684 N/A LYS 17.A N SER 23.A OG no hydrogen 2.898 N/A LYS 17.A NZ PRO 18.A O no hydrogen 3.150 N/A GLY 19.A N PHE 104.A O no hydrogen 2.796 N/A ASP 20.A N LYS 17.A O no hydrogen 3.146 N/A GLN 22.A NE2 GLU 26.A OE2 no hydrogen 2.814 N/A SER 23.A N ASP 20.A OD1 no hydrogen 3.384 N/A SER 23.A OG ASP 20.A O no hydrogen 2.877 N/A VAL 24.A N ASP 20.A O no hydrogen 3.202 N/A LEU 25.A N PRO 21.A O no hydrogen 3.051 N/A GLU 26.A N GLN 22.A O no hydrogen 2.997 N/A ALA 27.A N SER 23.A O no hydrogen 2.844 N/A ILE 28.A N VAL 24.A O no hydrogen 2.991 N/A ASP 29.A N LEU 25.A O no hydrogen 2.894 N/A THR 30.A N GLU 26.A O no hydrogen 2.889 N/A THR 30.A OG1 GLU 26.A O no hydrogen 2.858 N/A TYR 31.A N ALA 27.A O no hydrogen 2.922 N/A TYR 31.A OH GLU 36.A OE2 no hydrogen 2.481 N/A CYS 32.A N ILE 28.A O no hydrogen 2.936 N/A CYS 32.A SG ILE 28.A O no hydrogen 3.332 N/A CYS 32.A SG GLU 36.A O no hydrogen 3.986 N/A THR 33.A N ASP 29.A O no hydrogen 2.981 N/A THR 33.A N THR 30.A O no hydrogen 3.201 N/A THR 33.A OG1 ASP 29.A O no hydrogen 2.801 N/A GLN 34.A N THR 30.A O no hydrogen 2.851 N/A LYS 35.A N TYR 31.A O no hydrogen 2.801 N/A GLU 36.A N TYR 31.A O no hydrogen 3.259 N/A ASN 40.A ND2 GLY 65.A O no hydrogen 3.441 N/A ASN 40.A ND2 ASP 140.A O no hydrogen 3.002 N/A GLY 42.A N ASP 29.A OD1 no hydrogen 3.190 N/A LYS 45.A NZ ASP 168.A OD1 no hydrogen 2.808 N/A LYS 45.A NZ ASP 204.A OD2 no hydrogen 2.868 N/A GLY 46.A N GLY 42.A O no hydrogen 3.038 N/A GLN 47.A N ASP 43.A O no hydrogen 2.894 N/A GLN 47.A N ALA 44.A O no hydrogen 3.216 N/A MET 49.A N LYS 45.A O no hydrogen 3.104 N/A ASP 50.A N GLY 46.A O no hydrogen 2.856 N/A ALA 51.A N GLN 47.A O no hydrogen 3.005 N/A VAL 52.A N ILE 48.A O no hydrogen 2.977 N/A ILE 53.A N MET 49.A O no hydrogen 3.014 N/A ARG 54.A N ASP 50.A O no hydrogen 2.875 N/A GLU 55.A N ALA 51.A O no hydrogen 2.885 N/A TYR 56.A N VAL 52.A O no hydrogen 3.052 N/A SER 57.A N ILE 53.A O no hydrogen 2.755 N/A SER 57.A OG ARG 54.A O no hydrogen 3.487 N/A SER 59.A N ASP 135.A OD2 no hydrogen 2.791 N/A LEU 60.A N ASP 135.A OD2 no hydrogen 2.701 N/A VAL 61.A N ARG 84.A O no hydrogen 2.984 N/A LEU 62.A N MET 136.A O no hydrogen 2.823 N/A GLU 63.A N LEU 86.A O no hydrogen 2.887 N/A LEU 64.A N PHE 138.A O no hydrogen 2.747 N/A GLY 65.A N MET 88.A O no hydrogen 2.743 N/A ALA 66.A N MET 88.A O no hydrogen 3.160 N/A TYR 67.A N GLU 89.A OE1 no hydrogen 2.780 N/A TYR 67.A OH GLU 5.A OE2 no hydrogen 2.442 N/A GLY 69.A N ALA 66.A O no hydrogen 2.941 N/A TYR 70.A OH ASP 29.A OD1 no hydrogen 3.227 N/A TYR 70.A OH ASP 29.A OD2 no hydrogen 2.581 N/A VAL 73.A N GLY 69.A O no hydrogen 2.862 N/A ARG 74.A N TYR 70.A O no hydrogen 2.888 N/A ARG 74.A NE ASP 50.A OD1 no hydrogen 2.973 N/A ARG 74.A NE ASP 50.A OD2 no hydrogen 3.292 N/A ARG 74.A NH1 ASP 43.A OD1 no hydrogen 3.516 N/A ARG 74.A NH1 GLN 47.A OE1 no hydrogen 3.466 N/A ARG 74.A NH1 ASP 50.A OD2 no hydrogen 2.488 N/A ARG 74.A NH2 ASP 43.A OD1 no hydrogen 2.988 N/A ARG 74.A NH2 TYR 70.A OH no hydrogen 3.099 N/A MET 75.A N SER 71.A O no hydrogen 2.904 N/A ALA 76.A N ALA 72.A O no hydrogen 2.931 N/A ARG 77.A N VAL 73.A O no hydrogen 3.118 N/A ARG 77.A NH1 ASP 50.A OD1 no hydrogen 2.867 N/A ARG 77.A NH1 ARG 74.A O no hydrogen 2.780 N/A ARG 77.A NH2 ASP 50.A OD2 no hydrogen 3.202 N/A LEU 78.A N MET 75.A O no hydrogen 2.876 N/A LEU 79.A N ALA 76.A O no hydrogen 3.206 N/A ALA 83.A N GLN 80.A O no hydrogen 3.086 N/A ARG 84.A N SER 59.A O no hydrogen 2.824 N/A ARG 84.A NH1 ALA 83.A O no hydrogen 2.360 N/A LEU 85.A N LYS 110.A O no hydrogen 2.836 N/A LEU 86.A N VAL 61.A O no hydrogen 2.758 N/A THR 87.A N THR 112.A O no hydrogen 2.853 N/A THR 87.A OG1 GLU 63.A OE1 no hydrogen 2.455 N/A MET 88.A N GLU 63.A O no hydrogen 2.865 N/A GLU 89.A N LEU 114.A O no hydrogen 2.854 N/A ASN 91.A N GLU 89.A OE2 no hydrogen 2.868 N/A CYS 94.A N ASN 91.A OD1 no hydrogen 2.971 N/A CYS 94.A SG ASN 91.A OD1 no hydrogen 3.771 N/A ALA 95.A N ASN 91.A O no hydrogen 2.807 N/A ALA 96.A N PRO 92.A O no hydrogen 2.902 N/A ILE 97.A N ASP 93.A O no hydrogen 2.998 N/A THR 98.A N CYS 94.A O no hydrogen 2.840 N/A THR 98.A OG1 TYR 67.A O no hydrogen 2.839 N/A THR 98.A OG1 CYS 94.A O no hydrogen 3.213 N/A GLN 99.A N ALA 95.A O no hydrogen 3.049 N/A GLN 99.A NE2 GLN 99.A O no hydrogen 3.029 N/A GLN 100.A N ALA 96.A O no hydrogen 3.169 N/A GLN 100.A NE2 ALA 96.A O no hydrogen 3.387 N/A MET 101.A N ILE 97.A O no hydrogen 2.872 N/A LEU 102.A N THR 98.A O no hydrogen 2.989 N/A ASN 103.A N GLN 99.A O no hydrogen 2.928 N/A PHE 104.A N GLN 100.A O no hydrogen 2.878 N/A ALA 105.A N MET 101.A O no hydrogen 3.029 N/A GLY 106.A N ASN 103.A O no hydrogen 2.953 N/A LEU 107.A N LEU 102.A O no hydrogen 2.980 N/A GLN 108.A N GLN 108.A OE1 no hydrogen 2.874 N/A LYS 110.A N LEU 107.A O no hydrogen 2.834 N/A LYS 110.A NZ ALA 76.A O no hydrogen 3.057 N/A LYS 110.A NZ LEU 79.A O no hydrogen 3.169 N/A THR 112.A N LEU 85.A O no hydrogen 2.852 N/A LEU 114.A N THR 87.A O no hydrogen 2.807 N/A ASN 115.A ND2 GLU 89.A O no hydrogen 2.704 N/A GLY 116.A N GLU 89.A O no hydrogen 3.107 N/A SER 118.A OG GLN 119.A OE1 no hydrogen 3.562 N/A SER 118.A OG ASP 149.A OD1 no hydrogen 3.407 N/A SER 118.A OG ASP 149.A OD2 no hydrogen 2.600 N/A GLN 119.A N GLN 119.A OE1 no hydrogen 2.867 N/A ASP 120.A N ALA 117.A O no hydrogen 2.957 N/A LEU 121.A N ALA 117.A O no hydrogen 2.980 N/A ILE 122.A N SER 118.A O no hydrogen 2.898 N/A GLN 124.A N LEU 121.A O no hydrogen 2.918 N/A GLN 124.A NE2 ASP 120.A O no hydrogen 3.051 N/A LEU 125.A N ILE 122.A O no hydrogen 3.268 N/A LYS 126.A NZ ASP 132.A O no hydrogen 2.934 N/A LYS 128.A N GLN 124.A O no hydrogen 2.699 N/A LYS 128.A NZ TYR 129.A OH no hydrogen 3.465 N/A TYR 129.A N LEU 125.A O no hydrogen 3.046 N/A VAL 131.A N LEU 125.A O no hydrogen 3.157 N/A LEU 134.A N LEU 158.A O no hydrogen 2.634 N/A ASP 135.A N LEU 60.A O no hydrogen 2.929 N/A MET 136.A N LEU 60.A O no hydrogen 3.241 N/A VAL 137.A N VAL 164.A O no hydrogen 2.796 N/A PHE 138.A N LEU 62.A O no hydrogen 2.730 N/A LEU 139.A N LEU 166.A O no hydrogen 2.853 N/A ASP 140.A N LEU 64.A O no hydrogen 2.998 N/A HIS 141.A N HIS 141.A ND1 no hydrogen 2.817 N/A HIS 141.A NE2 ASP 149.A OD2 no hydrogen 2.573 N/A LYS 143.A NZ ASP 140.A OD1 no hydrogen 3.354 N/A LYS 143.A NZ HIS 141.A O no hydrogen 2.799 N/A LYS 143.A NZ TYR 146.A OH no hydrogen 3.099 N/A LYS 143.A NZ ASN 169.A OD1 no hydrogen 3.293 N/A ARG 145.A N TRP 142.A O no hydrogen 2.951 N/A TYR 146.A N LYS 143.A O no hydrogen 3.241 N/A TYR 146.A OH ASP 168.A O no hydrogen 2.735 N/A ASP 149.A N ARG 145.A O no hydrogen 2.918 N/A THR 150.A N TYR 146.A O no hydrogen 3.035 N/A THR 150.A OG1 TYR 146.A O no hydrogen 2.861 N/A LEU 151.A N LEU 147.A O no hydrogen 3.020 N/A LEU 152.A N PRO 148.A O no hydrogen 2.844 N/A LEU 153.A N ASP 149.A O no hydrogen 2.824 N/A GLU 154.A N THR 150.A O no hydrogen 3.067 N/A LYS 155.A N LEU 151.A O no hydrogen 2.920 N/A CYS 156.A N LEU 152.A O no hydrogen 2.833 N/A CYS 156.A SG LEU 152.A O no hydrogen 3.355 N/A GLY 157.A N GLU 154.A O no hydrogen 3.041 N/A LEU 158.A N LEU 153.A O no hydrogen 3.030 N/A ARG 160.A N THR 163.A OG1 no hydrogen 2.922 N/A ARG 160.A NE ASP 135.A OD1 no hydrogen 3.344 N/A ARG 160.A NH1 ASP 135.A OD1 no hydrogen 2.871 N/A ARG 160.A NH2 LYS 161.A O no hydrogen 2.964 N/A GLY 162.A N TYR 211.A O no hydrogen 2.753 N/A THR 163.A N ARG 160.A O no hydrogen 2.993 N/A THR 163.A OG1 LEU 134.A O no hydrogen 2.678 N/A THR 163.A OG1 ARG 160.A O no hydrogen 3.002 N/A VAL 164.A N ASP 135.A O no hydrogen 3.050 N/A LEU 165.A N ALA 209.A O no hydrogen 2.802 N/A LEU 166.A N VAL 137.A O no hydrogen 2.784 N/A ALA 167.A N GLU 207.A O no hydrogen 2.743 N/A ASP 168.A N LEU 139.A O no hydrogen 2.964 N/A ASN 169.A N ASP 168.A OD1 no hydrogen 2.652 N/A ASN 169.A ND2 VAL 172.A O no hydrogen 3.162 N/A ASN 169.A ND2 ASP 204.A OD2 no hydrogen 2.904 N/A VAL 170.A N GLY 205.A O no hydrogen 3.396 N/A ILE 171.A N ASP 204.A OD1 no hydrogen 3.253 N/A VAL 172.A N ASP 204.A OD1 no hydrogen 2.814 N/A GLY 174.A N ASN 169.A O no hydrogen 3.077 N/A THR 175.A N VAL 170.A O no hydrogen 3.021 N/A THR 175.A OG1 THR 175.A O no hydrogen 2.625 N/A PHE 178.A N ASP 177.A OD1 no hydrogen 2.691 N/A LEU 179.A N THR 175.A O no hydrogen 3.017 N/A ALA 180.A N PRO 176.A O no hydrogen 2.911 N/A TYR 181.A N ASP 177.A O no hydrogen 3.003 N/A VAL 182.A N PHE 178.A O no hydrogen 3.003 N/A ARG 183.A N LEU 179.A O no hydrogen 2.992 N/A ARG 183.A NE GLU 207.A OE2 no hydrogen 3.008 N/A ARG 183.A NH2 GLU 207.A OE1 no hydrogen 2.817 N/A ARG 183.A NH2 GLU 207.A OE2 no hydrogen 3.524 N/A GLY 184.A N ALA 180.A O no hydrogen 2.959 N/A SER 187.A N SER 185.A OG no hydrogen 2.998 N/A SER 187.A OG GLY 213.A O no hydrogen 2.798 N/A PHE 188.A N SER 185.A O no hydrogen 3.396 N/A GLU 189.A N ILE 210.A O no hydrogen 2.980 N/A THR 191.A N LYS 208.A O no hydrogen 2.814 N/A HIS 192.A ND1 GLU 207.A OE1 no hydrogen 2.846 N/A TYR 193.A N LEU 206.A O no hydrogen 2.843 N/A SER 195.A N ASP 204.A O no hydrogen 2.914 N/A LEU 197.A N VAL 202.A O no hydrogen 2.829 N/A LYS 201.A NZ GLU 198.A O no hydrogen 3.364 N/A VAL 202.A N LEU 197.A O no hydrogen 3.388 N/A ASP 204.A N SER 195.A O no hydrogen 2.893 N/A LEU 206.A N TYR 193.A O no hydrogen 2.829 N/A GLU 207.A N ALA 167.A O no hydrogen 2.920 N/A LYS 208.A N THR 191.A O no hydrogen 2.809 N/A LYS 208.A NZ TYR 56.A OH no hydrogen 2.898 N/A LYS 208.A NZ TYR 193.A OH no hydrogen 2.806 N/A ALA 209.A N LEU 165.A O no hydrogen 2.673 N/A ILE 210.A N GLU 189.A O no hydrogen 2.933 N/A TYR 211.A N THR 163.A O no hydrogen 2.849 N/A TYR 211.A OH GLU 154.A OE2 no hydrogen 2.405 N/A GLN 212.A N SER 187.A O no hydrogen 2.510 N/A GLN 212.A NE2 ILE 210.A O no hydrogen 3.127 N/A