Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5k0j_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A N GLN 6.A OE1 no hydrogen 3.212 N/A THR 3.A OG1 GLN 6.A OE1 no hydrogen 3.271 N/A LYS 4.A NZ TRP 37.A O no hydrogen 2.821 N/A GLN 6.A N THR 3.A OG1 no hydrogen 3.167 N/A ARG 7.A N THR 3.A O no hydrogen 2.977 N/A ARG 7.A NE GLU 36.A OE1 no hydrogen 2.922 N/A ARG 7.A NH1 GLU 36.A OE1 no hydrogen 3.489 N/A ARG 7.A NH1 GLU 36.A OE2 no hydrogen 2.479 N/A ARG 7.A NH2 ASP 2.A OD2 no hydrogen 3.130 N/A ILE 8.A N LYS 4.A O no hydrogen 2.900 N/A LEU 9.A N GLU 5.A O no hydrogen 3.083 N/A ARG 10.A N GLN 6.A O no hydrogen 2.852 N/A ARG 10.A NH1 ASP 2.A OD1 no hydrogen 2.658 N/A ARG 10.A NH2 ASP 2.A OD1 no hydrogen 2.896 N/A TYR 11.A N ARG 7.A O no hydrogen 2.975 N/A VAL 12.A N ILE 8.A O no hydrogen 3.119 N/A GLN 13.A N LEU 9.A O no hydrogen 2.997 N/A GLN 14.A N ARG 10.A O no hydrogen 2.974 N/A GLN 14.A NE2.A ARG 10.A O no hydrogen 3.231 N/A ASN 15.A N TYR 11.A O no hydrogen 2.965 N/A ASN 15.A ND2 TYR 11.A O no hydrogen 2.925 N/A ALA 16.A N VAL 12.A O no hydrogen 2.735 N/A LYS 17.A N SER 23.A OG no hydrogen 2.995 N/A GLY 19.A N PHE 104.A O no hydrogen 2.922 N/A ASP 20.A N LYS 17.A O no hydrogen 3.109 N/A GLN 22.A NE2 GLU 26.A OE2 no hydrogen 3.276 N/A SER 23.A N ASP 20.A O no hydrogen 2.993 N/A SER 23.A N ASP 20.A OD1 no hydrogen 3.257 N/A SER 23.A OG LYS 17.A O no hydrogen 3.313 N/A SER 23.A OG ASP 20.A O no hydrogen 2.707 N/A VAL 24.A N ASP 20.A O no hydrogen 3.261 N/A LEU 25.A N PRO 21.A O no hydrogen 2.986 N/A GLU 26.A N GLN 22.A O no hydrogen 3.050 N/A ALA 27.A N SER 23.A O no hydrogen 2.917 N/A ILE 28.A N VAL 24.A O no hydrogen 3.033 N/A ASP 29.A N LEU 25.A O no hydrogen 3.012 N/A THR 30.A N GLU 26.A O no hydrogen 2.880 N/A THR 30.A OG1 GLU 26.A O no hydrogen 2.983 N/A TYR 31.A N ALA 27.A O no hydrogen 2.881 N/A TYR 31.A OH GLU 36.A OE1 no hydrogen 2.594 N/A CYS 32.A N ILE 28.A O no hydrogen 2.850 N/A CYS 32.A SG ILE 28.A O no hydrogen 3.336 N/A THR 33.A N ASP 29.A O no hydrogen 3.045 N/A THR 33.A OG1 ASP 29.A O no hydrogen 2.602 N/A THR 33.A OG1 THR 30.A O no hydrogen 3.275 N/A GLN 34.A N THR 30.A O no hydrogen 2.894 N/A GLN 34.A N TYR 31.A O no hydrogen 3.341 N/A LYS 35.A N TYR 31.A O no hydrogen 2.725 N/A GLU 36.A N TYR 31.A O no hydrogen 3.173 N/A GLY 42.A N ASN 40.A OD1 no hydrogen 3.106 N/A LYS 45.A NZ ASP 168.A OD1 no hydrogen 2.848 N/A LYS 45.A NZ ASP 204.A OD2 no hydrogen 2.411 N/A GLY 46.A N GLY 42.A O no hydrogen 2.990 N/A GLN 47.A N ASP 43.A O no hydrogen 3.031 N/A GLN 47.A N ALA 44.A O no hydrogen 3.132 N/A MET 49.A N LYS 45.A O no hydrogen 3.033 N/A ASP 50.A N GLY 46.A O no hydrogen 2.915 N/A ALA 51.A N GLN 47.A O no hydrogen 3.061 N/A VAL 52.A N ILE 48.A O no hydrogen 3.033 N/A ILE 53.A N MET 49.A O no hydrogen 2.963 N/A ARG 54.A N ASP 50.A O no hydrogen 2.837 N/A GLU 55.A N ALA 51.A O no hydrogen 2.816 N/A TYR 56.A N VAL 52.A O no hydrogen 3.019 N/A SER 57.A N ILE 53.A O no hydrogen 2.810 N/A SER 59.A N ASP 135.A OD2 no hydrogen 2.657 N/A LEU 60.A N ASP 135.A OD2 no hydrogen 2.739 N/A VAL 61.A N ARG 84.A O no hydrogen 2.908 N/A LEU 62.A N MET 136.A O no hydrogen 2.864 N/A GLU 63.A N LEU 86.A O no hydrogen 2.752 N/A LEU 64.A N PHE 138.A O no hydrogen 2.882 N/A GLY 65.A N MET 88.A O no hydrogen 2.839 N/A ALA 66.A N MET 88.A O no hydrogen 3.226 N/A TYR 67.A N GLU 89.A OE1 no hydrogen 2.817 N/A TYR 67.A OH GLU 5.A OE2 no hydrogen 2.565 N/A GLY 69.A N ALA 66.A O no hydrogen 3.006 N/A TYR 70.A OH ASP 29.A OD1 no hydrogen 3.375 N/A TYR 70.A OH ASP 29.A OD2 no hydrogen 2.703 N/A VAL 73.A N GLY 69.A O no hydrogen 2.884 N/A ARG 74.A N TYR 70.A O no hydrogen 2.777 N/A ARG 74.A NE ASP 50.A OD1 no hydrogen 2.949 N/A ARG 74.A NE ASP 50.A OD2 no hydrogen 3.346 N/A ARG 74.A NH1 ASP 43.A OD1 no hydrogen 3.440 N/A ARG 74.A NH1 ASP 50.A OD2 no hydrogen 2.782 N/A ARG 74.A NH2 ASP 43.A OD1 no hydrogen 3.102 N/A MET 75.A N SER 71.A O no hydrogen 2.847 N/A ALA 76.A N ALA 72.A O no hydrogen 2.874 N/A ARG 77.A N VAL 73.A O no hydrogen 3.201 N/A ARG 77.A NH1 ASP 50.A OD1 no hydrogen 3.033 N/A ARG 77.A NH1 ARG 74.A O no hydrogen 2.669 N/A ARG 77.A NH2 GLN 22.A OE1 no hydrogen 3.268 N/A ARG 77.A NH2 ASP 50.A OD2 no hydrogen 3.067 N/A LEU 78.A N MET 75.A O no hydrogen 2.961 N/A LEU 79.A N ALA 76.A O no hydrogen 3.176 N/A ALA 83.A N GLN 80.A O no hydrogen 3.035 N/A ARG 84.A N SER 59.A O no hydrogen 2.841 N/A ARG 84.A NH1 TYR 129.A O no hydrogen 3.454 N/A ARG 84.A NH2 TYR 129.A O no hydrogen 3.344 N/A LEU 85.A N LYS 110.A O no hydrogen 2.895 N/A LEU 86.A N VAL 61.A O no hydrogen 2.773 N/A THR 87.A N THR 112.A O no hydrogen 2.931 N/A THR 87.A OG1 GLU 63.A OE1 no hydrogen 2.670 N/A MET 88.A N GLU 63.A O no hydrogen 2.868 N/A GLU 89.A N LEU 114.A O no hydrogen 2.992 N/A ASN 91.A N GLU 89.A OE2 no hydrogen 2.721 N/A CYS 94.A N ASN 91.A OD1 no hydrogen 2.937 N/A CYS 94.A SG ASN 91.A OD1 no hydrogen 3.757 N/A ALA 95.A N ASN 91.A O no hydrogen 2.917 N/A ALA 96.A N PRO 92.A O no hydrogen 3.024 N/A ILE 97.A N ASP 93.A O no hydrogen 3.045 N/A THR 98.A N CYS 94.A O no hydrogen 2.892 N/A THR 98.A OG1 TYR 67.A O no hydrogen 2.728 N/A THR 98.A OG1 CYS 94.A O no hydrogen 3.153 N/A GLN 99.A N ALA 95.A O no hydrogen 3.034 N/A GLN 99.A NE2 GLN 99.A O no hydrogen 3.205 N/A GLN 100.A N ALA 96.A O no hydrogen 3.110 N/A GLN 100.A NE2 ALA 96.A O no hydrogen 3.252 N/A MET 101.A N ILE 97.A O no hydrogen 2.774 N/A LEU 102.A N THR 98.A O no hydrogen 2.977 N/A ASN 103.A N GLN 99.A O no hydrogen 2.918 N/A PHE 104.A N GLN 100.A O no hydrogen 2.943 N/A ALA 105.A N MET 101.A O no hydrogen 3.044 N/A GLY 106.A N ASN 103.A O no hydrogen 2.948 N/A LEU 107.A N LEU 102.A O no hydrogen 2.911 N/A GLN 108.A N GLN 108.A OE1 no hydrogen 2.686 N/A LYS 110.A N LEU 107.A O no hydrogen 3.009 N/A LYS 110.A NZ GLN 80.A O no hydrogen 2.710 N/A LYS 110.A NZ ALA 83.A O no hydrogen 3.267 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 2.768 N/A ASN 115.A ND2 GLU 89.A O no hydrogen 2.758 N/A GLY 116.A N GLU 89.A O no hydrogen 3.073 N/A SER 118.A OG ASP 149.A OD1 no hydrogen 3.565 N/A SER 118.A OG ASP 149.A OD2 no hydrogen 2.661 N/A GLN 119.A N GLN 119.A OE1 no hydrogen 2.997 N/A ASP 120.A N ALA 117.A O no hydrogen 2.999 N/A LEU 121.A N ALA 117.A O no hydrogen 3.037 N/A LEU 121.A N SER 118.A O no hydrogen 3.242 N/A ILE 122.A N SER 118.A O no hydrogen 2.867 N/A GLN 124.A N LEU 121.A O no hydrogen 2.955 N/A GLN 124.A NE2 ASP 120.A O no hydrogen 2.924 N/A LEU 125.A N ILE 122.A O no hydrogen 3.293 N/A LYS 126.A NZ ASP 132.A O no hydrogen 2.947 N/A LYS 126.A NZ GLY 157.A O no hydrogen 3.508 N/A LYS 128.A N GLN 124.A O no hydrogen 2.780 N/A TYR 129.A N LEU 125.A O no hydrogen 3.080 N/A VAL 131.A N LEU 125.A O no hydrogen 3.223 N/A LEU 134.A N LEU 158.A O no hydrogen 2.769 N/A ASP 135.A N LEU 60.A O no hydrogen 2.833 N/A MET 136.A N LEU 60.A O no hydrogen 3.298 N/A VAL 137.A N VAL 164.A O no hydrogen 2.793 N/A PHE 138.A N LEU 62.A O no hydrogen 2.766 N/A LEU 139.A N LEU 166.A O no hydrogen 2.839 N/A ASP 140.A N LEU 64.A O no hydrogen 2.963 N/A HIS 141.A N HIS 141.A ND1 no hydrogen 2.828 N/A HIS 141.A NE2 ASP 149.A OD2 no hydrogen 2.690 N/A LYS 143.A NZ ASP 140.A OD1 no hydrogen 3.134 N/A LYS 143.A NZ HIS 141.A O no hydrogen 2.895 N/A LYS 143.A NZ TYR 146.A OH no hydrogen 3.077 N/A LYS 143.A NZ ASN 169.A OD1 no hydrogen 3.067 N/A ARG 145.A N TRP 142.A O no hydrogen 2.936 N/A TYR 146.A N LYS 143.A O no hydrogen 3.390 N/A TYR 146.A OH ASP 168.A O no hydrogen 2.677 N/A ASP 149.A N ARG 145.A O no hydrogen 2.951 N/A THR 150.A N TYR 146.A O no hydrogen 3.044 N/A THR 150.A OG1 TYR 146.A O no hydrogen 2.788 N/A LEU 151.A N LEU 147.A O no hydrogen 3.024 N/A LEU 152.A N PRO 148.A O no hydrogen 2.942 N/A LEU 153.A N ASP 149.A O no hydrogen 2.771 N/A GLU 154.A N THR 150.A O no hydrogen 3.103 N/A GLU 155.A N LEU 151.A O no hydrogen 3.047 N/A CYS 156.A N LEU 152.A O no hydrogen 2.966 N/A CYS 156.A SG LEU 152.A O no hydrogen 3.347 N/A GLY 157.A N GLU 154.A O no hydrogen 3.001 N/A LEU 158.A N LEU 153.A O no hydrogen 3.066 N/A ARG 160.A N THR 163.A OG1 no hydrogen 2.922 N/A ARG 160.A NH1 LYS 161.A O no hydrogen 3.061 N/A ARG 160.A NH2 ASP 135.A OD1 no hydrogen 2.882 N/A GLY 162.A N TYR 211.A O no hydrogen 2.839 N/A THR 163.A N ARG 160.A O no hydrogen 2.952 N/A THR 163.A OG1 LEU 134.A O no hydrogen 2.824 N/A THR 163.A OG1 ARG 160.A O no hydrogen 2.950 N/A VAL 164.A N ASP 135.A O no hydrogen 3.130 N/A LEU 165.A N ALA 209.A O no hydrogen 2.760 N/A LEU 166.A N VAL 137.A O no hydrogen 2.813 N/A ALA 167.A N GLU 207.A O no hydrogen 2.841 N/A ASP 168.A N LEU 139.A O no hydrogen 2.988 N/A ASN 169.A ND2 VAL 172.A O no hydrogen 3.380 N/A ASN 169.A ND2 ASP 204.A OD2 no hydrogen 2.927 N/A VAL 170.A N GLY 205.A O no hydrogen 3.380 N/A ILE 171.A N ASP 204.A OD1 no hydrogen 3.337 N/A VAL 172.A N ASP 204.A OD1 no hydrogen 2.929 N/A GLY 174.A N ASN 169.A O no hydrogen 3.223 N/A THR 175.A N VAL 170.A O no hydrogen 3.151 N/A PHE 178.A N ASP 177.A OD1 no hydrogen 2.698 N/A LEU 179.A N THR 175.A O no hydrogen 2.999 N/A ALA 180.A N PRO 176.A O no hydrogen 2.943 N/A TYR 181.A N ASP 177.A O no hydrogen 3.156 N/A VAL 182.A N PHE 178.A O no hydrogen 3.078 N/A ARG 183.A N LEU 179.A O no hydrogen 3.031 N/A ARG 183.A NE GLU 207.A OE2 no hydrogen 2.769 N/A ARG 183.A NH2 GLU 207.A OE1 no hydrogen 2.927 N/A ARG 183.A NH2 GLU 207.A OE2 no hydrogen 3.456 N/A GLY 184.A N ALA 180.A O no hydrogen 3.035 N/A SER 185.A N TYR 181.A O no hydrogen 2.878 N/A SER 187.A N SER 185.A OG no hydrogen 2.914 N/A SER 187.A OG GLY 213.A O no hydrogen 2.924 N/A PHE 188.A N SER 185.A O no hydrogen 3.271 N/A GLU 189.A N ILE 210.A O no hydrogen 2.893 N/A CYS 190.A SG VAL 182.A O no hydrogen 3.291 N/A CYS 190.A SG PHE 188.A O no hydrogen 4.001 N/A THR 191.A N LYS 208.A O no hydrogen 2.853 N/A HIS 192.A ND1 GLU 207.A OE1 no hydrogen 2.880 N/A TYR 193.A N LEU 206.A O no hydrogen 2.816 N/A SER 195.A N ASP 204.A O no hydrogen 3.026 N/A LEU 197.A N VAL 202.A O no hydrogen 3.016 N/A ASP 204.A N SER 195.A O no hydrogen 2.805 N/A LEU 206.A N TYR 193.A O no hydrogen 2.938 N/A GLU 207.A N ALA 167.A O no hydrogen 2.903 N/A LYS 208.A N THR 191.A O no hydrogen 2.827 N/A LYS 208.A NZ TYR 56.A OH no hydrogen 3.099 N/A LYS 208.A NZ TYR 193.A OH no hydrogen 3.502 N/A ALA 209.A N LEU 165.A O no hydrogen 2.769 N/A ILE 210.A N GLU 189.A O no hydrogen 2.928 N/A TYR 211.A N THR 163.A O no hydrogen 2.964 N/A TYR 211.A OH GLU 154.A OE2 no hydrogen 2.678 N/A GLN 212.A N SER 187.A O no hydrogen 2.636 N/A GLN 212.A NE2 ILE 210.A O no hydrogen 2.836 N/A