Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ru6_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 3.A N ASP 194.A O no hydrogen 2.914 N/A LYS 3.A NZ TYR 195.A OH no hydrogen 3.465 N/A CYS 5.A N ILE 196.A O no hydrogen 2.855 N/A VAL 6.A N TRP 29.A O no hydrogen 2.875 N/A ALA 7.A N VAL 198.A O no hydrogen 2.963 N/A LEU 8.A N LYS 31.A O no hydrogen 2.990 N/A ASP 9.A N ALA 7.A O no hydrogen 2.931 N/A SER 11.A OG GLU 15.A OE1 no hydrogen 2.997 N/A THR 12.A N GLU 15.A OE1 no hydrogen 3.227 N/A GLU 14.A N.A GLU 14.A OE1.A no hydrogen 2.784 N/A GLU 15.A N THR 12.A OG1 no hydrogen 3.224 N/A CYS 16.A N THR 12.A O no hydrogen 3.099 N/A CYS 16.A SG LEU 8.A O no hydrogen 3.479 N/A CYS 16.A SG LEU 10.A O no hydrogen 3.424 N/A CYS 16.A SG THR 12.A O no hydrogen 3.620 N/A LEU 17.A N LYS 13.A O no hydrogen 2.958 N/A GLN 18.A N GLU 14.A O.A no hydrogen 2.983 N/A GLN 18.A N GLU 14.A O.B no hydrogen 3.026 N/A LEU 19.A N GLU 15.A O no hydrogen 2.927 N/A ALA 20.A N CYS 16.A O no hydrogen 2.984 N/A LYS 21.A N LEU 17.A O no hydrogen 2.994 N/A GLU 22.A N.A GLN 18.A O no hydrogen 3.053 N/A GLU 22.A N.B GLN 18.A O no hydrogen 3.063 N/A LEU 23.A N LEU 19.A O no hydrogen 3.126 N/A LEU 23.A N ALA 20.A O no hydrogen 2.996 N/A LYS 24.A N LYS 21.A O no hydrogen 3.314 N/A ASN 25.A N ASP 52.A OD1 no hydrogen 2.705 N/A LEU 26.A N LEU 23.A O no hydrogen 3.244 N/A ILE 28.A N LEU 26.A O no hydrogen 2.929 N/A TRP 29.A N LEU 4.A O no hydrogen 2.876 N/A LEU 30.A N LYS 55.A O no hydrogen 2.976 N/A LYS 31.A N VAL 6.A O no hydrogen 2.847 N/A LYS 31.A NZ ASP 59.A OD2 no hydrogen 2.827 N/A VAL 32.A N PHE 57.A O no hydrogen 3.028 N/A TYR 37.A N GLY 33.A O no hydrogen 3.152 N/A LEU 38.A N LEU 34.A O no hydrogen 2.891 N/A ARG 39.A N ARG 35.A O no hydrogen 3.010 N/A ARG 39.A NE ASP 40.A OD2 no hydrogen 3.168 N/A ARG 39.A NH1 ASP 40.A OD2 no hydrogen 3.555 N/A ARG 39.A NH2 SER 11.A O no hydrogen 2.709 N/A ASP 40.A N ALA 36.A O no hydrogen 2.976 N/A GLY 41.A N TYR 37.A O no hydrogen 2.697 N/A PHE 44.A N GLY 41.A O no hydrogen 3.096 N/A GLU 46.A N PHE 42.A O no hydrogen 3.100 N/A GLU 47.A N LYS 43.A O.A no hydrogen 2.866 N/A GLU 47.A N LYS 43.A O.B no hydrogen 2.867 N/A LEU 48.A N PHE 44.A O no hydrogen 2.926 N/A LYS 49.A N ILE 45.A O no hydrogen 3.043 N/A LYS 50.A N GLU 46.A O no hydrogen 3.166 N/A LYS 50.A N GLU 47.A O no hydrogen 3.139 N/A LYS 50.A NZ GLU 47.A OE1 no hydrogen 3.275 N/A VAL 51.A N LEU 48.A O no hydrogen 2.998 N/A ASP 53.A N ASP 52.A OD2 no hydrogen 2.718 N/A ILE 56.A N ASP 82.A OD2 no hydrogen 2.719 N/A PHE 57.A N LEU 30.A O no hydrogen 2.876 N/A LEU 58.A N MET 83.A O no hydrogen 2.975 N/A ASP 59.A N VAL 32.A O no hydrogen 2.828 N/A LYS 61.A N.A ASN 85.A OD1 no hydrogen 3.006 N/A LYS 61.A NZ.A ASP 59.A OD1 no hydrogen 2.401 N/A LYS 61.A NZ.A ASP 59.A OD2 no hydrogen 2.843 N/A LYS 61.A NZ.B ASP 59.A OD1 no hydrogen 3.203 N/A LYS 61.A NZ.B ASP 59.A OD2 no hydrogen 3.544 N/A ILE 65.A N ASP 64.A OD1 no hydrogen 2.701 N/A ASN 67.A ND2.B GLU 97.A OE1 no hydrogen 2.413 N/A MET 69.A N ILE 65.A O no hydrogen 3.031 N/A ALA 70.A N PRO 66.A O no hydrogen 2.930 N/A ASP 71.A N ASN 67.A O.A no hydrogen 2.956 N/A ASP 71.A N ASN 67.A O.B no hydrogen 3.032 N/A ALA 72.A N THR 68.A O no hydrogen 2.888 N/A CYS 73.A N MET 69.A O no hydrogen 2.883 N/A CYS 73.A SG MET 69.A O no hydrogen 3.329 N/A GLU 74.A N ALA 70.A O no hydrogen 2.972 N/A GLU 75.A N.A ASP 71.A O no hydrogen 2.963 N/A GLU 75.A N.B ASP 71.A O no hydrogen 2.948 N/A VAL 76.A N ALA 72.A O no hydrogen 3.107 N/A SER 77.A N CYS 73.A O no hydrogen 2.903 N/A SER 77.A OG CYS 73.A O no hydrogen 2.705 N/A LYS 78.A N GLU 74.A O no hydrogen 3.116 N/A LYS 78.A NZ GLU 75.A OE1.A no hydrogen 3.486 N/A LEU 79.A N VAL 76.A O no hydrogen 3.062 N/A GLY 80.A N SER 77.A O no hydrogen 3.106 N/A ASP 82.A N ILE 56.A O no hydrogen 2.857 N/A MET 83.A N ILE 56.A O no hydrogen 3.169 N/A ILE 84.A N LEU 110.A O no hydrogen 2.915 N/A ASN 85.A ND2 ASP 59.A OD1 no hydrogen 3.107 N/A ILE 86.A N LEU 112.A O no hydrogen 3.029 N/A HIS 87.A N PHE 62.A O no hydrogen 2.981 N/A ALA 88.A N VAL 114.A O no hydrogen 3.010 N/A ALA 90.A N HIS 87.A O no hydrogen 3.047 N/A GLY 91.A N ALA 88.A O no hydrogen 3.013 N/A ILE 95.A N GLY 91.A O no hydrogen 3.129 N/A GLN 96.A N LYS 92.A O no hydrogen 2.892 N/A GLN 96.A NE2 ASN 147.A OD1 no hydrogen 2.970 N/A GLU 97.A N ILE 93.A O no hydrogen 2.874 N/A VAL 98.A N ALA 94.A O no hydrogen 2.946 N/A MET 99.A N ILE 95.A O no hydrogen 3.080 N/A THR 100.A N GLN 96.A O no hydrogen 2.945 N/A THR 100.A OG1 GLN 96.A O no hydrogen 2.972 N/A ARG 101.A N GLU 97.A O no hydrogen 3.023 N/A ARG 101.A NH1 ASP 71.A OD1 no hydrogen 2.763 N/A ARG 101.A NH1 GLU 74.A OE2 no hydrogen 2.806 N/A ARG 101.A NH2 ASP 71.A OD1 no hydrogen 3.485 N/A LEU 102.A N VAL 98.A O no hydrogen 2.927 N/A SER 103.A N MET 99.A O no hydrogen 3.040 N/A SER 103.A OG THR 100.A O no hydrogen 2.683 N/A LYS 104.A N ARG 101.A O no hydrogen 3.141 N/A LYS 104.A NZ THR 100.A O no hydrogen 2.924 N/A PHE 105.A N LEU 102.A O no hydrogen 3.134 N/A ARG 108.A NH1 PRO 109.A O no hydrogen 2.942 N/A ARG 108.A NH1 ASP 150.A OD2 no hydrogen 2.732 N/A ARG 108.A NH2 ASP 150.A OD1 no hydrogen 3.071 N/A ARG 108.A NH2 ASP 150.A OD2 no hydrogen 3.551 N/A LEU 110.A N ASP 82.A O no hydrogen 2.976 N/A VAL 111.A N ASP 150.A OD2 no hydrogen 2.777 N/A LEU 112.A N ILE 84.A O no hydrogen 3.057 N/A ALA 113.A N GLY 151.A O no hydrogen 2.969 N/A VAL 114.A N ILE 86.A O no hydrogen 2.798 N/A SER 115.A OG VAL 153.A O no hydrogen 3.125 N/A PHE 120.A N LEU 117.A O no hydrogen 3.099 N/A ASN 124.A N ASP 121.A OD2 no hydrogen 2.937 N/A PHE 125.A N ASP 121.A O no hydrogen 3.161 N/A PHE 126.A N GLU 122.A O no hydrogen 2.887 N/A SER 127.A N.A GLU 123.A O no hydrogen 3.106 N/A SER 127.A N.B GLU 123.A O no hydrogen 3.109 N/A SER 127.A OG.A GLU 123.A O no hydrogen 2.959 N/A ILE 128.A N PHE 125.A O no hydrogen 3.069 N/A TYR 129.A N PHE 125.A O no hydrogen 2.968 N/A ARG 130.A N PHE 126.A O no hydrogen 2.811 N/A ARG 130.A NE SER 127.A O.A no hydrogen 3.460 N/A ARG 130.A NE SER 127.A O.B no hydrogen 3.420 N/A GLN 131.A NE2 TYR 129.A O no hydrogen 3.106 N/A LYS 132.A N GLU 135.A OE1 no hydrogen 3.004 N/A ILE 133.A N GLU 122.A OE2 no hydrogen 3.103 N/A ALA 136.A N LYS 132.A O no hydrogen 2.974 N/A VAL 137.A N ILE 133.A O no hydrogen 2.840 N/A ILE 138.A N GLU 134.A O no hydrogen 3.105 N/A ASN 139.A N GLU 135.A O no hydrogen 2.899 N/A ASN 139.A ND2 GLN 131.A OE1 no hydrogen 3.277 N/A PHE 140.A N ALA 136.A O no hydrogen 2.760 N/A SER 141.A N VAL 137.A O no hydrogen 2.878 N/A SER 141.A OG VAL 137.A O no hydrogen 2.697 N/A LYS 142.A N.A ILE 138.A O no hydrogen 3.063 N/A LYS 142.A N.B ILE 138.A O no hydrogen 3.066 N/A ILE 143.A N ASN 139.A O no hydrogen 3.218 N/A SER 144.A N PHE 140.A O no hydrogen 2.919 N/A SER 144.A OG PHE 140.A O no hydrogen 2.913 N/A TYR 145.A N SER 141.A O no hydrogen 2.872 N/A GLU 146.A N LYS 142.A O.A no hydrogen 2.863 N/A GLU 146.A N LYS 142.A O.B no hydrogen 2.884 N/A ASN 147.A N ILE 143.A O no hydrogen 3.046 N/A ASN 147.A ND2 ILE 143.A O no hydrogen 3.001 N/A GLY 148.A N TYR 145.A O no hydrogen 3.409 N/A LEU 149.A N SER 144.A O no hydrogen 3.061 N/A ASP 150.A N VAL 111.A O no hydrogen 3.014 N/A MET 152.A N LEU 171.A O no hydrogen 2.822 N/A VAL 153.A N ALA 113.A O no hydrogen 2.813 N/A CYS 154.A N LEU 173.A O no hydrogen 2.872 N/A CYS 154.A SG SER 155.A O no hydrogen 3.555 N/A PHE 157.A N SER 155.A OG no hydrogen 3.243 N/A GLU 158.A N SER 155.A O no hydrogen 2.912 N/A SER 159.A OG THR 172.A OG1 no hydrogen 2.848 N/A SER 159.A OG ASN 191.A O no hydrogen 2.643 N/A LYS 161.A NZ GLU 134.A OE1 no hydrogen 3.526 N/A ILE 162.A N GLU 158.A O no hydrogen 2.890 N/A LYS 163.A N SER 159.A O no hydrogen 3.247 N/A LYS 163.A NZ SER 168.A O no hydrogen 3.073 N/A LYS 163.A NZ PHE 170.A O no hydrogen 2.677 N/A LYS 163.A NZ ASP 194.A OD2 no hydrogen 2.835 N/A GLU 164.A N LYS 160.A O no hydrogen 3.052 N/A HIS 165.A N.A LYS 161.A O no hydrogen 3.172 N/A HIS 165.A N.A ILE 162.A O no hydrogen 3.204 N/A HIS 165.A N.B LYS 161.A O no hydrogen 3.179 N/A HIS 165.A N.B ILE 162.A O no hydrogen 3.186 N/A THR 166.A N LYS 163.A O no hydrogen 3.088 N/A THR 166.A OG1 ILE 162.A O no hydrogen 2.797 N/A SER 167.A N THR 166.A OG1 no hydrogen 2.696 N/A PHE 170.A N SER 167.A O no hydrogen 2.998 N/A LEU 171.A N ASP 150.A O no hydrogen 2.962 N/A THR 172.A N ASP 194.A OD2 no hydrogen 2.942 N/A THR 172.A OG1 SER 159.A OG no hydrogen 2.848 N/A LEU 173.A N MET 152.A O no hydrogen 2.898 N/A THR 174.A N TYR 195.A O no hydrogen 2.898 N/A THR 174.A OG1 SER 193.A OG no hydrogen 2.945 N/A THR 174.A OG1 TYR 195.A O no hydrogen 3.440 N/A ILE 177.A N VAL 197.A O no hydrogen 3.142 N/A ARG 178.A N ALA 183.A O no hydrogen 2.854 N/A GLY 181.A N ARG 178.A O no hydrogen 3.117 N/A ASN 184.A ND2 GLY 181.A O no hydrogen 3.102 N/A LEU 185.A N PRO 179.A O no hydrogen 3.156 N/A MET 187.A N ASN 184.A OD1 no hydrogen 3.038 N/A ALA 188.A N ASN 184.A O no hydrogen 3.042 N/A ARG 189.A N LEU 185.A O no hydrogen 2.838 N/A ARG 189.A NH2 LYS 218.A O no hydrogen 3.464 N/A GLU 190.A N ALA 186.A O no hydrogen 2.969 N/A ASN 191.A N MET 187.A O no hydrogen 2.845 N/A ASN 191.A ND2 VAL 156.A O no hydrogen 2.839 N/A LEU 192.A N ARG 189.A O no hydrogen 3.215 N/A SER 193.A N ALA 188.A O no hydrogen 2.974 N/A SER 193.A OG THR 174.A OG1 no hydrogen 2.945 N/A SER 193.A OG ALA 188.A O no hydrogen 3.515 N/A ASP 194.A N THR 172.A O no hydrogen 3.009 N/A TYR 195.A N THR 172.A O no hydrogen 3.099 N/A ILE 196.A N LYS 3.A O no hydrogen 2.913 N/A VAL 197.A N THR 174.A O no hydrogen 3.101 N/A VAL 198.A N CYS 5.A O no hydrogen 2.948 N/A ILE 202.A N GLY 199.A O no hydrogen 2.916 N/A TYR 203.A N GLY 199.A O no hydrogen 3.071 N/A LYS 204.A N.A ARG 200.A O no hydrogen 2.912 N/A LYS 204.A N.B ARG 200.A O no hydrogen 2.913 N/A ASN 205.A N ILE 202.A O no hydrogen 3.110 N/A ASN 207.A N ASN 205.A OD1 no hydrogen 2.739 N/A ARG 209.A NE GLU 213.A OE2 no hydrogen 3.245 N/A ARG 209.A NH1 GLU 22.A O.A no hydrogen 2.908 N/A ARG 209.A NH1 GLU 22.A O.B no hydrogen 2.898 N/A ARG 209.A NH1 LYS 24.A O no hydrogen 2.798 N/A ARG 209.A NH2 LYS 24.A O no hydrogen 3.161 N/A ALA 210.A N ASN 207.A OD1 no hydrogen 3.137 N/A VAL 211.A N ASN 207.A O no hydrogen 3.214 N/A CYS 212.A N PRO 208.A O no hydrogen 3.101 N/A CYS 212.A SG PRO 208.A O no hydrogen 3.574 N/A GLU 213.A N ARG 209.A O no hydrogen 2.974 N/A LYS 214.A N ALA 210.A O no hydrogen 3.006 N/A ILE 215.A N VAL 211.A O no hydrogen 2.945 N/A LEU 216.A N CYS 212.A O no hydrogen 2.930 N/A ASN 217.A N GLU 213.A O no hydrogen 2.875 N/A LYS 218.A N LYS 214.A O no hydrogen 3.115 N/A ILE 219.A N ILE 215.A O no hydrogen 2.929 N/A HIS 220.A N LEU 216.A O no hydrogen 3.019 N/A HIS 220.A ND1 LEU 216.A O no hydrogen 2.812 N/A