Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5pav_C.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 1.A N GLN 134.A O no hydrogen 2.839 N/A ILE 1.A N ASP 186.A OD2 no hydrogen 2.716 N/A VAL 2.A N ASP 181.A O no hydrogen 2.798 N/A LYS 5.A N VAL 147.A O no hydrogen 3.020 N/A CYS 7.A N LEU 145.A O no hydrogen 2.797 N/A CYS 7.A SG PRO 8.A O no hydrogen 3.822 N/A LYS 9.A NZ ASP 65.A OD1 no hydrogen 3.561 N/A LYS 9.A NZ ASP 65.A OD2 no hydrogen 2.798 N/A LYS 9.A NZ ASP 67.A OD2 no hydrogen 2.732 N/A GLU 11.A N PRO 8.A O no hydrogen 2.812 N/A GLN 15.A N CYS 12.A O no hydrogen 3.100 N/A GLN 15.A NE2 VAL 16.A O no hydrogen 3.028 N/A VAL 16.A N GLY 28.A O no hydrogen 2.857 N/A LEU 17.A N VAL 55.A O no hydrogen 2.963 N/A LEU 18.A N CYS 26.A O no hydrogen 2.812 N/A LEU 19.A N ILE 53.A O no hydrogen 2.843 N/A VAL 20.A N ALA 23.A O no hydrogen 2.899 N/A ASN 21.A N ASN 51.A O.A no hydrogen 2.999 N/A ASN 21.A N ASN 51.A O.B no hydrogen 3.251 N/A ALA 23.A N VAL 20.A O no hydrogen 2.975 N/A GLN 24.A NE2 TRP 132.A O no hydrogen 2.874 N/A LEU 25.A N LEU 18.A O no hydrogen 2.817 N/A CYS 26.A N LEU 18.A O no hydrogen 3.458 N/A CYS 26.A SG LEU 25.A O no hydrogen 2.988 N/A GLY 27.A N SER 187.A O no hydrogen 2.788 N/A GLY 28.A N VAL 16.A O no hydrogen 3.008 N/A THR 29.A N VAL 37.A O no hydrogen 2.834 N/A LEU 30.A N TRP 14.A O no hydrogen 2.893 N/A ILE 31.A N TRP 35.A O no hydrogen 2.946 N/A THR 33.A N ASN 32.A OD1.B no hydrogen 2.771 N/A ILE 34.A N ASN 32.A OD1.A no hydrogen 3.207 N/A TRP 35.A N ASN 32.A O no hydrogen 3.423 N/A TRP 35.A N ASN 32.A OD1.A no hydrogen 3.047 N/A VAL 36.A N LEU 94.A O no hydrogen 2.930 N/A VAL 37.A N THR 29.A O no hydrogen 2.813 N/A SER 38.A N ALA 92.A O no hydrogen 2.850 N/A SER 38.A OG GLY 27.A O no hydrogen 2.782 N/A ALA 39.A N SER 38.A OG no hydrogen 2.787 N/A HIS 41.A N ASP 90.A OD1 no hydrogen 2.824 N/A HIS 41.A ND1 ASP 90.A OD2 no hydrogen 2.688 N/A CYS 42.A N ALA 39.A O no hydrogen 3.200 N/A CYS 42.A SG SER 187.A O no hydrogen 3.819 N/A PHE 43.A N ALA 40.A O no hydrogen 3.014 N/A ASP 44.A N HIS 41.A O no hydrogen 3.196 N/A ILE 46.A N PHE 43.A O no hydrogen 3.500 N/A ARG 50.A N ASN 48.A OD1 no hydrogen 3.339 N/A ARG 50.A NH1.B LYS 47.A O no hydrogen 3.175 N/A ARG 50.A NH1.B ASN 48.A OD1 no hydrogen 3.182 N/A ASN 51.A N.A ASN 48.A O no hydrogen 3.108 N/A ASN 51.A N.B ASN 48.A O no hydrogen 3.184 N/A LEU 52.A N TRP 49.A O no hydrogen 3.330 N/A ILE 53.A N LEU 19.A O no hydrogen 2.914 N/A ALA 54.A N ARG 71.A O no hydrogen 2.916 N/A VAL 55.A N LEU 17.A O no hydrogen 2.810 N/A LEU 56.A N GLN 69.A O no hydrogen 2.804 N/A HIS 59.A N GLU 58.A OE1 no hydrogen 2.825 N/A HIS 59.A NE2 GLU 144.A OE2 no hydrogen 3.011 N/A LEU 61.A N LEU 143.A O no hydrogen 2.775 N/A SER 62.A N ASP 60.A OD1 no hydrogen 2.809 N/A SER 62.A OG ASP 60.A OD1 no hydrogen 2.626 N/A SER 62.A OG ASP 60.A OD2 no hydrogen 3.441 N/A GLU 63.A N ASP 60.A O no hydrogen 3.295 N/A ASP 65.A N GLU 68.A OE2 no hydrogen 2.906 N/A GLY 66.A N GLU 68.A OE1 no hydrogen 2.845 N/A ASP 67.A N ASP 65.A OD1 no hydrogen 3.078 N/A GLU 68.A N GLU 68.A OE1 no hydrogen 2.837 N/A GLN 69.A N LEU 56.A O no hydrogen 2.799 N/A GLN 69.A NE2 VAL 101.A O no hydrogen 2.874 N/A ARG 71.A N ALA 54.A O no hydrogen 2.834 N/A ARG 71.A NE PRO 99.A O no hydrogen 2.947 N/A ARG 71.A NH1 SER 70.A O no hydrogen 2.931 N/A ARG 71.A NH2 PRO 99.A O no hydrogen 3.056 N/A ALA 74.A N ARG 95.A O no hydrogen 2.781 N/A GLN 75.A N ARG 95.A O no hydrogen 3.317 N/A GLN 75.A NE2 ARG 239.A O no hydrogen 3.019 N/A GLN 75.A NE2 VAL 242.A O no hydrogen 3.108 N/A VAL 76.A N VAL 242.A O no hydrogen 2.905 N/A ILE 77.A N LEU 93.A O no hydrogen 2.785 N/A ILE 78.A N LEU 244.A O no hydrogen 2.927 N/A SER 80.A N ALA 246.A O no hydrogen 2.827 N/A TYR 82.A N PRO 79.A O no hydrogen 3.091 N/A TYR 82.A OH ASP 44.A OD1 no hydrogen 2.696 N/A TYR 82.A OH ASP 44.A OD2 no hydrogen 3.064 N/A GLY 85.A N ASP 44.A OD2 no hydrogen 3.036 N/A THR 86.A N VAL 83.A O no hydrogen 3.083 N/A THR 86.A OG1 VAL 83.A O no hydrogen 2.694 N/A ILE 91.A N HIS 89.A O no hydrogen 2.968 N/A ALA 92.A N SER 38.A O no hydrogen 2.897 N/A LEU 93.A N ILE 77.A O no hydrogen 2.880 N/A LEU 94.A N VAL 36.A O no hydrogen 2.731 N/A ARG 95.A N GLN 75.A O no hydrogen 2.913 N/A ARG 95.A NH2.A SER 236.A O no hydrogen 3.000 N/A LEU 96.A N ILE 34.A O no hydrogen 2.764 N/A HIS 97.A N ARG 72.A O no hydrogen 2.825 N/A VAL 100.A N THR 33.A O no hydrogen 2.906 N/A VAL 101.A N GLN 69.A OE1 no hydrogen 2.821 N/A THR 103.A N VAL 106.A O no hydrogen 2.984 N/A HIS 105.A N THR 103.A OG1 no hydrogen 2.979 N/A VAL 106.A N THR 103.A O no hydrogen 3.111 N/A VAL 107.A N PRO 13.A O no hydrogen 3.138 N/A LEU 109.A N LEU 30.A O no hydrogen 2.802 N/A CYS 110.A N TRP 199.A O no hydrogen 3.383 N/A CYS 110.A SG TRP 199.A O no hydrogen 3.685 N/A ARG 114.A NE.A GLU 228.A OE1.B no hydrogen 2.815 N/A ARG 114.A NE.B GLU 228.A OE2.A no hydrogen 2.835 N/A ARG 114.A NH1.A GLU 118.A OE2 no hydrogen 2.834 N/A ARG 114.A NH1.A GLN 225.A OE1 no hydrogen 3.252 N/A ARG 114.A NH2.A GLU 228.A OE1.B no hydrogen 2.845 N/A ARG 114.A NH2.A GLU 228.A OE2.B no hydrogen 1.967 N/A SER 117.A N GLU 113.A O no hydrogen 2.955 N/A GLU 118.A N ARG 114.A O.A no hydrogen 2.827 N/A GLU 118.A N ARG 114.A O.B no hydrogen 2.967 N/A ARG 119.A N THR 115.A O no hydrogen 2.774 N/A THR 120.A N PHE 116.A O no hydrogen 2.904 N/A LEU 121.A N PHE 116.A O no hydrogen 3.107 N/A ALA 122.A N SER 117.A O no hydrogen 2.837 N/A PHE 123.A N THR 120.A O no hydrogen 3.115 N/A VAL 124.A N LEU 121.A O no hydrogen 3.068 N/A SER 127.A N VAL 150.A O no hydrogen 2.968 N/A SER 127.A OG THR 193.A OG1 no hydrogen 2.589 N/A LEU 128.A N ALA 192.A O no hydrogen 2.895 N/A VAL 129.A N LEU 148.A O no hydrogen 2.909 N/A SER 130.A OG GLN 15.A OE1 no hydrogen 2.637 N/A GLY 131.A N MET 146.A O no hydrogen 2.928 N/A TRP 132.A NE1 HIS 59.A O no hydrogen 2.990 N/A GLY 133.A N ASP 186.A OD1 no hydrogen 2.748 N/A GLN 134.A N LYS 184.A O no hydrogen 2.848 N/A LEU 135.A N ALA 140.A O no hydrogen 3.101 N/A GLY 139.A N LEU 136.A O no hydrogen 2.965 N/A ALA 142.A N TRP 132.A O no hydrogen 3.306 N/A ALA 142.A N GLY 133.A O no hydrogen 3.132 N/A LEU 145.A N HIS 59.A O no hydrogen 3.041 N/A MET 146.A N GLY 131.A O no hydrogen 3.066 N/A VAL 147.A N LYS 5.A O no hydrogen 2.813 N/A LEU 148.A N VAL 129.A O no hydrogen 2.805 N/A ASN 149.A ND2 SER 127.A O no hydrogen 3.116 N/A VAL 150.A N SER 127.A O no hydrogen 2.863 N/A ARG 152.A N ARG 125.A O no hydrogen 2.845 N/A LEU 153.A N CYS 172.A O no hydrogen 2.990 N/A CYS 158.A N MET 154.A O no hydrogen 2.987 N/A LEU 159.A N THR 155.A O no hydrogen 3.009 N/A GLN 160.A N GLN 156.A O no hydrogen 3.049 N/A GLN 161.A N ASP 157.A O no hydrogen 2.755 N/A SER 162.A OG CYS 158.A O no hydrogen 2.787 N/A ARG 163.A N GLY 215.A O no hydrogen 2.917 N/A THR 167.A OG1 ASN 88.A OD1 no hydrogen 2.660 N/A TYR 169.A N THR 167.A OG1 no hydrogen 3.042 N/A MET 170.A N THR 167.A O no hydrogen 3.121 N/A PHE 171.A N TYR 220.A O no hydrogen 2.890 N/A ALA 173.A N GLY 218.A O no hydrogen 2.980 N/A GLY 174.A N PRO 151.A O no hydrogen 2.891 N/A SER 179.A N ASP 177.A OD1 no hydrogen 3.066 N/A SER 179.A OG ASP 177.A OD1 no hydrogen 2.672 N/A SER 179.A OG ASP 177.A OD2 no hydrogen 3.378 N/A LYS 180.A NZ SER 179.A OG no hydrogen 2.866 N/A ASP 181.A N VAL 2.A O no hydrogen 3.088 N/A SER 182.A N ASP 181.A OD1 no hydrogen 2.837 N/A SER 182.A OG TYR 220.A OH no hydrogen 2.921 N/A CYS 183.A N ASP 186.A OD2 no hydrogen 2.806 N/A CYS 183.A SG GLN 134.A OE1 no hydrogen 3.671 N/A ASP 186.A N CYS 183.A O no hydrogen 2.875 N/A SER 187.A OG HIS 41.A NE2 no hydrogen 3.156 N/A SER 187.A OG SER 206.A O.B no hydrogen 3.054 N/A GLY 188.A N VAL 205.A O no hydrogen 2.851 N/A GLY 189.A N ASP 186.A O no hydrogen 3.040 N/A HIS 191.A N GLY 203.A O no hydrogen 2.937 N/A HIS 191.A ND1 THR 202.A OG1 no hydrogen 2.745 N/A ALA 192.A N LEU 128.A O no hydrogen 2.838 N/A THR 193.A N TYR 200.A O no hydrogen 2.849 N/A THR 193.A OG1 SER 127.A OG no hydrogen 2.589 N/A THR 193.A OG1 THR 202.A OG1 no hydrogen 2.588 N/A TYR 195.A N THR 198.A O no hydrogen 2.848 N/A ARG 196.A NE.A TYR 195.A OH no hydrogen 2.819 N/A ARG 196.A NH2.A TYR 195.A OH no hydrogen 2.826 N/A GLY 197.A N HIS 194.A NE2 no hydrogen 3.202 N/A THR 198.A N TYR 195.A O no hydrogen 3.217 N/A TYR 200.A N THR 193.A O no hydrogen 2.883 N/A LEU 201.A N CYS 110.A O no hydrogen 2.919 N/A THR 202.A N HIS 191.A O no hydrogen 3.019 N/A THR 202.A OG1 HIS 191.A ND1 no hydrogen 2.745 N/A THR 202.A OG1 HIS 191.A O no hydrogen 3.101 N/A THR 202.A OG1 THR 193.A OG1 no hydrogen 2.588 N/A GLY 203.A N HIS 191.A O no hydrogen 3.109 N/A ILE 204.A N THR 221.A O no hydrogen 3.283 N/A VAL 205.A N GLY 189.A O no hydrogen 2.986 N/A SER 206.A N.A VAL 219.A O no hydrogen 3.237 N/A SER 206.A N.B VAL 219.A O no hydrogen 3.238 N/A SER 206.A OG.A ASP 90.A OD2 no hydrogen 2.639 N/A SER 206.A OG.B ASP 90.A OD2 no hydrogen 2.686 N/A TRP 207.A N.A VAL 219.A O no hydrogen 3.138 N/A TRP 207.A N.B SER 206.A OG.A no hydrogen 2.762 N/A ALA 212.A N ASP 181.A OD2 no hydrogen 2.899 N/A THR 213.A OG1 GLN 209.A O.A no hydrogen 2.351 N/A THR 213.A OG1 GLN 209.A O.B no hydrogen 3.181 N/A GLY 215.A N SER 176.A O no hydrogen 2.649 N/A HIS 216.A N THR 213.A O no hydrogen 3.076 N/A GLY 218.A N ALA 173.A O no hydrogen 3.051 N/A VAL 219.A N TRP 207.A O.A no hydrogen 2.819 N/A TYR 220.A N PHE 171.A O no hydrogen 2.818 N/A TYR 220.A OH SER 182.A OG no hydrogen 2.921 N/A THR 221.A N ILE 204.A O no hydrogen 2.936 N/A THR 221.A OG1 ASP 90.A O no hydrogen 2.716 N/A ARG 222.A N TYR 169.A O no hydrogen 2.877 N/A ARG 222.A NE MET 170.A O no hydrogen 2.997 N/A ARG 222.A NH2 MET 170.A O no hydrogen 2.927 N/A VAL 223.A N THR 202.A O no hydrogen 3.257 N/A GLN 225.A N ARG 222.A O no hydrogen 3.081 N/A GLN 225.A NE2 GLU 168.A O no hydrogen 2.872 N/A TYR 226.A N VAL 223.A O no hydrogen 2.842 N/A TYR 226.A OH HIS 89.A ND1 no hydrogen 2.700 N/A LEU 230.A N TYR 226.A O no hydrogen 2.828 N/A GLN 231.A N ILE 227.A O no hydrogen 2.855 N/A LYS 232.A N GLU 228.A O.A no hydrogen 2.982 N/A LYS 232.A N GLU 228.A O.B no hydrogen 3.049 N/A LEU 233.A N TRP 229.A O no hydrogen 3.154 N/A MET 234.A N LEU 230.A O no hydrogen 2.933 N/A ARG 235.A N LYS 232.A O no hydrogen 3.104 N/A SER 236.A N LEU 233.A O no hydrogen 2.994 N/A SER 236.A OG LEU 233.A O no hydrogen 2.692 N/A ARG 239.A N GLN 75.A OE1 no hydrogen 2.984 N/A LEU 244.A N VAL 76.A O no hydrogen 2.865 N/A ARG 245.A NH2 SER 80.A O no hydrogen 3.035 N/A ALA 246.A N ILE 78.A O no hydrogen 2.959 N/A PHE 248.A N SER 80.A OG no hydrogen 3.090 N/A