Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3v0l_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG LEU 2.A O no hydrogen 3.556 N/A THR 14.A N LYS 11.A O no hydrogen 2.928 N/A CYS 16.A SG.B GLY 34.A O no hydrogen 3.268 N/A ARG 17.A NE ASP 19.A OD1 no hydrogen 2.868 N/A ARG 17.A NH1 ASP 19.A OD1 no hydrogen 3.390 N/A ARG 17.A NH1 ASP 19.A OD2 no hydrogen 2.832 N/A ARG 17.A NH1 VAL 268.A O no hydrogen 2.973 N/A ARG 17.A NH2 GLU 33.A O no hydrogen 2.934 N/A ASP 19.A N ASP 19.A OD1 no hydrogen 2.624 N/A THR 24.A N ALA 28.A O no hydrogen 2.805 N/A THR 24.A OG1 ALA 28.A O no hydrogen 3.465 N/A TRP 26.A N THR 24.A OG1 no hydrogen 3.176 N/A TRP 26.A NE1 PRO 248.A O no hydrogen 2.739 N/A LEU 27.A N THR 24.A O no hydrogen 2.894 N/A ALA 28.A N THR 24.A OG1 no hydrogen 3.012 N/A ILE 30.A N VAL 22.A O no hydrogen 2.817 N/A VAL 31.A N VAL 251.A O no hydrogen 2.878 N/A TRP 32.A NE1 LEU 21.A O no hydrogen 2.872 N/A GLU 33.A N GLU 255.A OE1 no hydrogen 2.729 N/A GLU 33.A N GLU 255.A OE2 no hydrogen 3.124 N/A THR 35.A N TRP 32.A O no hydrogen 3.130 N/A THR 35.A OG1 TRP 32.A O no hydrogen 2.720 N/A ILE 40.A N ASN 37.A OD1 no hydrogen 3.128 N/A LEU 41.A N ASN 37.A O no hydrogen 3.292 N/A ASN 42.A N ILE 38.A O no hydrogen 2.781 N/A GLU 43.A N ASP 39.A O no hydrogen 3.113 N/A GLN 44.A N ILE 40.A O no hydrogen 3.019 N/A PHE 45.A N LEU 41.A O no hydrogen 2.962 N/A ARG 46.A N ASN 42.A O no hydrogen 2.903 N/A LEU 47.A N GLU 43.A O no hydrogen 3.008 N/A GLN 48.A N PHE 45.A O no hydrogen 3.246 N/A ASN 49.A N ARG 46.A O no hydrogen 2.733 N/A THR 50.A N PHE 45.A O no hydrogen 3.207 N/A THR 50.A OG1 PHE 45.A O no hydrogen 2.785 N/A THR 51.A N ASP 138.A OD2 no hydrogen 2.816 N/A ILE 52.A N ARG 82.A O no hydrogen 2.862 N/A GLY 53.A N TYR 139.A O no hydrogen 2.770 N/A LEU 54.A N HIS 84.A O no hydrogen 2.914 N/A THR 55.A N VAL 141.A O no hydrogen 2.859 N/A VAL 56.A N TYR 86.A O no hydrogen 3.037 N/A ALA 58.A N PHE 88.A O no hydrogen 2.787 N/A LYS 60.A N ASP 90.A OD1 no hydrogen 2.898 N/A TYR 62.A N ILE 59.A O no hydrogen 3.272 N/A VAL 63.A N LYS 60.A O no hydrogen 3.304 N/A ALA 64.A N LYS 61.A O no hydrogen 3.122 N/A PHE 65.A N TYR 62.A O no hydrogen 3.043 N/A LEU 66.A N VAL 63.A O no hydrogen 3.012 N/A LYS 67.A NZ GLU 71.A OE1.A no hydrogen 2.240 N/A LYS 67.A NZ GLU 71.A OE2.B no hydrogen 3.005 N/A PHE 69.A N PHE 65.A O no hydrogen 3.110 N/A LEU 70.A N LEU 66.A O no hydrogen 2.817 N/A GLU 71.A N LYS 67.A O no hydrogen 2.966 N/A THR 72.A N LEU 68.A O no hydrogen 2.946 N/A THR 72.A OG1 LEU 68.A O no hydrogen 2.839 N/A THR 72.A OG1 PHE 69.A O no hydrogen 3.205 N/A ALA 73.A N PHE 69.A O no hydrogen 2.921 N/A GLU 74.A N LEU 70.A O no hydrogen 3.026 N/A LYS 75.A N THR 72.A O no hydrogen 3.080 N/A HIS 76.A N THR 72.A O no hydrogen 2.979 N/A HIS 76.A N ALA 73.A O no hydrogen 3.237 N/A PHE 77.A N ALA 73.A O no hydrogen 2.794 N/A MET 78.A N VAL 153.A O no hydrogen 2.814 N/A HIS 81.A N MET 78.A O no hydrogen 3.063 N/A HIS 81.A NE2 ASN 42.A OD1 no hydrogen 2.855 N/A VAL 83.A N GLY 103.A O no hydrogen 3.187 N/A HIS 84.A N ILE 52.A O no hydrogen 2.850 N/A HIS 84.A NE2 SER 107.A OG no hydrogen 2.674 N/A TYR 85.A N GLN 105.A O no hydrogen 2.756 N/A TYR 85.A OH GLU 74.A OE1 no hydrogen 2.425 N/A TYR 86.A N LEU 54.A O no hydrogen 2.699 N/A TYR 86.A OH GLU 136.A OE1 no hydrogen 2.564 N/A VAL 87.A N SER 107.A O no hydrogen 2.945 N/A PHE 88.A N VAL 56.A O no hydrogen 2.940 N/A THR 89.A N LEU 109.A O no hydrogen 3.082 N/A THR 89.A OG1 ALA 58.A O no hydrogen 2.787 N/A GLN 91.A N THR 89.A OG1 no hydrogen 2.886 N/A GLN 91.A NE2 LYS 60.A O no hydrogen 2.802 N/A GLN 91.A NE2 ASP 90.A OD1 no hydrogen 2.926 N/A ALA 94.A N GLN 91.A O no hydrogen 2.915 N/A VAL 95.A N PRO 92.A O no hydrogen 3.211 N/A GLY 101.A N GLU 74.A OE2 no hydrogen 2.825 N/A ARG 104.A N GLY 101.A O no hydrogen 3.282 N/A ARG 104.A NE GLU 74.A OE1 no hydrogen 2.767 N/A ARG 104.A NH1 PHE 77.A O no hydrogen 3.021 N/A ARG 104.A NH1 MET 78.A O no hydrogen 3.307 N/A ARG 104.A NH2 GLU 74.A OE1 no hydrogen 3.462 N/A ARG 104.A NH2 PHE 77.A O no hydrogen 2.862 N/A ARG 104.A NH2 TYR 85.A OH no hydrogen 2.832 N/A GLN 105.A N VAL 83.A O no hydrogen 2.935 N/A SER 107.A N TYR 85.A O no hydrogen 2.795 N/A SER 107.A OG HIS 84.A NE2 no hydrogen 2.674 N/A LEU 109.A N VAL 87.A O no hydrogen 2.851 N/A VAL 111.A N THR 89.A O no hydrogen 2.815 N/A GLN 115.A N GLN 115.A OE1 no hydrogen 2.521 N/A SER 118.A N TRP 114.A O no hydrogen 2.653 N/A SER 118.A OG ASP 235.A OD1 no hydrogen 3.031 N/A MET 119.A N GLN 115.A O no hydrogen 2.954 N/A ARG 120.A N ASP 116.A O no hydrogen 2.992 N/A ARG 121.A N VAL 117.A O no hydrogen 2.965 N/A ARG 121.A NH1 ASP 144.A OD1 no hydrogen 2.873 N/A ARG 121.A NH2 ASP 235.A OD2 no hydrogen 2.907 N/A MET 122.A N SER 118.A O no hydrogen 3.491 N/A GLU 123.A N MET 119.A O no hydrogen 2.834 N/A MET 124.A N ARG 120.A O no hydrogen 2.676 N/A ILE 125.A N ARG 121.A O no hydrogen 3.086 N/A SER 126.A N MET 122.A O no hydrogen 3.091 N/A SER 126.A OG MET 122.A O no hydrogen 2.883 N/A SER 126.A OG GLU 123.A O no hydrogen 3.434 N/A ASP 127.A N GLU 123.A O no hydrogen 2.946 N/A CYS 129.A N MET 124.A O no hydrogen 3.147 N/A CYS 129.A SG MET 124.A O no hydrogen 3.603 N/A GLU 130.A N ASP 127.A O no hydrogen 3.343 N/A ARG 132.A NE GLU 136.A OE1 no hydrogen 3.168 N/A PHE 133.A N CYS 129.A O no hydrogen 2.957 N/A LEU 134.A N GLU 130.A O no hydrogen 3.209 N/A SER 135.A N ARG 131.A O no hydrogen 3.251 N/A SER 135.A N ARG 132.A O no hydrogen 3.140 N/A SER 135.A OG ARG 131.A O no hydrogen 2.974 N/A GLU 136.A N PHE 133.A O no hydrogen 3.157 N/A VAL 137.A N PHE 133.A O no hydrogen 3.075 N/A ASP 138.A N THR 51.A O no hydrogen 2.945 N/A TYR 139.A N THR 51.A O no hydrogen 3.312 N/A LEU 140.A N GLY 205.A O no hydrogen 2.825 N/A VAL 141.A N GLY 53.A O no hydrogen 2.843 N/A CYS 142.A N PHE 203.A O no hydrogen 2.804 N/A CYS 142.A SG THR 55.A OG1 no hydrogen 3.355 N/A VAL 143.A N THR 55.A O no hydrogen 3.152 N/A ASP 144.A N ALA 201.A O no hydrogen 3.144 N/A GLU 148.A N THR 275.A O no hydrogen 2.773 N/A PHE 149.A N THR 72.A OG1 no hydrogen 2.880 N/A ARG 150.A N ARG 273.A O no hydrogen 2.688 N/A ARG 150.A NH1 GLN 260.A OE1 no hydrogen 2.646 N/A ARG 150.A NH2 GLN 260.A OE1 no hydrogen 2.667 N/A ASP 151.A N ARG 273.A O no hydrogen 3.322 N/A HIS 152.A N ASP 151.A OD2 no hydrogen 2.593 N/A HIS 152.A NE2 GLU 156.A OE2 no hydrogen 2.713 N/A VAL 153.A N HIS 76.A O no hydrogen 2.917 N/A GLY 154.A N GLU 156.A OE1 no hydrogen 2.896 N/A GLU 156.A N GLU 156.A OE2 no hydrogen 2.846 N/A ILE 157.A N GLY 154.A O no hydrogen 3.066 N/A LEU 158.A N VAL 155.A O no hydrogen 3.011 N/A THR 159.A OG1 THR 249.A OG1 no hydrogen 2.596 N/A LEU 161.A N THR 249.A OG1 no hydrogen 3.003 N/A PHE 162.A N GLY 204.A O no hydrogen 2.742 N/A THR 164.A OG1 PHE 202.A O no hydrogen 2.818 N/A LEU 165.A N LEU 252.A O no hydrogen 2.893 N/A HIS 166.A N TYR 197.A O no hydrogen 2.885 N/A GLY 168.A N HIS 166.A ND1 no hydrogen 2.908 N/A PHE 169.A N HIS 166.A O no hydrogen 3.239 N/A SER 172.A N PHE 169.A O no hydrogen 2.971 N/A ARG 174.A NE GLY 194.A O no hydrogen 2.815 N/A ARG 174.A NH2 GLY 194.A O no hydrogen 2.883 N/A ALA 176.A N SER 173.A O no hydrogen 2.955 N/A PHE 177.A N ARG 174.A O no hydrogen 3.106 N/A THR 178.A OG1 TYR 197.A OH no hydrogen 3.364 N/A TYR 179.A OH PHE 196.A O no hydrogen 2.687 N/A ARG 181.A NH1 ILE 189.A O no hydrogen 2.740 N/A ARG 181.A NH1 PRO 190.A O no hydrogen 3.142 N/A ARG 181.A NH2 ARG 174.A O no hydrogen 2.929 N/A ARG 181.A NH2 PHE 177.A O no hydrogen 3.120 N/A ARG 182.A N GLU 180.A OE1 no hydrogen 2.770 N/A ARG 182.A NE GLU 180.A OE1 no hydrogen 2.698 N/A ARG 182.A NH2 GLU 180.A OE2 no hydrogen 2.962 N/A ARG 182.A NH2 GLU 230.A O no hydrogen 2.686 N/A SER 185.A N ARG 182.A O no hydrogen 3.012 N/A SER 185.A OG ASP 224.A OD1 no hydrogen 2.688 N/A GLN 186.A N ASP 224.A OD2 no hydrogen 2.768 N/A ALA 187.A N SER 185.A OG no hydrogen 2.955 N/A TYR 188.A N SER 185.A O no hydrogen 3.054 N/A ILE 189.A N GLU 180.A O no hydrogen 2.880 N/A LYS 191.A NZ GLU 175.A O no hydrogen 2.933 N/A GLU 193.A N PRO 190.A O no hydrogen 3.127 N/A TYR 197.A OH GLU 236.A OE1 no hydrogen 2.624 N/A TYR 198.A N ASN 240.A OD1 no hydrogen 2.832 N/A GLY 199.A N THR 164.A O no hydrogen 2.835 N/A GLY 200.A N GLU 236.A OE2 no hydrogen 2.722 N/A PHE 203.A N CYS 142.A O no hydrogen 3.203 N/A GLY 204.A N PHE 162.A O no hydrogen 3.175 N/A GLY 205.A N LEU 140.A O no hydrogen 2.943 N/A SER 206.A N PRO 160.A O no hydrogen 2.805 N/A VAL 207.A N ASP 138.A O no hydrogen 3.178 N/A GLU 209.A N SER 206.A OG no hydrogen 3.195 N/A VAL 210.A N SER 206.A O no hydrogen 2.892 N/A GLN 211.A N VAL 207.A O no hydrogen 2.875 N/A GLN 211.A NE2 GLU 130.A O no hydrogen 2.938 N/A ARG 212.A N GLN 208.A O no hydrogen 3.006 N/A LEU 213.A N GLU 209.A O no hydrogen 2.927 N/A THR 214.A N VAL 210.A O no hydrogen 2.859 N/A THR 214.A OG1 VAL 210.A O no hydrogen 3.059 N/A THR 214.A OG1 GLN 211.A O no hydrogen 3.385 N/A ARG 215.A N GLN 211.A O no hydrogen 2.918 N/A ALA 216.A N ARG 212.A O no hydrogen 2.908 N/A CYS 217.A N LEU 213.A O no hydrogen 2.861 N/A CYS 217.A SG LEU 213.A O no hydrogen 3.396 N/A HIS 218.A N THR 214.A O no hydrogen 2.827 N/A GLN 219.A N ARG 215.A O no hydrogen 2.903 N/A ALA 220.A N ALA 216.A O no hydrogen 2.937 N/A MET 221.A N CYS 217.A O no hydrogen 2.884 N/A MET 222.A N HIS 218.A O no hydrogen 2.946 N/A VAL 223.A N GLN 219.A O no hydrogen 3.026 N/A ASP 224.A N ALA 220.A O no hydrogen 3.030 N/A GLN 225.A N MET 221.A O no hydrogen 2.930 N/A ALA 226.A N MET 222.A O no hydrogen 2.908 N/A ASN 227.A N VAL 223.A O no hydrogen 2.967 N/A ASN 227.A N ASP 224.A O no hydrogen 2.968 N/A GLY 228.A N GLN 225.A O no hydrogen 3.039 N/A ILE 229.A N ASP 224.A O no hydrogen 2.859 N/A VAL 232.A N GLU 180.A OE2 no hydrogen 2.793 N/A TRP 233.A N SER 237.A OG no hydrogen 2.872 N/A HIS 234.A N ALA 231.A O no hydrogen 2.988 N/A HIS 234.A ND1 GLU 230.A OE2 no hydrogen 2.608 N/A ASP 235.A N SER 118.A OG no hydrogen 3.079 N/A GLU 236.A N TRP 233.A O no hydrogen 2.977 N/A SER 237.A N HIS 234.A O no hydrogen 3.064 N/A HIS 238.A N HIS 234.A O no hydrogen 3.361 N/A LEU 239.A N ASP 235.A O no hydrogen 2.824 N/A ASN 240.A N GLU 236.A O no hydrogen 2.992 N/A ASN 240.A ND2 TYR 198.A O no hydrogen 2.865 N/A ASN 240.A ND2 GLU 236.A O no hydrogen 2.912 N/A LYS 241.A N SER 237.A O no hydrogen 3.101 N/A LYS 241.A NZ GLN 186.A O no hydrogen 3.002 N/A LYS 241.A NZ TYR 188.A O no hydrogen 2.796 N/A TYR 242.A N HIS 238.A O no hydrogen 2.918 N/A LEU 243.A N LEU 239.A O no hydrogen 2.948 N/A LEU 244.A N ASN 240.A O no hydrogen 3.016 N/A ARG 245.A N LYS 241.A O no hydrogen 3.277 N/A HIS 246.A N TYR 242.A O no hydrogen 2.799 N/A HIS 246.A ND1 TYR 242.A O no hydrogen 2.854 N/A LYS 247.A NZ ASP 195.A OD2 no hydrogen 2.669 N/A LYS 247.A NZ LEU 244.A O no hydrogen 2.717 N/A THR 249.A N LEU 161.A O no hydrogen 2.716 N/A THR 249.A OG1 THR 159.A OG1 no hydrogen 2.596 N/A THR 249.A OG1 LEU 161.A O no hydrogen 3.097 N/A LYS 250.A N LEU 161.A O no hydrogen 3.361 N/A LYS 250.A NZ GLU 156.A O no hydrogen 2.779 N/A LYS 250.A NZ LEU 158.A O no hydrogen 2.756 N/A VAL 251.A N PRO 29.A O no hydrogen 2.903 N/A LEU 252.A N GLY 163.A O no hydrogen 2.824 N/A SER 253.A N VAL 31.A O no hydrogen 3.096 N/A SER 253.A OG VAL 31.A O no hydrogen 2.830 N/A GLU 255.A N SER 253.A OG no hydrogen 3.289 N/A TYR 256.A N SER 253.A O no hydrogen 3.030 N/A TYR 256.A OH GLU 156.A OE1 no hydrogen 2.646 N/A LEU 257.A N PRO 254.A O no hydrogen 3.040 N/A TRP 258.A N PHE 274.A O no hydrogen 2.921 N/A TRP 258.A NE1 GLY 264.A O no hydrogen 2.734 N/A LEU 262.A N ASP 259.A OD1 no hydrogen 3.171 N/A LEU 263.A N ASP 259.A O no hydrogen 2.967 N/A GLY 264.A N GLN 260.A O no hydrogen 2.787 N/A TRP 265.A NE1 LEU 269.A O no hydrogen 2.748 N/A LEU 269.A N PRO 266.A O no hydrogen 3.020 N/A LYS 271.A NZ ASP 151.A OD2 no hydrogen 3.456 N/A ARG 273.A N GLU 255.A O no hydrogen 2.777 N/A ARG 273.A NE GLU 255.A OE2 no hydrogen 2.803 N/A ARG 273.A NH1 HIS 152.A O no hydrogen 2.914 N/A ARG 273.A NH2 GLU 33.A OE1 no hydrogen 2.890 N/A ARG 273.A NH2 GLU 255.A OE2 no hydrogen 2.922 N/A PHE 274.A N GLU 255.A O no hydrogen 3.422 N/A THR 275.A N GLU 148.A O no hydrogen 2.916 N/A THR 275.A OG1.B GLU 148.A O no hydrogen 3.435 N/A ALA 276.A N TRP 258.A O no hydrogen 2.945 N/A VAL 277.A N ASP 146.A O no hydrogen 3.083 N/A