Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5itx_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 2.A N GLU 5.A OE1 no hydrogen 2.810 N/A GLY 3.A N GLY 172.A O no hydrogen 2.976 N/A GLU 5.A N GLU 2.A O no hydrogen 2.769 N/A LEU 6.A N GLU 2.A O no hydrogen 3.038 N/A HIS 7.A N GLY 3.A O no hydrogen 2.996 N/A LEU 8.A N PRO 4.A O no hydrogen 2.807 N/A ALA 9.A N GLU 5.A O no hydrogen 2.755 N/A SER 10.A N LEU 6.A O no hydrogen 2.985 N/A SER 10.A OG HIS 7.A O no hydrogen 3.244 N/A GLN 11.A N HIS 7.A O no hydrogen 3.209 N/A PHE 12.A N LEU 8.A O no hydrogen 2.781 N/A VAL 13.A N ALA 9.A O no hydrogen 2.931 N/A ASN 14.A N SER 10.A O no hydrogen 3.063 N/A ASN 14.A ND2 ALA 48.A O no hydrogen 2.922 N/A GLU 15.A N GLN 11.A O no hydrogen 3.115 N/A ALA 16.A N PHE 12.A O no hydrogen 2.920 N/A CYS 17.A N VAL 13.A O no hydrogen 3.076 N/A CYS 17.A SG VAL 13.A O no hydrogen 3.213 N/A ARG 18.A N GLU 15.A O no hydrogen 3.337 N/A LEU 20.A N CYS 17.A O no hydrogen 3.065 N/A PHE 22.A N TYR 44.A O no hydrogen 2.600 N/A GLY 23.A N TYR 101.A O no hydrogen 3.150 N/A GLY 24.A N SER 41.A O no hydrogen 2.993 N/A CYS 25.A SG PHE 39.A O no hydrogen 3.830 N/A GLU 27.A N ARG 99.A O no hydrogen 3.059 N/A LYS 28.A NZ SER 29.A O no hydrogen 2.737 N/A LYS 28.A NZ SER 32.A O no hydrogen 2.835 N/A SER 29.A N HIS 97.A O no hydrogen 3.002 N/A SER 29.A OG HIS 97.A ND1 no hydrogen 2.890 N/A SER 32.A N SER 29.A OG no hydrogen 3.263 N/A ASN 34.A N SER 32.A OG no hydrogen 3.232 N/A ASN 34.A ND2 GLY 120.A O no hydrogen 3.503 N/A GLU 40.A N GLN 69.A OE1 no hydrogen 3.230 N/A SER 41.A N GLY 24.A O no hydrogen 3.179 N/A SER 41.A OG ALA 43.A O no hydrogen 3.139 N/A SER 42.A N GLN 66.A O no hydrogen 2.927 N/A TYR 44.A N PHE 22.A O no hydrogen 2.719 N/A ARG 45.A N SER 60.A O no hydrogen 3.190 N/A SER 47.A N ILE 58.A O no hydrogen 3.088 N/A SER 47.A OG ILE 58.A O no hydrogen 3.547 N/A ALA 48.A N ASN 14.A OD1 no hydrogen 2.619 N/A SER 49.A N ARG 56.A O no hydrogen 3.035 N/A ARG 51.A N GLU 54.A O no hydrogen 2.930 N/A ARG 51.A NE GLU 139.A OE1 no hydrogen 2.969 N/A ARG 51.A NH2 ARG 132.A O no hydrogen 3.494 N/A LYS 53.A N ASN 171.A OD1 no hydrogen 2.984 N/A LYS 53.A NZ ILE 173.A O no hydrogen 2.884 N/A GLU 54.A N ARG 51.A O no hydrogen 3.001 N/A LEU 55.A N PHE 76.A O no hydrogen 2.959 N/A ARG 56.A N SER 49.A O no hydrogen 2.663 N/A ARG 56.A NH1 GLY 126.A O no hydrogen 2.486 N/A LEU 57.A N LEU 74.A O no hydrogen 2.816 N/A ILE 58.A N SER 47.A O no hydrogen 2.832 N/A LEU 59.A N LEU 72.A O no hydrogen 2.721 N/A SER 60.A N ARG 45.A O no hydrogen 2.807 N/A LEU 62.A N ALA 43.A O no hydrogen 2.810 N/A ALA 65.A N LEU 62.A O no hydrogen 3.099 N/A GLN 66.A N SER 42.A OG no hydrogen 2.978 N/A GLN 69.A NE2 GLU 70.A O no hydrogen 3.353 N/A LEU 72.A N LEU 59.A O no hydrogen 2.899 N/A LEU 74.A N LEU 57.A O no hydrogen 2.881 N/A VAL 75.A N ASP 123.A O no hydrogen 3.416 N/A PHE 76.A N LEU 55.A O no hydrogen 2.866 N/A ARG 77.A N ARG 121.A O no hydrogen 2.885 N/A ARG 77.A NE GLU 54.A OE2 no hydrogen 3.382 N/A ARG 77.A NH2 ASP 123.A OD2 no hydrogen 2.532 N/A SER 81.A OG ASP 115.A OD1 no hydrogen 2.652 N/A GLY 82.A N PHE 78.A O no hydrogen 2.973 N/A SER 83.A OG VAL 114.A O no hydrogen 3.247 N/A PHE 84.A N TYR 225.A OH no hydrogen 2.995 N/A GLN 85.A N CYS 112.A O no hydrogen 2.897 N/A VAL 87.A N ALA 110.A O no hydrogen 3.019 N/A ARG 89.A N ARG 108.A O no hydrogen 3.035 N/A GLU 91.A N PRO 88.A O no hydrogen 2.859 N/A HIS 97.A N PHE 113.A O no hydrogen 2.815 N/A HIS 97.A ND1 SER 29.A OG no hydrogen 2.890 N/A HIS 97.A NE2 ASP 115.A O no hydrogen 2.986 N/A ARG 99.A N GLU 27.A O no hydrogen 2.768 N/A PHE 100.A N LEU 111.A O no hydrogen 2.796 N/A TYR 101.A OH GLU 27.A OE1 no hydrogen 3.232 N/A THR 102.A N LEU 109.A O no hydrogen 3.039 N/A THR 102.A OG1 LEU 109.A O no hydrogen 3.451 N/A ALA 103.A N VAL 21.A O no hydrogen 2.865 N/A ARG 108.A NH2 THR 102.A O no hydrogen 2.898 N/A LEU 109.A N THR 102.A OG1 no hydrogen 2.594 N/A ALA 110.A N VAL 87.A O no hydrogen 2.689 N/A LEU 111.A N PHE 100.A O no hydrogen 2.875 N/A CYS 112.A N GLN 85.A O no hydrogen 2.861 N/A CYS 112.A SG ALA 110.A O no hydrogen 3.931 N/A PHE 113.A N LEU 98.A O no hydrogen 2.785 N/A VAL 114.A N SER 83.A O no hydrogen 2.882 N/A ASP 115.A N HIS 95.A O no hydrogen 2.964 N/A ARG 117.A N SER 81.A OG no hydrogen 2.833 N/A ARG 118.A N ASP 115.A OD1 no hydrogen 3.299 N/A GLY 120.A N ASP 115.A OD2 no hydrogen 2.981 N/A ARG 121.A N ARG 77.A O no hydrogen 3.022 N/A ARG 121.A NE GLY 120.A O no hydrogen 2.918 N/A ARG 121.A NH2 ARG 118.A O no hydrogen 3.086 N/A TRP 122.A N ASN 34.A OD1 no hydrogen 3.470 N/A TRP 122.A NE1 PRO 35.A O no hydrogen 2.922 N/A ASP 123.A N VAL 75.A O no hydrogen 3.292 N/A GLN 129.A N GLU 54.A OE1 no hydrogen 2.856 N/A ARG 132.A N GLN 129.A O no hydrogen 3.080 N/A ARG 132.A NH1 GLN 167.A OE1 no hydrogen 3.116 N/A ARG 132.A NH1 ASN 171.A OD1 no hydrogen 2.856 N/A GLY 133.A N GLN 167.A O no hydrogen 2.961 N/A CYS 135.A N GLU 139.A OE1 no hydrogen 2.907 N/A VAL 136.A N ASN 171.A O no hydrogen 3.500 N/A GLU 139.A N CYS 135.A O no hydrogen 2.792 N/A PHE 143.A N GLU 139.A O no hydrogen 2.789 N/A ARG 144.A N TYR 140.A O no hydrogen 2.730 N/A ARG 144.A NE GLN 201.A OE1 no hydrogen 2.594 N/A ARG 144.A NH1 TYR 140.A OH no hydrogen 2.747 N/A ARG 144.A NH1 ASP 205.A OD1 no hydrogen 3.102 N/A ARG 144.A NH1 ASP 205.A OD2 no hydrogen 3.396 N/A ARG 144.A NH2 GLN 201.A OE1 no hydrogen 3.227 N/A ARG 144.A NH2 ASP 205.A OD2 no hydrogen 2.791 N/A GLU 145.A N GLN 141.A O no hydrogen 2.831 N/A ASN 146.A N GLN 142.A O no hydrogen 2.893 N/A VAL 147.A N PHE 143.A O no hydrogen 3.179 N/A VAL 147.A N ARG 144.A O no hydrogen 3.211 N/A LEU 148.A N ARG 144.A O no hydrogen 3.099 N/A ARG 149.A N GLU 145.A O no hydrogen 2.922 N/A ASN 150.A N VAL 147.A O no hydrogen 3.207 N/A ASN 150.A ND2 ASN 146.A O no hydrogen 2.674 N/A ASP 153.A N ASN 150.A O no hydrogen 3.032 N/A LYS 154.A NZ ASP 153.A OD1 no hydrogen 3.372 N/A ALA 155.A N ASP 153.A OD1 no hydrogen 2.706 N/A PHE 156.A N ASP 153.A O no hydrogen 2.759 N/A ASP 157.A N LYS 154.A O no hydrogen 3.016 N/A ARG 158.A N ALA 155.A O no hydrogen 3.184 N/A ARG 158.A NE GLU 162.A OE1 no hydrogen 3.395 N/A ARG 158.A NH2 GLU 162.A OE1 no hydrogen 3.376 N/A ILE 160.A N GLU 191.A O no hydrogen 2.854 N/A CYS 161.A N PRO 189.A O no hydrogen 3.005 N/A CYS 161.A SG PRO 189.A O no hydrogen 3.422 N/A GLU 162.A N PRO 159.A O no hydrogen 3.059 N/A ALA 163.A N PRO 159.A O no hydrogen 2.999 N/A LEU 164.A N ILE 160.A O no hydrogen 3.028 N/A LEU 165.A N GLU 162.A O no hydrogen 2.899 N/A ASP 166.A N ALA 163.A O no hydrogen 2.992 N/A GLN 167.A NE2 LEU 165.A O no hydrogen 3.043 N/A GLN 167.A NE2 ILE 173.A O no hydrogen 2.871 N/A ARG 168.A N ASP 166.A OD1 no hydrogen 3.023 N/A ARG 168.A NH1 ASP 153.A OD2 no hydrogen 2.980 N/A PHE 169.A N ASP 166.A O no hydrogen 3.134 N/A PHE 170.A N ASP 166.A O no hydrogen 3.000 N/A ASN 171.A ND2 GLY 133.A O no hydrogen 2.935 N/A GLY 172.A N GLN 167.A OE1 no hydrogen 2.907 N/A ILE 173.A N PHE 170.A O no hydrogen 3.008 N/A GLY 174.A N GLU 2.A OE1 no hydrogen 2.851 N/A ASN 175.A ND2 THR 252.A O no hydrogen 3.012 N/A TYR 176.A N GLU 2.A OE2 no hydrogen 2.818 N/A TYR 176.A OH GLU 5.A OE1 no hydrogen 3.343 N/A TYR 176.A OH GLU 5.A OE2 no hydrogen 2.422 N/A LEU 177.A N GLU 2.A OE1 no hydrogen 3.043 N/A ARG 178.A N GLY 174.A O no hydrogen 2.914 N/A ARG 178.A NE ASN 175.A OD1 no hydrogen 2.753 N/A ARG 178.A NH1 CYS 161.A O no hydrogen 2.846 N/A ARG 178.A NH1 ASP 247.A OD2 no hydrogen 2.634 N/A ARG 178.A NH2 ASN 175.A OD1 no hydrogen 2.902 N/A ARG 178.A NH2 ASP 247.A OD2 no hydrogen 3.093 N/A ARG 178.A NH2 ARG 251.A O no hydrogen 3.307 N/A ALA 179.A N ASN 175.A O no hydrogen 3.478 N/A GLU 180.A N TYR 176.A O no hydrogen 3.101 N/A ILE 181.A N LEU 177.A O no hydrogen 2.795 N/A LEU 182.A N ARG 178.A O no hydrogen 2.935 N/A TYR 183.A N ALA 179.A O no hydrogen 3.030 N/A ARG 184.A N GLU 180.A O no hydrogen 3.194 N/A ARG 184.A NH1 GLU 216.A OE1 no hydrogen 3.232 N/A ARG 184.A NH1 GLU 216.A OE2 no hydrogen 2.784 N/A ARG 184.A NH2 GLU 216.A OE1 no hydrogen 2.981 N/A LYS 186.A N TYR 183.A O no hydrogen 3.251 N/A ILE 187.A N LEU 182.A O no hydrogen 3.291 N/A PHE 190.A N PRO 259.A O no hydrogen 2.882 N/A GLU 191.A N PRO 188.A O no hydrogen 3.073 N/A LYS 192.A N GLU 191.A OE1 no hydrogen 3.229 N/A ALA 193.A N ARG 158.A O no hydrogen 3.130 N/A ARG 194.A N PHE 156.A O no hydrogen 2.945 N/A ARG 194.A NE LEU 151.A O no hydrogen 2.613 N/A ARG 194.A NH1 ASP 157.A OD1 no hydrogen 2.646 N/A ARG 194.A NH2 LEU 151.A O no hydrogen 2.735 N/A ARG 194.A NH2 ASP 157.A OD1 no hydrogen 3.109 N/A SER 195.A OG LYS 192.A O no hydrogen 3.068 N/A VAL 196.A N LYS 192.A O no hydrogen 3.229 N/A VAL 196.A N ALA 193.A O no hydrogen 3.193 N/A LEU 197.A N ALA 193.A O no hydrogen 3.222 N/A LEU 197.A N ARG 194.A O no hydrogen 3.345 N/A GLU 198.A N ARG 194.A O no hydrogen 2.989 N/A LEU 200.A N LEU 197.A O no hydrogen 3.274 N/A ASP 205.A N GLU 208.A OE1 no hydrogen 3.253 N/A GLU 208.A N ASP 205.A OD1 no hydrogen 2.921 N/A LEU 209.A N ASP 205.A O no hydrogen 3.034 N/A CYS 210.A N LEU 206.A O no hydrogen 3.221 N/A CYS 210.A SG LEU 206.A O no hydrogen 3.258 N/A HIS 211.A N GLU 208.A O no hydrogen 3.348 N/A HIS 211.A ND1 VAL 136.A O no hydrogen 2.926 N/A SER 212.A N GLU 208.A O no hydrogen 3.077 N/A SER 212.A OG GLU 208.A O no hydrogen 3.216 N/A VAL 213.A N LEU 209.A O no hydrogen 2.701 N/A LYS 215.A N HIS 211.A O no hydrogen 3.098 N/A GLU 216.A N SER 212.A O no hydrogen 3.067 N/A VAL 217.A N PRO 214.A O no hydrogen 2.991 N/A VAL 218.A N PRO 214.A O no hydrogen 3.090 N/A GLN 219.A N LYS 215.A O no hydrogen 2.998 N/A LEU 220.A N GLU 216.A O no hydrogen 3.054 N/A LEU 220.A N VAL 217.A O no hydrogen 3.075 N/A GLY 221.A N VAL 218.A O no hydrogen 2.907 N/A LYS 223.A NZ GLU 5.A OE2 no hydrogen 2.635 N/A ARG 231.A N PHE 227.A O no hydrogen 3.012 N/A ALA 232.A N ALA 228.A O no hydrogen 3.024 N/A TRP 233.A N ALA 229.A O no hydrogen 3.186 N/A TRP 233.A N PHE 230.A O no hydrogen 2.922 N/A TRP 233.A NE1 GLU 216.A OE1 no hydrogen 2.748 N/A LEU 234.A N PHE 230.A O no hydrogen 2.987 N/A ARG 235.A N GLU 180.A OE1 no hydrogen 2.822 N/A CYS 236.A N GLU 180.A OE2 no hydrogen 2.979 N/A TYR 237.A N GLU 180.A OE2 no hydrogen 2.784 N/A MET 239.A N CYS 236.A O no hydrogen 2.734 N/A MET 242.A N MET 239.A O no hydrogen 3.155 N/A SER 243.A N PHE 255.A O no hydrogen 2.709 N/A LEU 245.A N ILE 253.A O no hydrogen 2.985 N/A GLN 246.A NE2 GLY 250.A O no hydrogen 3.061 N/A GLN 246.A NE2 THR 252.A OG1 no hydrogen 3.393 N/A ASP 247.A N ARG 251.A O no hydrogen 3.051 N/A ARG 248.A N GLU 162.A OE2 no hydrogen 3.282 N/A GLY 250.A N ASP 247.A O no hydrogen 3.019 N/A ARG 251.A N ASP 247.A OD1 no hydrogen 2.654 N/A THR 252.A OG1 GLN 246.A OE1 no hydrogen 3.224 N/A ILE 253.A N LEU 245.A O no hydrogen 2.764 N/A PHE 255.A N SER 243.A O no hydrogen 2.974 N/A GLY 260.A N ASP 258.A OD1 no hydrogen 3.300 N/A LEU 262.A N PHE 190.A O no hydrogen 2.930 N/A ALA 263.A N GLY 260.A O no hydrogen 3.164 N/A