Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3tos_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 1.A NE2 VAL 112.A O no hydrogen 2.576 N/A ARG 4.A N ASP 2.A OD2 no hydrogen 3.107 N/A ARG 4.A NE ASP 2.A OD2 no hydrogen 2.868 N/A ALA 5.A N ASP 2.A O no hydrogen 3.124 N/A PHE 6.A N LEU 3.A O no hydrogen 3.247 N/A HIS 8.A ND1 PHE 6.A O no hydrogen 2.779 N/A SER 10.A OG GLU 12.A OE1 no hydrogen 3.505 N/A GLU 13.A N SER 10.A OG no hydrogen 2.895 N/A THR 14.A N SER 10.A O no hydrogen 3.021 N/A THR 14.A OG1 SER 10.A O no hydrogen 3.279 N/A GLU 15.A N PRO 11.A O no hydrogen 2.841 N/A THR 16.A N GLU 12.A O no hydrogen 2.867 N/A THR 16.A OG1 GLU 12.A O no hydrogen 3.335 N/A THR 17.A N GLU 13.A O no hydrogen 3.029 N/A THR 17.A OG1 GLU 13.A O no hydrogen 2.878 N/A GLN 18.A N THR 14.A O no hydrogen 2.924 N/A ARG 19.A N GLU 15.A O no hydrogen 2.854 N/A ARG 19.A NE GLU 15.A OE2 no hydrogen 2.684 N/A ARG 19.A NH2 GLU 15.A OE2 no hydrogen 3.458 N/A LEU 20.A N THR 16.A O no hydrogen 2.893 N/A THR 21.A N THR 17.A O no hydrogen 2.973 N/A THR 21.A OG1 THR 17.A O no hydrogen 2.964 N/A LYS 22.A N.A GLN 18.A O no hydrogen 3.083 N/A LYS 22.A N.B GLN 18.A O no hydrogen 3.082 N/A LEU 23.A N ARG 19.A O no hydrogen 2.830 N/A LEU 24.A N LEU 20.A O no hydrogen 2.886 N/A THR 25.A N THR 21.A O no hydrogen 3.052 N/A THR 25.A OG1 THR 21.A O no hydrogen 2.949 N/A THR 25.A OG1 LYS 22.A O.A no hydrogen 3.524 N/A THR 25.A OG1 LYS 22.A O.B no hydrogen 3.469 N/A ASN 26.A N LYS 22.A O.A no hydrogen 2.918 N/A ASN 26.A N LYS 22.A O.B no hydrogen 2.871 N/A ASN 26.A ND2 LYS 22.A O.A no hydrogen 2.963 N/A ASN 26.A ND2 LYS 22.A O.B no hydrogen 2.985 N/A ILE 29.A N SER 27.A OG no hydrogen 3.120 N/A GLU 32.A N GLU 32.A OE1 no hydrogen 2.840 N/A GLU 33.A N PRO 30.A O no hydrogen 2.876 N/A LEU 34.A N THR 31.A O no hydrogen 3.243 N/A ASN 36.A N GLU 33.A O no hydrogen 2.919 N/A ASN 36.A ND2 GLU 33.A OE1 no hydrogen 2.873 N/A ASN 37.A N LEU 34.A O no hydrogen 2.992 N/A ASN 37.A ND2 GLU 33.A O no hydrogen 2.961 N/A LEU 40.A N ASN 37.A O no hydrogen 3.087 N/A PHE 41.A N LEU 38.A O no hydrogen 2.809 N/A LEU 42.A N PRO 39.A O no hydrogen 3.335 N/A ARG 43.A NE GLU 13.A OE2 no hydrogen 2.789 N/A ARG 43.A NH2 GLU 13.A OE2 no hydrogen 3.379 N/A THR 47.A OG1 ARG 44.A O no hydrogen 2.783 N/A ASP 48.A N HIS 45.A O no hydrogen 3.299 N/A LEU 49.A N GLN 46.A O no hydrogen 3.057 N/A SER 51.A N THR 47.A O no hydrogen 2.865 N/A SER 51.A OG THR 47.A O no hydrogen 3.186 N/A ALA 53.A N LEU 50.A O no hydrogen 2.903 N/A LEU 54.A N SER 51.A O no hydrogen 2.993 N/A TYR 55.A OH GLU 86.A OE1 no hydrogen 2.651 N/A ARG 56.A N ASP 52.A O no hydrogen 2.869 N/A ARG 56.A NE ASP 52.A OD2 no hydrogen 2.908 N/A GLN 57.A N ALA 53.A O no hydrogen 3.289 N/A GLN 57.A N LEU 54.A O no hydrogen 3.104 N/A GLN 57.A NE2 TYR 242.A OH no hydrogen 3.236 N/A VAL 58.A N TYR 55.A O no hydrogen 2.941 N/A LEU 59.A N ARG 56.A O no hydrogen 3.518 N/A VAL 61.A N VAL 58.A O no hydrogen 2.950 N/A VAL 64.A N VAL 173.A O no hydrogen 2.733 N/A ILE 65.A N ARG 93.A O no hydrogen 2.950 N/A PHE 67.A N TYR 178.A O no hydrogen 2.904 N/A GLY 68.A N PHE 97.A O no hydrogen 2.907 N/A VAL 69.A N ASP 98.A OD2 no hydrogen 2.783 N/A ARG 70.A N ASP 98.A OD2 no hydrogen 3.000 N/A GLY 72.A N VAL 69.A O no hydrogen 2.900 N/A ARG 73.A NH1 GLN 46.A OE1 no hydrogen 2.893 N/A HIS 74.A ND1 GLU 66.A OE2 no hydrogen 2.614 N/A HIS 74.A NE2 ASP 48.A OD1 no hydrogen 2.716 N/A GLY 76.A N GLY 72.A O no hydrogen 2.978 N/A THR 77.A N ARG 73.A O no hydrogen 3.242 N/A THR 77.A OG1 ARG 73.A O no hydrogen 2.804 N/A PHE 78.A N HIS 74.A O no hydrogen 2.850 N/A ALA 79.A N LEU 75.A O no hydrogen 2.862 N/A ALA 80.A N GLY 76.A O no hydrogen 3.124 N/A LEU 81.A N THR 77.A O no hydrogen 2.934 N/A ARG 82.A N PHE 78.A O no hydrogen 2.855 N/A ARG 82.A NH1 ARG 92.A O no hydrogen 2.904 N/A ARG 82.A NH1 ARG 150.A O.A no hydrogen 2.785 N/A ARG 82.A NH1 ARG 150.A O.B no hydrogen 2.913 N/A ARG 82.A NH2 GLU 139.A OE2 no hydrogen 2.831 N/A GLY 83.A N ALA 79.A O no hydrogen 3.383 N/A VAL 84.A N ALA 80.A O no hydrogen 3.034 N/A TYR 85.A N LEU 81.A O no hydrogen 2.828 N/A TYR 85.A OH ASP 52.A OD1 no hydrogen 2.447 N/A GLU 86.A N ARG 82.A O no hydrogen 2.798 N/A ASN 89.A N GLU 86.A O no hydrogen 3.213 N/A ASN 89.A ND2 GLU 86.A OE2 no hydrogen 3.012 N/A LEU 91.A N ASN 89.A OD1 no hydrogen 2.896 N/A ARG 92.A NE GLU 86.A OE1 no hydrogen 2.772 N/A ARG 92.A NE GLU 86.A OE2 no hydrogen 3.436 N/A ARG 92.A NH1 VAL 61.A O no hydrogen 2.812 N/A ARG 92.A NH1 GLY 63.A O no hydrogen 2.963 N/A ARG 92.A NH2 VAL 58.A O no hydrogen 3.184 N/A ARG 92.A NH2 VAL 61.A O no hydrogen 3.195 N/A ARG 92.A NH2 GLU 86.A OE2 no hydrogen 2.913 N/A ARG 93.A N LEU 91.A O no hydrogen 2.860 N/A ARG 93.A NE GLN 149.A O.A no hydrogen 2.895 N/A ARG 93.A NE GLN 149.A O.B no hydrogen 2.857 N/A ARG 93.A NH1 TYR 165.A OH no hydrogen 2.935 N/A ARG 93.A NH1 ASN 169.A OD1 no hydrogen 3.200 N/A ARG 93.A NH2 GLN 149.A O.A no hydrogen 3.437 N/A ILE 94.A N ARG 150.A O.A no hydrogen 2.976 N/A ILE 94.A N ARG 150.A O.B no hydrogen 2.891 N/A VAL 95.A N ILE 65.A O no hydrogen 2.845 N/A GLY 96.A N VAL 152.A O no hydrogen 2.889 N/A PHE 97.A N GLU 66.A O no hydrogen 2.901 N/A ASP 98.A N VAL 154.A O no hydrogen 3.175 N/A THR 99.A OG1 ASP 98.A OD1 no hydrogen 3.353 N/A THR 99.A OG1 THR 101.A OG1 no hydrogen 3.422 N/A THR 99.A OG1 GLY 102.A O no hydrogen 2.847 N/A PHE 100.A N ASP 98.A OD1 no hydrogen 2.857 N/A THR 101.A N THR 99.A OG1 no hydrogen 2.914 N/A PHE 103.A N ARG 120.A O no hydrogen 2.968 N/A ASN 107.A N ASP 110.A OD2 no hydrogen 2.942 N/A ASN 107.A ND2 GLU 185.A OE2 no hydrogen 2.750 N/A VAL 109.A N ASN 107.A OD1 no hydrogen 2.918 N/A ASP 110.A N ASN 107.A O no hydrogen 2.902 N/A ARG 111.A N.A ASP 108.A O no hydrogen 3.048 N/A ARG 111.A N.B ASP 108.A O no hydrogen 3.039 N/A ARG 111.A NH1.A ASP 108.A OD1 no hydrogen 2.953 N/A VAL 112.A N ASP 110.A O no hydrogen 2.942 N/A TYR 117.A N THR 115.A O no hydrogen 3.051 N/A GLN 118.A NE2.B PRO 104.A O.B no hydrogen 2.733 N/A GLY 119.A N PHE 103.A O no hydrogen 2.710 N/A ARG 120.A N TYR 117.A O no hydrogen 3.127 N/A ARG 120.A NH1 TYR 117.A OH no hydrogen 2.877 N/A ALA 122.A N GLY 119.A O no hydrogen 3.043 N/A VAL 123.A N PHE 100.A O no hydrogen 3.426 N/A TYR 127.A N PRO 124.A O no hydrogen 2.985 N/A TYR 127.A OH PHE 71.A O no hydrogen 2.648 N/A ALA 129.A N GLY 126.A O no hydrogen 3.228 N/A LEU 131.A N TYR 127.A O no hydrogen 2.937 N/A LYS 132.A N PRO 128.A O no hydrogen 2.876 N/A LYS 132.A NZ ASP 136.A OD1 no hydrogen 3.415 N/A LYS 132.A NZ SER 151.A O.A no hydrogen 2.589 N/A LYS 132.A NZ SER 151.A O.B no hydrogen 2.794 N/A GLU 133.A N ALA 129.A O no hydrogen 2.910 N/A VAL 134.A N TYR 130.A O no hydrogen 2.959 N/A LEU 135.A N LEU 131.A O no hydrogen 2.919 N/A ASP 136.A N LYS 132.A O no hydrogen 2.807 N/A ALA 137.A N GLU 133.A O no hydrogen 2.900 N/A HIS 138.A N VAL 134.A O no hydrogen 3.164 N/A GLU 139.A N LEU 135.A O no hydrogen 2.980 N/A CYS 140.A N.A ASP 136.A O no hydrogen 3.028 N/A CYS 140.A N.B ASP 136.A O no hydrogen 2.981 N/A CYS 140.A N.C ASP 136.A O no hydrogen 2.994 N/A CYS 140.A SG.A ALA 137.A O no hydrogen 3.149 N/A CYS 140.A SG.C ASP 136.A O no hydrogen 3.368 N/A SER 141.A N HIS 138.A O no hydrogen 3.340 N/A SER 141.A OG HIS 138.A O no hydrogen 3.359 N/A ASP 142.A N GLU 139.A O no hydrogen 3.003 N/A GLY 145.A N ASP 142.A O no hydrogen 2.855 N/A VAL 147.A N PHE 144.A O no hydrogen 3.003 N/A ARG 150.A NE.A VAL 147.A O no hydrogen 2.997 N/A ARG 150.A NH1.A ASP 142.A OD2 no hydrogen 3.259 N/A ARG 150.A NH1.B ASP 142.A OD2 no hydrogen 2.667 N/A ARG 150.A NH2.A ASP 142.A OD2 no hydrogen 3.319 N/A ARG 150.A NH2.B ASP 142.A OD2 no hydrogen 2.874 N/A SER 151.A OG.A GLU 139.A OE2 no hydrogen 2.286 N/A SER 151.A OG.B GLU 139.A OE2 no hydrogen 2.823 N/A VAL 152.A N ILE 94.A O no hydrogen 2.879 N/A VAL 154.A N GLY 96.A O no hydrogen 2.854 N/A GLY 156.A N ASP 98.A O no hydrogen 2.850 N/A ARG 159.A N ASP 157.A OD1 no hydrogen 3.013 N/A ARG 159.A NH1 ASP 105.A OD2.B no hydrogen 2.791 N/A ARG 159.A NH1 GLU 185.A OE1 no hydrogen 2.501 N/A ARG 159.A NH2 ASP 105.A OD1.B no hydrogen 2.954 N/A ARG 159.A NH2 ASP 105.A OD2.B no hydrogen 3.366 N/A ARG 159.A NH2 ASP 157.A OD1 no hydrogen 3.438 N/A ARG 159.A NH2 ASP 157.A OD2 no hydrogen 2.773 N/A GLU 160.A N ASP 157.A O no hydrogen 2.922 N/A THR 161.A N ASP 157.A O no hydrogen 2.912 N/A THR 161.A OG1 ASP 157.A O no hydrogen 3.349 N/A VAL 162.A N VAL 158.A O no hydrogen 3.033 N/A ARG 164.A N.A GLU 160.A O no hydrogen 3.161 N/A ARG 164.A N.B GLU 160.A O no hydrogen 3.166 N/A TYR 165.A N THR 161.A O no hydrogen 2.819 N/A LEU 166.A N VAL 162.A O no hydrogen 2.992 N/A ALA 167.A N PRO 163.A O no hydrogen 2.932 N/A GLU 168.A N ARG 164.A O.A no hydrogen 2.981 N/A GLU 168.A N ARG 164.A O.B no hydrogen 2.978 N/A ASN 169.A N LEU 166.A O no hydrogen 3.059 N/A ASN 169.A ND2 TYR 165.A O no hydrogen 2.929 N/A GLN 171.A N GLN 171.A OE1 no hydrogen 2.748 N/A GLN 171.A NE2 ASN 169.A OD1 no hydrogen 2.958 N/A THR 172.A N ASN 169.A O no hydrogen 3.028 N/A THR 172.A OG1 ASN 169.A O no hydrogen 2.672 N/A ILE 174.A N TYR 197.A O no hydrogen 2.826 N/A ALA 175.A N VAL 64.A O no hydrogen 2.801 N/A LEU 176.A N VAL 64.A O no hydrogen 3.284 N/A ALA 177.A N ILE 203.A O no hydrogen 2.897 N/A TYR 178.A OH ASP 207.A OD2 no hydrogen 2.654 N/A PHE 179.A N ALA 205.A O no hydrogen 2.774 N/A ASP 180.A N PHE 67.A O no hydrogen 2.766 N/A ASP 182.A N GLU 217.A OE2 no hydrogen 3.365 N/A TYR 184.A N ASP 110.A OD1 no hydrogen 2.907 N/A THR 187.A N LEU 183.A O no hydrogen 3.306 N/A THR 187.A OG1 LEU 183.A O no hydrogen 2.710 N/A LYS 188.A N TYR 184.A O no hydrogen 3.001 N/A LYS 188.A NZ GLU 192.A OE2 no hydrogen 2.668 N/A ALA 189.A N GLU 185.A O no hydrogen 3.052 N/A VAL 190.A N PRO 186.A O no hydrogen 2.933 N/A LEU 191.A N THR 187.A O no hydrogen 2.900 N/A GLU 192.A N LYS 188.A O no hydrogen 3.081 N/A ALA 193.A N ALA 189.A O no hydrogen 2.977 N/A ILE 194.A N VAL 190.A O no hydrogen 2.944 N/A TYR 197.A N ILE 194.A O no hydrogen 3.019 N/A LEU 198.A N ARG 195.A O no hydrogen 3.358 N/A THR 199.A N SER 202.A OG no hydrogen 2.988 N/A GLY 201.A N TRP 245.A O no hydrogen 2.910 N/A SER 202.A N THR 199.A O no hydrogen 3.016 N/A SER 202.A OG ILE 174.A O no hydrogen 2.649 N/A SER 202.A OG THR 199.A O no hydrogen 3.245 N/A ILE 203.A N ALA 175.A O no hydrogen 2.907 N/A VAL 204.A N LEU 243.A O no hydrogen 3.036 N/A ALA 205.A N ALA 177.A O no hydrogen 2.892 N/A PHE 206.A N ALA 241.A O no hydrogen 2.767 N/A ASP 207.A N PHE 179.A O no hydrogen 2.966 N/A GLU 208.A N.A GLU 217.A OE1 no hydrogen 2.989 N/A GLU 208.A N.B GLU 217.A OE1 no hydrogen 2.990 N/A ASN 211.A N GLU 208.A O.A no hydrogen 3.382 N/A ASN 211.A N GLU 208.A O.B no hydrogen 3.527 N/A ASN 211.A ND2 GLU 208.A OE1.A no hydrogen 2.727 N/A LYS 213.A N ASN 211.A OD1 no hydrogen 2.854 N/A TRP 214.A N ASN 211.A O no hydrogen 2.906 N/A ILE 219.A N PRO 215.A O no hydrogen 2.911 N/A ALA 220.A N GLY 216.A O no hydrogen 2.865 N/A ARG 221.A NE ASN 218.A OD1 no hydrogen 2.738 N/A LYS 222.A N ILE 219.A O no hydrogen 3.045 N/A VAL 223.A N ALA 220.A O no hydrogen 2.905 N/A HIS 228.A N GLY 225.A O no hydrogen 3.116 N/A ARG 232.A N TYR 242.A O no hydrogen 2.817 N/A ARG 232.A NH1 LEU 231.A O no hydrogen 2.855 N/A ARG 237.A N LEU 234.A O no hydrogen 3.110 N/A ARG 237.A NH1 SER 51.A OG no hydrogen 3.036 N/A ALA 241.A N PHE 206.A O no hydrogen 3.021 N/A TYR 242.A N ARG 232.A O no hydrogen 2.852 N/A LEU 243.A N VAL 204.A O no hydrogen 2.903 N/A ARG 244.A NE.A ASP 247.A OD2 no hydrogen 3.214 N/A TRP 245.A N SER 202.A O no hydrogen 2.780 N/A ASP 247.A N ARG 244.A O.A no hydrogen 2.970 N/A ASP 247.A N ARG 244.A O.B no hydrogen 3.114 N/A