Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3dgq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 5.A N GLN 57.A O no hydrogen 2.964 N/A VAL 6.A N LYS 30.A O no hydrogen 2.783 N/A VAL 7.A N LYS 55.A O no hydrogen 2.818 N/A TYR 8.A N GLU 32.A O no hydrogen 3.098 N/A VAL 11.A N PHE 9.A O no hydrogen 2.779 N/A ARG 12.A N PRO 203.A O no hydrogen 2.867 N/A ARG 12.A NE TYR 199.A O no hydrogen 2.997 N/A ARG 12.A NE LEU 202.A O no hydrogen 2.984 N/A ARG 12.A NH2 TYR 199.A O no hydrogen 3.146 N/A ARG 12.A NH2 VAL 200.A O no hydrogen 3.027 N/A GLY 13.A N ILE 204.A O no hydrogen 2.821 N/A ARG 14.A N TYR 8.A OH no hydrogen 2.953 N/A ARG 14.A NH1 SER 66.A OG no hydrogen 3.043 N/A ARG 14.A NH1 GLU 98.A OE1 no hydrogen 2.793 N/A ARG 14.A NH1 GLU 98.A OE2 no hydrogen 3.423 N/A ARG 14.A NH2 GLU 98.A OE1 no hydrogen 3.506 N/A ARG 14.A NH2 GLU 98.A OE2 no hydrogen 2.961 N/A CYS 15.A N ARG 12.A O no hydrogen 2.971 N/A ALA 16.A N GLY 13.A O no hydrogen 3.338 N/A ARG 19.A N CYS 15.A O no hydrogen 2.963 N/A ARG 19.A NE GLU 31.A OE2 no hydrogen 2.764 N/A ARG 19.A NH1 VAL 11.A O no hydrogen 2.940 N/A ARG 19.A NH2 GLU 31.A OE1 no hydrogen 2.922 N/A MET 20.A N ALA 16.A O no hydrogen 2.905 N/A LEU 21.A N ALA 17.A O no hydrogen 2.838 N/A LEU 22.A N LEU 18.A O no hydrogen 2.877 N/A ALA 23.A N ARG 19.A O no hydrogen 2.824 N/A ASP 24.A N MET 20.A O no hydrogen 2.799 N/A GLN 25.A N LEU 21.A O no hydrogen 2.940 N/A GLN 25.A N LEU 22.A O no hydrogen 3.158 N/A GLN 25.A NE2 TYR 154.A OH no hydrogen 2.959 N/A GLY 26.A N ALA 23.A O no hydrogen 3.035 N/A GLN 27.A N LEU 22.A O no hydrogen 2.998 N/A GLN 27.A NE2 GLN 25.A O no hydrogen 3.539 N/A TRP 29.A NE1 GLU 31.A OE2 no hydrogen 2.751 N/A LYS 30.A N TYR 4.A O no hydrogen 2.851 N/A LYS 30.A NZ GLU 32.A OE2 no hydrogen 3.170 N/A GLU 32.A N VAL 6.A O no hydrogen 2.767 N/A VAL 34.A N TYR 8.A O no hydrogen 2.901 N/A THR 35.A OG1 THR 38.A OG1 no hydrogen 3.029 N/A THR 38.A N THR 35.A OG1 no hydrogen 3.129 N/A THR 38.A OG1 THR 35.A OG1 no hydrogen 3.029 N/A TRP 39.A N THR 35.A O no hydrogen 2.974 N/A GLN 40.A N VAL 36.A O no hydrogen 2.844 N/A GLU 41.A N GLU 37.A O no hydrogen 3.117 N/A GLU 41.A N THR 38.A O no hydrogen 3.217 N/A SER 43.A N GLU 41.A OE1 no hydrogen 3.054 N/A SER 43.A OG GLU 41.A OE1 no hydrogen 2.874 N/A LYS 45.A NZ GLY 51.A O no hydrogen 2.693 N/A ALA 46.A N GLY 42.A O no hydrogen 2.931 N/A SER 47.A N SER 43.A O no hydrogen 3.088 N/A SER 47.A OG LEU 44.A O no hydrogen 2.723 N/A CYS 48.A N LYS 45.A O no hydrogen 3.010 N/A CYS 48.A SG LEU 44.A O no hydrogen 3.336 N/A CYS 48.A SG GLN 52.A O no hydrogen 3.722 N/A GLY 51.A N CYS 48.A O no hydrogen 2.988 N/A LYS 55.A N VAL 7.A O no hydrogen 3.140 N/A PHE 56.A N LEU 63.A O no hydrogen 2.808 N/A GLN 57.A N THR 5.A O no hydrogen 2.889 N/A ASP 58.A N LEU 61.A O no hydrogen 2.856 N/A GLY 59.A N PRO 3.A O no hydrogen 2.895 N/A LEU 61.A N ASP 58.A O no hydrogen 2.980 N/A LEU 63.A N PHE 56.A O no hydrogen 2.795 N/A ILE 69.A N GLN 65.A O no hydrogen 3.014 N/A LEU 70.A N SER 66.A O no hydrogen 2.899 N/A ARG 71.A N ASN 67.A O no hydrogen 2.935 N/A ARG 71.A NE TYR 80.A OH no hydrogen 3.135 N/A ARG 71.A NE ASP 91.A OD1 no hydrogen 2.874 N/A ARG 71.A NH2 ASP 91.A OD1 no hydrogen 3.051 N/A ARG 71.A NH2 ASP 95.A OD1 no hydrogen 3.148 N/A HIS 72.A N THR 68.A O no hydrogen 2.863 N/A HIS 72.A NE2 ASP 58.A OD2 no hydrogen 2.761 N/A LEU 73.A N ILE 69.A O no hydrogen 2.938 N/A GLY 74.A N LEU 70.A O no hydrogen 2.767 N/A ARG 75.A N ARG 71.A O no hydrogen 2.840 N/A THR 76.A N HIS 72.A O no hydrogen 2.947 N/A THR 76.A OG1 HIS 72.A O no hydrogen 3.234 N/A LEU 77.A N LEU 73.A O no hydrogen 2.821 N/A GLY 78.A N ARG 75.A O no hydrogen 3.469 N/A LEU 79.A N GLY 74.A O no hydrogen 2.778 N/A TYR 80.A OH ASP 91.A OD1 no hydrogen 2.599 N/A TYR 80.A OH ASP 91.A OD2 no hydrogen 3.305 N/A LYS 82.A N GLU 86.A OE1 no hydrogen 2.763 N/A GLU 86.A N ASP 83.A OD1 no hydrogen 2.777 N/A ALA 87.A N ASP 83.A O no hydrogen 3.026 N/A ALA 88.A N GLN 84.A O no hydrogen 3.102 N/A LEU 89.A N GLN 85.A O no hydrogen 3.109 N/A VAL 90.A N GLU 86.A O no hydrogen 2.781 N/A ASP 91.A N ALA 87.A O no hydrogen 2.947 N/A MET 92.A N ALA 88.A O no hydrogen 2.837 N/A VAL 93.A N LEU 89.A O no hydrogen 2.973 N/A ASN 94.A N VAL 90.A O no hydrogen 2.945 N/A ASP 95.A N ASP 91.A O no hydrogen 2.869 N/A GLY 96.A N MET 92.A O no hydrogen 3.187 N/A VAL 97.A N VAL 93.A O no hydrogen 2.864 N/A GLU 98.A N ASN 94.A O no hydrogen 2.868 N/A ASP 99.A N ASP 95.A O no hydrogen 2.930 N/A LEU 100.A N GLY 96.A O no hydrogen 3.190 N/A ARG 101.A N VAL 97.A O no hydrogen 2.773 N/A ARG 101.A NH1 ASP 158.A OD2 no hydrogen 2.985 N/A ARG 101.A NH2 ASN 155.A O no hydrogen 3.537 N/A ARG 101.A NH2 ASN 155.A OD1 no hydrogen 2.829 N/A ARG 101.A NH2 ASP 158.A OD2 no hydrogen 2.751 N/A CYS 102.A N.A GLU 98.A O no hydrogen 2.852 N/A CYS 102.A N.B GLU 98.A O no hydrogen 2.832 N/A CYS 102.A SG.A GLU 98.A O no hydrogen 3.392 N/A CYS 102.A SG.A GLU 98.A OE2 no hydrogen 3.110 N/A LYS 103.A N ASP 99.A O no hydrogen 3.248 N/A TYR 104.A N LEU 100.A O no hydrogen 2.860 N/A TYR 104.A OH ASN 205.A OD1 no hydrogen 2.952 N/A ILE 105.A N ARG 101.A O no hydrogen 2.816 N/A SER 106.A N CYS 102.A O.A no hydrogen 2.821 N/A SER 106.A N CYS 102.A O.B no hydrogen 3.135 N/A LEU 107.A N LYS 103.A O no hydrogen 2.918 N/A ILE 108.A N TYR 104.A O no hydrogen 2.896 N/A TYR 109.A N ILE 105.A O no hydrogen 2.940 N/A THR 110.A N SER 106.A O no hydrogen 2.905 N/A THR 110.A OG1 SER 106.A O no hydrogen 2.759 N/A ASN 111.A N LEU 107.A O no hydrogen 3.088 N/A TYR 112.A OH GLN 210.A O no hydrogen 2.622 N/A GLY 115.A N ASN 111.A O no hydrogen 2.853 N/A LYS 116.A N TYR 112.A O no hydrogen 3.192 N/A LYS 116.A NZ TYR 112.A OH no hydrogen 2.738 N/A LYS 116.A NZ LEU 166.A O no hydrogen 3.436 N/A TYR 119.A N GLY 115.A O no hydrogen 2.900 N/A TYR 119.A OH HIS 163.A NE2 no hydrogen 2.702 N/A VAL 120.A N LYS 116.A O no hydrogen 2.856 N/A LYS 121.A N ASP 117.A O no hydrogen 3.034 N/A ALA 122.A N ASP 118.A O no hydrogen 2.989 N/A LEU 123.A N VAL 120.A O no hydrogen 3.306 N/A GLN 126.A N ALA 122.A O no hydrogen 3.332 N/A GLN 126.A N LEU 123.A O no hydrogen 2.930 N/A LEU 127.A N LEU 123.A O no hydrogen 2.928 N/A LEU 127.A N PRO 124.A O no hydrogen 3.203 N/A LYS 128.A N PRO 124.A O no hydrogen 2.893 N/A PHE 130.A N LEU 127.A O no hydrogen 2.952 N/A GLU 131.A N LEU 127.A O no hydrogen 3.351 N/A THR 132.A N LYS 128.A O no hydrogen 2.850 N/A THR 132.A OG1 LYS 128.A O no hydrogen 3.213 N/A LEU 133.A N PRO 129.A O no hydrogen 2.908 N/A LEU 134.A N PHE 130.A O no hydrogen 2.974 N/A SER 135.A N GLU 131.A O no hydrogen 2.827 N/A SER 135.A OG THR 132.A O no hydrogen 2.637 N/A GLN 136.A N THR 132.A O no hydrogen 3.045 N/A GLN 136.A N LEU 133.A O no hydrogen 3.070 N/A ASN 137.A N LEU 134.A O no hydrogen 2.915 N/A ASN 137.A ND2 PHE 143.A O no hydrogen 2.821 N/A ASN 137.A ND2 GLY 146.A O no hydrogen 2.973 N/A GLY 140.A N ASN 137.A O no hydrogen 2.940 N/A LYS 141.A N GLN 138.A O no hydrogen 3.203 N/A LYS 141.A NZ GLY 139.A O no hydrogen 2.987 N/A THR 142.A OG1 GLN 138.A OE1 no hydrogen 2.894 N/A THR 142.A OG1 GLY 146.A O no hydrogen 3.238 N/A PHE 143.A N THR 142.A OG1 no hydrogen 2.650 N/A ILE 144.A N ASP 153.A OD1 no hydrogen 2.878 N/A SER 150.A N ASP 153.A OD2 no hydrogen 2.815 N/A SER 150.A OG ASP 153.A OD2 no hydrogen 3.318 N/A PHE 151.A N LEU 79.A O no hydrogen 2.900 N/A ASP 153.A N SER 150.A O no hydrogen 2.888 N/A TYR 154.A OH ASP 24.A OD2 no hydrogen 2.576 N/A ASN 155.A N PHE 151.A O no hydrogen 3.101 N/A ASN 155.A ND2 ASN 94.A OD1 no hydrogen 2.923 N/A LEU 156.A N ALA 152.A O no hydrogen 2.809 N/A LEU 157.A N ASP 153.A O no hydrogen 2.805 N/A ASP 158.A N TYR 154.A O no hydrogen 3.023 N/A LEU 159.A N ASN 155.A O no hydrogen 2.938 N/A LEU 160.A N LEU 156.A O no hydrogen 2.838 N/A LEU 161.A N LEU 157.A O no hydrogen 2.818 N/A ILE 162.A N ASP 158.A O no hydrogen 2.959 N/A HIS 163.A N LEU 159.A O no hydrogen 3.099 N/A HIS 163.A ND1 LEU 159.A O no hydrogen 2.786 N/A HIS 163.A NE2 TYR 119.A OH no hydrogen 2.702 N/A GLU 164.A N LEU 160.A O no hydrogen 2.930 N/A VAL 165.A N LEU 161.A O no hydrogen 3.278 N/A LEU 166.A N ILE 162.A O no hydrogen 3.017 N/A ALA 167.A N HIS 163.A O no hydrogen 2.814 N/A CYS 170.A N ALA 167.A O no hydrogen 2.959 N/A ASP 172.A N GLY 169.A O no hydrogen 2.926 N/A PHE 174.A N LEU 171.A O no hydrogen 2.920 N/A LEU 176.A N GLU 131.A OE2 no hydrogen 2.884 N/A LEU 177.A N GLU 131.A OE1 no hydrogen 2.744 N/A SER 178.A N PHE 174.A O no hydrogen 2.856 N/A SER 178.A OG.B LEU 171.A O no hydrogen 2.478 N/A SER 178.A OG.B PHE 174.A O no hydrogen 3.150 N/A ALA 179.A N PRO 175.A O no hydrogen 2.979 N/A TYR 180.A N LEU 176.A O no hydrogen 2.889 N/A TYR 180.A OH ASP 153.A OD1 no hydrogen 2.574 N/A VAL 181.A N LEU 177.A O no hydrogen 2.981 N/A GLY 182.A N SER 178.A O no hydrogen 3.125 N/A ARG 183.A N ALA 179.A O no hydrogen 2.841 N/A ARG 183.A NH2 GLY 140.A O no hydrogen 2.931 N/A ARG 183.A NH2 THR 142.A O no hydrogen 2.889 N/A LEU 184.A N TYR 180.A O no hydrogen 2.868 N/A SER 185.A N VAL 181.A O no hydrogen 2.888 N/A SER 185.A OG VAL 181.A O no hydrogen 2.766 N/A ALA 186.A N ARG 183.A O no hydrogen 3.196 N/A ARG 187.A N LEU 184.A O no hydrogen 3.082 N/A ARG 187.A NE ASP 24.A OD2 no hydrogen 2.742 N/A ARG 187.A NH2 ASP 24.A OD2 no hydrogen 3.122 N/A LYS 191.A N ARG 187.A O no hydrogen 2.672 N/A ALA 192.A N PRO 188.A O no hydrogen 2.947 N/A PHE 193.A N LYS 189.A O no hydrogen 2.951 N/A LEU 194.A N LEU 190.A O no hydrogen 2.842 N/A ALA 195.A N LYS 191.A O no hydrogen 3.153 N/A ALA 195.A N ALA 192.A O no hydrogen 3.283 N/A SER 196.A N PHE 193.A O no hydrogen 3.024 N/A SER 196.A OG PHE 193.A O no hydrogen 2.659 N/A TYR 199.A N SER 196.A O no hydrogen 3.079 N/A VAL 200.A N SER 196.A O no hydrogen 2.851 N/A ASN 201.A N PRO 197.A O no hydrogen 2.907 N/A LEU 202.A N TYR 199.A O no hydrogen 3.281 N/A GLY 206.A N TYR 109.A OH no hydrogen 2.692 N/A ASN 207.A ND2 ILE 108.A O no hydrogen 2.915 N/A LYS 209.A N ASN 207.A OD1 no hydrogen 3.141 N/A