Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ioq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 4.A OG.A TYR 166.A O no hydrogen 2.795 N/A ILE 5.A N TYR 166.A O no hydrogen 2.967 N/A TRP 7.A N VAL 164.A O no hydrogen 2.832 N/A TRP 7.A NE1 ILE 125.A O no hydrogen 2.759 N/A ARG 8.A N ASP 6.A OD1 no hydrogen 2.990 N/A ARG 8.A NE ASP 6.A OD1 no hydrogen 2.965 N/A ARG 8.A NE ASP 6.A OD2 no hydrogen 3.305 N/A ARG 8.A NH2 ASP 6.A OD2 no hydrogen 2.817 N/A GLN 9.A N ASP 6.A O no hydrogen 2.966 N/A LYS 10.A N TRP 7.A O no hydrogen 3.169 N/A GLY 11.A N ARG 8.A O no hydrogen 3.179 N/A ALA 12.A N TRP 7.A O no hydrogen 3.075 N/A THR 14.A OG1 GLU 35.A OE1 no hydrogen 2.873 N/A ARG 17.A NE PRO 15.A O no hydrogen 3.054 N/A ARG 17.A NH2 THR 14.A OG1 no hydrogen 3.228 N/A GLN 19.A N SER 176.A O no hydrogen 2.860 N/A GLN 19.A NE2 CYS 22.A O no hydrogen 2.865 N/A GLY 20.A N ASN 18.A OD1 no hydrogen 2.927 N/A CYS 22.A SG TYR 88.A OH no hydrogen 3.521 N/A GLY 23.A N CYS 63.A O no hydrogen 2.805 N/A SER 24.A OG TYR 88.A OH no hydrogen 2.725 N/A TRP 26.A NE1 GLY 62.A O no hydrogen 3.019 N/A THR 27.A N SER 24.A O no hydrogen 2.885 N/A THR 27.A OG1 SER 24.A O no hydrogen 2.738 N/A PHE 28.A N CYS 25.A O no hydrogen 2.981 N/A SER 29.A N CYS 25.A O no hydrogen 3.073 N/A SER 29.A OG SER 131.A OG no hydrogen 2.799 N/A SER 30.A OG.A TRP 26.A O no hydrogen 2.788 N/A SER 30.A OG.A THR 27.A O no hydrogen 3.124 N/A SER 30.A OG.B TRP 26.A O no hydrogen 2.807 N/A SER 30.A OG.B PRO 68.A O no hydrogen 3.523 N/A VAL 31.A N THR 27.A O no hydrogen 3.070 N/A ALA 32.A N PHE 28.A O no hydrogen 2.953 N/A ALA 33.A N SER 29.A O no hydrogen 3.015 N/A VAL 34.A N SER 30.A O no hydrogen 2.964 N/A GLU 35.A N VAL 31.A O no hydrogen 2.782 N/A GLY 36.A N ALA 32.A O no hydrogen 3.033 N/A ILE 37.A N ALA 33.A O no hydrogen 3.051 N/A ASN 38.A N VAL 34.A O no hydrogen 2.866 N/A ASN 38.A ND2 GLN 44.A O no hydrogen 3.605 N/A LYS 39.A N GLU 35.A O no hydrogen 3.015 N/A LYS 39.A NZ LYS 10.A O no hydrogen 2.871 N/A ILE 40.A N GLY 36.A O no hydrogen 3.031 N/A VAL 41.A N ILE 37.A O no hydrogen 2.902 N/A THR 42.A N ASN 38.A O no hydrogen 2.916 N/A THR 42.A OG1 ASN 38.A O no hydrogen 2.658 N/A GLY 43.A N LYS 39.A O no hydrogen 2.760 N/A GLN 44.A N THR 42.A OG1 no hydrogen 3.125 N/A LEU 48.A N GLU 35.A OE2 no hydrogen 2.859 N/A SER 49.A N HIS 81.A O no hydrogen 2.889 N/A SER 49.A OG TYR 86.A O no hydrogen 2.614 N/A GLN 51.A NE2 ASP 55.A OD1 no hydrogen 2.849 N/A GLN 51.A NE2 ASP 55.A OD2 no hydrogen 3.442 N/A GLN 51.A NE2 VAL 91.A O no hydrogen 2.863 N/A GLU 52.A N SER 49.A OG no hydrogen 2.901 N/A LEU 54.A N GLU 50.A O no hydrogen 2.926 N/A ASP 55.A N GLN 51.A O no hydrogen 2.834 N/A CYS 56.A N GLU 52.A O no hydrogen 2.760 N/A CYS 56.A SG TYR 86.A OH no hydrogen 3.882 N/A GLU 57.A N LEU 53.A O no hydrogen 2.948 N/A ARG 59.A N GLU 57.A OE2 no hydrogen 3.219 N/A ARG 59.A NH1 GLN 73.A OE1 no hydrogen 2.939 N/A ARG 59.A NH2 GLN 73.A OE1 no hydrogen 2.858 N/A SER 60.A N GLU 57.A O no hydrogen 3.291 N/A SER 60.A OG GLU 57.A OE1 no hydrogen 2.573 N/A TYR 61.A N GLY 65.A O no hydrogen 2.796 N/A CYS 63.A SG GLY 90.A O no hydrogen 3.478 N/A ARG 64.A N TYR 61.A O no hydrogen 2.898 N/A ARG 64.A NE.A CYS 63.A O no hydrogen 3.454 N/A PHE 67.A N SER 60.A OG no hydrogen 2.979 N/A ALA 71.A N PHE 67.A O no hydrogen 2.971 N/A LEU 72.A N PRO 68.A O no hydrogen 2.905 N/A GLN 73.A N LEU 69.A O no hydrogen 2.971 N/A TYR 74.A N TYR 70.A O no hydrogen 2.873 N/A TYR 74.A OH GLU 52.A OE2 no hydrogen 2.691 N/A VAL 75.A N ALA 71.A O no hydrogen 3.093 N/A ALA 76.A N LEU 72.A O no hydrogen 3.080 N/A ASN 77.A N GLN 73.A O no hydrogen 2.961 N/A ASN 77.A N TYR 74.A O no hydrogen 3.133 N/A SER 78.A N TYR 74.A O no hydrogen 2.694 N/A GLY 79.A N VAL 75.A O no hydrogen 3.005 N/A ILE 80.A N VAL 105.A O no hydrogen 2.844 N/A HIS 81.A N GLU 52.A OE1 no hydrogen 2.963 N/A HIS 81.A ND1 GLU 52.A OE1 no hydrogen 2.726 N/A ARG 83.A N SER 47.A O no hydrogen 2.780 N/A TYR 85.A N LEU 82.A O no hydrogen 3.052 N/A TYR 86.A N ARG 83.A O no hydrogen 2.955 N/A TYR 86.A OH ASP 55.A OD2 no hydrogen 2.646 N/A TYR 88.A OH GLN 19.A O no hydrogen 2.614 N/A TYR 88.A OH SER 24.A OG no hydrogen 2.725 N/A GLU 89.A N.A GLN 51.A OE1 no hydrogen 2.709 N/A GLU 89.A N.B GLN 51.A OE1 no hydrogen 2.711 N/A ARG 93.A N ASP 55.A OD1 no hydrogen 2.906 N/A ARG 96.A N TYR 86.A OH no hydrogen 3.014 N/A ARG 96.A NE.A GLN 94.A O no hydrogen 3.027 N/A ARG 96.A NH1.A GLU 89.A OE2.A no hydrogen 2.775 N/A ARG 96.A NH1.B GLN 99.A OE1.A no hydrogen 2.840 N/A ARG 96.A NH2.A ASP 55.A OD2 no hydrogen 2.650 N/A ARG 96.A NH2.A GLU 89.A OE2.A no hydrogen 2.746 N/A SER 98.A OG GLN 99.A OE1.B no hydrogen 3.118 N/A GLN 99.A N ARG 96.A O no hydrogen 3.106 N/A ALA 100.A N ALA 97.A O no hydrogen 3.198 N/A LYS 104.A NZ SER 78.A O no hydrogen 2.784 N/A VAL 105.A N ILE 80.A O no hydrogen 2.835 N/A LYS 106.A NZ ALA 76.A O no hydrogen 2.798 N/A LYS 106.A NZ THR 107.A O no hydrogen 2.697 N/A THR 107.A N VAL 75.A O no hydrogen 3.499 N/A ASP 108.A N THR 210.A O no hydrogen 2.763 N/A GLY 109.A N THR 210.A O no hydrogen 3.233 N/A GLY 111.A N PHE 208.A O no hydrogen 2.761 N/A ARG 112.A NE ASP 205.A OD1 no hydrogen 3.394 N/A VAL 113.A N SER 206.A O no hydrogen 2.950 N/A ASN 116.A N LEU 203.A O no hydrogen 2.964 N/A ALA 120.A N ASN 117.A OD1 no hydrogen 3.066 N/A LEU 121.A N ASN 117.A O no hydrogen 3.194 N/A ILE 122.A N GLU 118.A O no hydrogen 2.982 N/A GLN 123.A N GLN 119.A O no hydrogen 2.861 N/A GLN 123.A NE2.A GLN 119.A OE1 no hydrogen 3.258 N/A GLN 123.A NE2.B GLN 119.A OE1 no hydrogen 3.053 N/A ARG 124.A N ALA 120.A O no hydrogen 3.090 N/A ARG 124.A NH1 GLN 128.A OE1 no hydrogen 2.966 N/A ILE 125.A N LEU 121.A O no hydrogen 2.881 N/A ALA 126.A N ILE 122.A O no hydrogen 2.942 N/A ILE 127.A N ARG 124.A O no hydrogen 2.807 N/A GLN 128.A N ARG 124.A O no hydrogen 3.002 N/A GLN 128.A NE2 PRO 209.A O no hydrogen 2.821 N/A VAL 130.A N ALA 163.A O no hydrogen 2.968 N/A SER 131.A N VAL 207.A O no hydrogen 2.883 N/A SER 131.A OG SER 29.A OG no hydrogen 2.799 N/A ILE 132.A N VAL 161.A O no hydrogen 2.836 N/A VAL 134.A N HIS 159.A O no hydrogen 2.918 N/A GLU 135.A N CYS 200.A O no hydrogen 2.820 N/A ALA 136.A N ASP 158.A OD1 no hydrogen 2.728 N/A GLN 142.A N GLY 138.A O no hydrogen 2.932 N/A ASN 143.A N ARG 139.A O no hydrogen 2.846 N/A TYR 144.A N PHE 141.A O no hydrogen 3.141 N/A TYR 144.A OH GLY 147.A O no hydrogen 2.636 N/A GLY 147.A N GLU 183.A OE2 no hydrogen 2.942 N/A PHE 149.A N ARG 188.A O no hydrogen 2.828 N/A SER 156.A N GLU 135.A OE1 no hydrogen 2.791 N/A ILE 157.A N THR 155.A O no hydrogen 2.961 N/A ASP 158.A N VAL 134.A O no hydrogen 2.943 N/A HIS 159.A NE2 ASN 175.A OD1 no hydrogen 2.668 N/A VAL 161.A N ILE 132.A O no hydrogen 3.002 N/A ALA 162.A N LYS 174.A O no hydrogen 3.205 N/A ALA 163.A N VAL 130.A O no hydrogen 2.762 N/A VAL 164.A N LEU 172.A O no hydrogen 2.848 N/A TYR 166.A N ILE 5.A O no hydrogen 3.021 N/A TYR 166.A OH PRO 2.A O no hydrogen 2.777 N/A GLY 167.A N TYR 170.A O no hydrogen 2.980 N/A TYR 170.A N GLY 167.A O no hydrogen 3.374 N/A ILE 171.A N ILE 189.A O no hydrogen 2.803 N/A LEU 172.A N GLY 165.A O no hydrogen 2.841 N/A ILE 173.A N ILE 187.A O no hydrogen 2.855 N/A LYS 174.A N ALA 162.A O no hydrogen 2.765 N/A LYS 174.A NZ THR 14.A O no hydrogen 2.921 N/A LYS 174.A NZ PRO 15.A O no hydrogen 3.150 N/A ASN 175.A N GLY 185.A O no hydrogen 3.091 N/A SER 176.A N ASN 175.A OD1 no hydrogen 2.783 N/A SER 176.A OG GLN 19.A OE1 no hydrogen 2.614 N/A GLY 178.A N ARG 17.A O no hydrogen 2.926 N/A TRP 181.A NE1 PHE 141.A O no hydrogen 3.188 N/A TRP 181.A NE1 GLN 142.A O no hydrogen 3.099 N/A GLY 182.A N TYR 144.A O no hydrogen 3.245 N/A GLU 183.A N TYR 186.A O no hydrogen 2.830 N/A GLY 185.A N TRP 181.A O no hydrogen 2.746 N/A TYR 186.A N GLU 183.A O no hydrogen 2.995 N/A ILE 187.A N ILE 173.A O no hydrogen 2.920 N/A ARG 188.A N TYR 144.A OH no hydrogen 3.322 N/A ARG 188.A NH1 GLU 183.A OE1 no hydrogen 2.845 N/A ARG 188.A NH2 TYR 170.A OH no hydrogen 3.351 N/A ILE 189.A N ILE 171.A O no hydrogen 2.925 N/A LYS 190.A N PHE 149.A O no hydrogen 2.941 N/A LYS 190.A NZ ASP 169.A OD1 no hydrogen 3.111 N/A LYS 190.A NZ ARG 191.A O no hydrogen 3.091 N/A ARG 191.A N ASP 169.A O no hydrogen 3.172 N/A ARG 191.A NE GLU 118.A OE2 no hydrogen 2.921 N/A ARG 191.A NH1 GLY 167.A O no hydrogen 2.802 N/A ARG 191.A NH2 GLU 118.A OE2 no hydrogen 3.548 N/A GLY 192.A N GLU 118.A OE1 no hydrogen 2.551 N/A ASN 195.A N SER 193.A OG no hydrogen 2.869 N/A ASN 195.A ND2 GLY 198.A O no hydrogen 3.306 N/A GLY 198.A N ASN 195.A O no hydrogen 2.883 N/A GLY 201.A N GLY 198.A O no hydrogen 3.067 N/A VAL 202.A N ALA 199.A O no hydrogen 3.079 N/A LEU 203.A N GLN 197.A O no hydrogen 2.833 N/A SER 204.A N GLY 201.A O no hydrogen 2.921 N/A SER 204.A OG GLN 197.A OE1.B no hydrogen 2.665 N/A SER 204.A OG GLY 201.A O no hydrogen 2.753 N/A VAL 207.A N SER 131.A O no hydrogen 2.876 N/A PHE 208.A N GLY 111.A O no hydrogen 2.967 N/A THR 210.A N GLY 109.A O no hydrogen 2.944 N/A LYS 211.A NZ LYS 106.A O no hydrogen 2.787 N/A ASN 212.A N ASP 108.A OD2 no hydrogen 2.894 N/A