Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3qre_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 5.A N THR 17.A O no hydrogen 2.836 N/A GLU 7.A N ILE 15.A O no hydrogen 2.976 N/A THR 9.A N VAL 13.A O no hydrogen 2.892 N/A THR 9.A OG1 VAL 13.A O no hydrogen 3.569 N/A THR 9.A OG1 GLU 174.A OE1 no hydrogen 3.113 N/A GLY 12.A N THR 9.A O no hydrogen 3.154 N/A VAL 13.A N THR 9.A OG1 no hydrogen 3.174 N/A ALA 14.A N VAL 50.A O no hydrogen 2.837 N/A ILE 15.A N GLU 7.A O no hydrogen 2.607 N/A ILE 16.A N VAL 52.A O no hydrogen 2.748 N/A THR 17.A N LEU 5.A O no hydrogen 2.993 N/A PHE 18.A N THR 54.A O no hydrogen 2.845 N/A ASN 19.A N ALA 3.A O no hydrogen 2.793 N/A ASN 19.A ND2 ASP 2.A O no hydrogen 2.918 N/A ARG 20.A N ASN 25.A OD1 no hydrogen 2.758 N/A ARG 20.A NE ASP 30.A OD1 no hydrogen 2.891 N/A ARG 20.A NH1 GLN 1.A O no hydrogen 2.954 N/A ARG 20.A NH1 ASN 19.A O no hydrogen 3.536 N/A ARG 20.A NH2 ASP 30.A OD1 no hydrogen 3.388 N/A ARG 23.A N ARG 20.A O no hydrogen 3.125 N/A ARG 23.A NH1 TRP 27.A O no hydrogen 3.352 N/A ARG 23.A NH2 ASP 30.A OD2 no hydrogen 2.713 N/A LEU 24.A N ALA 21.A O no hydrogen 2.823 N/A ASN 25.A N ARG 20.A O no hydrogen 2.970 N/A ASN 25.A ND2 ARG 56.A O no hydrogen 3.197 N/A ASN 25.A ND2 GLY 59.A O no hydrogen 2.994 N/A ASN 25.A ND2 PHE 60.A O no hydrogen 3.442 N/A ALA 26.A N ARG 23.A O no hydrogen 3.140 N/A TRP 27.A N GLY 63.A O no hydrogen 2.765 N/A LEU 31.A N ASP 30.A OD2 no hydrogen 2.813 N/A ALA 32.A N GLY 28.A O no hydrogen 2.783 N/A ALA 33.A N PRO 29.A O no hydrogen 2.985 N/A GLY 34.A N ASP 30.A O no hydrogen 3.052 N/A PHE 35.A N LEU 31.A O no hydrogen 2.941 N/A TYR 36.A N ALA 32.A O no hydrogen 2.849 N/A ALA 37.A N ALA 33.A O no hydrogen 3.124 N/A ALA 38.A N GLY 34.A O no hydrogen 2.825 N/A ILE 39.A N PHE 35.A O no hydrogen 2.862 N/A ASP 40.A N TYR 36.A O no hydrogen 2.837 N/A ARG 41.A N ALA 37.A O no hydrogen 2.996 N/A ALA 42.A N ALA 38.A O no hydrogen 3.033 N/A GLU 43.A N ILE 39.A O no hydrogen 2.832 N/A ALA 44.A N ASP 40.A O no hydrogen 2.862 N/A ASP 45.A N ARG 41.A O no hydrogen 3.091 N/A ASP 45.A N ALA 42.A O no hydrogen 3.359 N/A GLY 47.A N ASP 45.A OD1 no hydrogen 2.853 N/A ILE 48.A N ASP 45.A O no hydrogen 2.845 N/A ARG 49.A N GLY 12.A O no hydrogen 2.764 N/A ARG 49.A NH1 ALA 177.A O no hydrogen 2.756 N/A ARG 49.A NH1 CYS 180.A O no hydrogen 3.377 N/A ARG 49.A NH2 CYS 180.A O no hydrogen 2.677 N/A VAL 50.A N GLY 12.A O no hydrogen 3.256 N/A ILE 51.A N PRO 76.A O no hydrogen 3.055 N/A VAL 52.A N ALA 14.A O no hydrogen 2.709 N/A LEU 53.A N ILE 78.A O no hydrogen 2.799 N/A THR 54.A N ILE 16.A O no hydrogen 2.906 N/A THR 54.A OG1 ALA 80.A O no hydrogen 3.028 N/A THR 54.A OG1 ASN 82.A OD1 no hydrogen 3.364 N/A GLY 55.A N ASN 82.A OD1 no hydrogen 3.143 N/A ARG 56.A N PHE 18.A O no hydrogen 2.832 N/A PHE 60.A N PRO 84.A O no hydrogen 3.222 N/A CYS 61.A N PRO 84.A O no hydrogen 3.092 N/A CYS 61.A SG ASN 25.A O no hydrogen 3.222 N/A ALA 62.A N LEU 24.A O no hydrogen 3.057 N/A GLY 63.A N VAL 86.A O no hydrogen 2.871 N/A ARG 65.A NH1 ASP 40.A OD1 no hydrogen 3.369 N/A ARG 65.A NH1 ASP 40.A OD2 no hydrogen 2.566 N/A ARG 65.A NH2 ASP 40.A OD1 no hydrogen 2.626 N/A HIS 68.A N HIS 68.A ND1 no hydrogen 2.836 N/A PHE 69.A N PRO 66.A O no hydrogen 3.243 N/A THR 71.A N HIS 68.A O no hydrogen 2.937 N/A THR 71.A OG1 HIS 68.A O no hydrogen 2.756 N/A MET 72.A N PHE 69.A O no hydrogen 2.907 N/A LEU 73.A N VAL 70.A O no hydrogen 3.349 N/A ARG 74.A N GLU 43.A OE2 no hydrogen 2.735 N/A ARG 74.A NH2 GLU 43.A O no hydrogen 2.909 N/A LYS 75.A NZ ALA 42.A O no hydrogen 3.101 N/A LYS 75.A NZ GLU 43.A O no hydrogen 3.436 N/A LYS 75.A NZ ILE 48.A O no hydrogen 2.581 N/A VAL 77.A N ASP 97.A OD2 no hydrogen 2.602 N/A ILE 78.A N ILE 51.A O no hydrogen 2.784 N/A ALA 79.A N VAL 98.A O no hydrogen 2.765 N/A ALA 80.A N LEU 53.A O no hydrogen 2.817 N/A ILE 81.A N PHE 100.A O no hydrogen 2.695 N/A ASN 82.A ND2 GLY 57.A O no hydrogen 3.197 N/A CYS 85.A N LYS 106.A O no hydrogen 2.707 N/A CYS 85.A SG GLY 89.A O no hydrogen 3.465 N/A VAL 86.A N CYS 61.A O no hydrogen 3.034 N/A GLY 87.A N ALA 108.A O no hydrogen 3.222 N/A GLY 89.A N VAL 86.A O no hydrogen 2.983 N/A LEU 90.A N GLY 87.A O no hydrogen 2.828 N/A THR 91.A N GLY 87.A O no hydrogen 3.112 N/A GLN 92.A N ILE 88.A O no hydrogen 2.830 N/A ALA 93.A N GLY 89.A O no hydrogen 3.141 N/A LEU 94.A N LEU 90.A O no hydrogen 2.922 N/A MET 95.A N THR 91.A O no hydrogen 3.049 N/A MET 95.A N GLN 92.A O no hydrogen 3.283 N/A CYS 96.A N ALA 93.A O no hydrogen 3.058 N/A CYS 96.A SG GLN 92.A O no hydrogen 3.361 N/A ASP 97.A N VAL 77.A O no hydrogen 2.881 N/A VAL 98.A N VAL 77.A O no hydrogen 3.279 N/A ARG 99.A NE LEU 155.A O no hydrogen 2.838 N/A ARG 99.A NH1 ALA 93.A O no hydrogen 3.028 N/A ARG 99.A NH1 CYS 96.A O no hydrogen 2.700 N/A PHE 100.A N ALA 79.A O no hydrogen 2.768 N/A ALA 101.A N GLU 158.A O no hydrogen 3.127 N/A ALA 102.A N ILE 81.A O no hydrogen 2.886 N/A ALA 103.A N VAL 160.A O no hydrogen 2.752 N/A ALA 105.A N ALA 102.A O no hydrogen 3.092 N/A PHE 107.A N PHE 145.A O no hydrogen 2.707 N/A ALA 108.A N CYS 85.A O no hydrogen 3.180 N/A LEU 116.A N ALA 112.A O no hydrogen 3.159 N/A ILE 117.A N ARG 113.A O no hydrogen 2.961 N/A GLY 121.A N ALA 118.A O no hydrogen 3.235 N/A SER 123.A OG LEU 116.A O no hydrogen 3.428 N/A TRP 124.A N GLY 121.A O no hydrogen 2.987 N/A ILE 125.A N GLY 121.A O no hydrogen 3.050 N/A LEU 126.A N ILE 122.A O no hydrogen 3.011 N/A ARG 128.A NH2 TRP 124.A O no hydrogen 3.203 N/A LEU 129.A N ILE 125.A O no hydrogen 2.944 N/A THR 130.A N LEU 126.A O no hydrogen 3.013 N/A THR 130.A OG1 LEU 126.A O no hydrogen 2.760 N/A SER 131.A N THR 130.A OG1 no hydrogen 2.687 N/A VAL 134.A N SER 131.A OG no hydrogen 3.231 N/A ALA 135.A N SER 131.A O no hydrogen 2.953 N/A LEU 136.A N TRP 132.A O no hydrogen 2.691 N/A ASP 137.A N ALA 133.A O no hydrogen 2.962 N/A LEU 138.A N VAL 134.A O no hydrogen 2.918 N/A LEU 139.A N ALA 135.A O no hydrogen 2.969 N/A LEU 140.A N LEU 136.A O no hydrogen 2.948 N/A SER 141.A N ASP 137.A O no hydrogen 3.013 N/A SER 141.A OG ASP 137.A O no hydrogen 2.640 N/A GLY 142.A N LEU 138.A O no hydrogen 2.905 N/A ARG 143.A N SER 141.A OG no hydrogen 3.107 N/A ARG 143.A NE ASP 137.A OD1 no hydrogen 3.246 N/A ARG 143.A NE ASP 137.A OD2 no hydrogen 3.220 N/A ARG 143.A NH1 GLU 149.A OE1 no hydrogen 3.005 N/A ARG 143.A NH1 GLU 149.A OE2 no hydrogen 3.205 N/A ARG 143.A NH2 ASP 137.A OD2 no hydrogen 2.889 N/A ARG 143.A NH2 GLU 149.A OE1 no hydrogen 2.843 N/A PHE 145.A N PHE 107.A O no hydrogen 2.881 N/A ALA 147.A N ALA 105.A O no hydrogen 2.904 N/A ALA 150.A N LEU 146.A O no hydrogen 2.929 N/A ALA 151.A N ALA 147.A O no hydrogen 2.964 N/A GLN 152.A N GLU 148.A O no hydrogen 3.133 N/A LEU 153.A N GLU 149.A O no hydrogen 2.940 N/A GLY 154.A N ALA 151.A O no hydrogen 2.990 N/A LEU 155.A N ALA 150.A O no hydrogen 2.736 N/A LYS 157.A N ARG 99.A O no hydrogen 2.909 N/A VAL 160.A N ALA 101.A O no hydrogen 2.979 N/A GLN 164.A N THR 161.A O no hydrogen 3.029 N/A GLN 164.A N THR 161.A OG1 no hydrogen 3.288 N/A LEU 165.A N PRO 162.A O no hydrogen 3.296 N/A ARG 168.A N GLN 164.A O no hydrogen 3.128 N/A ARG 168.A NE GLU 158.A OE2 no hydrogen 2.959 N/A ARG 168.A NH1 GLU 171.A OE1 no hydrogen 2.906 N/A ARG 168.A NH2 GLU 158.A OE1 no hydrogen 3.448 N/A ALA 169.A N LEU 165.A O no hydrogen 3.025 N/A LEU 170.A N MET 166.A O no hydrogen 2.881 N/A GLU 171.A N PRO 167.A O no hydrogen 2.777 N/A TYR 172.A N ARG 168.A O no hydrogen 2.972 N/A ALA 173.A N ALA 169.A O no hydrogen 3.003 N/A GLU 174.A N LEU 170.A O no hydrogen 3.027 N/A ASP 175.A N GLU 171.A O no hydrogen 2.780 N/A ILE 176.A N TYR 172.A O no hydrogen 2.912 N/A ALA 177.A N ALA 173.A O no hydrogen 3.061 N/A ARG 178.A N GLU 174.A O no hydrogen 2.951 N/A TYR 179.A N ASP 175.A O no hydrogen 3.019 N/A CYS 180.A N ILE 176.A O no hydrogen 2.909 N/A SER 184.A N SER 181.A OG no hydrogen 3.082 N/A SER 184.A OG SER 181.A OG no hydrogen 3.304 N/A MET 185.A N SER 181.A O no hydrogen 3.015 N/A ALA 186.A N PRO 182.A O no hydrogen 3.170 N/A VAL 187.A N SER 183.A O no hydrogen 3.120 N/A ILE 188.A N SER 184.A O no hydrogen 2.968 N/A LYS 189.A N MET 185.A O no hydrogen 2.956 N/A LYS 189.A NZ VAL 70.A O no hydrogen 2.816 N/A LYS 189.A NZ LYS 75.A O no hydrogen 2.879 N/A LYS 189.A NZ ASP 97.A OD2 no hydrogen 2.741 N/A ARG 190.A N ALA 186.A O no hydrogen 3.044 N/A GLN 191.A N VAL 187.A O no hydrogen 2.640 N/A VAL 192.A N ILE 188.A O no hydrogen 2.807 N/A TYR 193.A N LYS 189.A O no hydrogen 3.090 N/A GLY 194.A N ARG 190.A O no hydrogen 2.911 N/A ALA 196.A N TYR 193.A O no hydrogen 3.324 N/A THR 197.A OG1 GLY 194.A O no hydrogen 3.473 N/A ARG 198.A N ASP 195.A O no hydrogen 3.119 N/A