Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4agu_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 1.A N ASP 24.A OD2 no hydrogen 2.739 N/A LYS 2.A NZ TYR 3.A O no hydrogen 3.262 N/A TYR 3.A OH GLU 66.A OE1 no hydrogen 2.611 N/A GLU 4.A N ARG 21.A O no hydrogen 2.979 N/A ILE 6.A N LYS 19.A O no hydrogen 2.735 N/A GLY 7.A N LYS 19.A O no hydrogen 3.347 N/A ILE 9.A N VAL 17.A O no hydrogen 2.792 N/A GLY 10.A N VAL 17.A O no hydrogen 3.372 N/A GLY 12.A N GLY 15.A O no hydrogen 2.723 N/A TYR 14.A OH GLU 49.A OE1 no hydrogen 2.952 N/A TYR 14.A OH ASP 142.A OD1 no hydrogen 3.361 N/A VAL 16.A N LYS 33.A O no hydrogen 2.879 N/A VAL 17.A N GLY 10.A O no hydrogen 2.883 N/A PHE 18.A N ILE 31.A O no hydrogen 2.827 N/A LYS 19.A N GLY 7.A O no hydrogen 2.807 N/A LYS 19.A NZ TYR 80.A OH no hydrogen 3.474 N/A CYS 20.A N VAL 29.A O no hydrogen 2.821 N/A ARG 21.A N GLU 4.A O no hydrogen 3.029 N/A ASN 22.A N GLN 27.A O no hydrogen 2.854 N/A ARG 23.A N LYS 2.A O no hydrogen 2.697 N/A ASP 24.A N ASN 22.A OD1 no hydrogen 2.921 N/A THR 25.A N ASN 22.A O no hydrogen 3.302 N/A THR 25.A N ASN 22.A OD1 no hydrogen 3.125 N/A GLY 26.A N ASN 22.A O no hydrogen 2.696 N/A GLN 27.A N THR 25.A OG1 no hydrogen 3.268 N/A VAL 29.A N CYS 20.A O no hydrogen 2.974 N/A ALA 30.A N PHE 78.A O no hydrogen 2.975 N/A ILE 31.A N PHE 18.A O no hydrogen 2.880 N/A LYS 32.A N LEU 76.A O no hydrogen 2.865 N/A LYS 32.A NZ TYR 14.A OH no hydrogen 2.796 N/A LYS 32.A NZ GLU 49.A OE1 no hydrogen 3.369 N/A LYS 32.A NZ GLU 49.A OE2 no hydrogen 2.668 N/A LYS 33.A N VAL 16.A O no hydrogen 2.704 N/A PHE 34.A N LEU 74.A O no hydrogen 2.903 N/A LEU 35.A N TYR 14.A O no hydrogen 3.118 N/A ASP 39.A N ASP 39.A OD1 no hydrogen 2.707 N/A LYS 44.A N PRO 40.A O no hydrogen 2.908 N/A ILE 45.A N VAL 41.A O no hydrogen 3.155 N/A ALA 46.A N ILE 42.A O no hydrogen 2.913 N/A LEU 47.A N LYS 43.A O no hydrogen 3.038 N/A ARG 48.A N LYS 44.A O no hydrogen 3.018 N/A ARG 48.A NE GLY 144.A O no hydrogen 2.703 N/A GLU 49.A N ILE 45.A O no hydrogen 2.869 N/A ILE 50.A N ALA 46.A O no hydrogen 2.846 N/A ARG 51.A N LEU 47.A O no hydrogen 2.902 N/A MET 52.A N ARG 48.A O no hydrogen 2.914 N/A LEU 53.A N GLU 49.A O no hydrogen 2.924 N/A LYS 54.A N ILE 50.A O no hydrogen 2.876 N/A GLN 55.A N ARG 51.A O no hydrogen 3.173 N/A LEU 56.A N MET 52.A O no hydrogen 2.885 N/A LYS 57.A NZ LEU 53.A O no hydrogen 3.407 N/A LYS 57.A NZ ASN 63.A OD1 no hydrogen 2.851 N/A ASN 60.A N HIS 58.A ND1 no hydrogen 3.074 N/A ASN 60.A ND2 GLN 107.A OE1 no hydrogen 2.981 N/A ASN 60.A ND2 ILE 138.A O no hydrogen 3.060 N/A LEU 61.A N HIS 58.A O no hydrogen 3.112 N/A VAL 62.A N LEU 140.A O no hydrogen 2.874 N/A ASN 63.A N GLU 79.A OE2 no hydrogen 2.779 N/A LEU 65.A N VAL 77.A O no hydrogen 2.662 N/A GLU 66.A N VAL 77.A O no hydrogen 3.289 N/A PHE 68.A N HIS 75.A O no hydrogen 3.034 N/A ARG 70.A N ARG 73.A O no hydrogen 2.816 N/A ARG 73.A N ARG 70.A O no hydrogen 3.209 N/A HIS 75.A N PHE 68.A O no hydrogen 2.685 N/A LEU 76.A N LYS 32.A O no hydrogen 3.072 N/A VAL 77.A N GLU 66.A O no hydrogen 2.809 N/A PHE 78.A N ALA 30.A O no hydrogen 2.814 N/A GLU 79.A N ASN 63.A O no hydrogen 3.079 N/A HIS 83.A N ILE 132.A O no hydrogen 3.201 N/A HIS 83.A ND1 ASP 82.A OD2 no hydrogen 3.049 N/A THR 84.A OG1 HIS 87.A ND1 no hydrogen 2.697 N/A VAL 85.A N ILE 130.A O no hydrogen 2.925 N/A HIS 87.A N THR 84.A O no hydrogen 3.192 N/A HIS 87.A N THR 84.A OG1 no hydrogen 3.355 N/A HIS 87.A ND1 THR 84.A OG1 no hydrogen 2.697 N/A GLU 88.A N THR 84.A O no hydrogen 3.304 N/A LEU 89.A N VAL 85.A O no hydrogen 3.014 N/A ASP 90.A N HIS 87.A O no hydrogen 3.234 N/A ARG 91.A N HIS 87.A O no hydrogen 3.069 N/A TYR 92.A N GLU 88.A O no hydrogen 3.180 N/A GLY 95.A N TYR 92.A O no hydrogen 3.129 N/A VAL 96.A N LEU 181.A O no hydrogen 3.349 N/A LEU 100.A N PRO 97.A O no hydrogen 2.897 N/A VAL 101.A N PRO 97.A O no hydrogen 2.933 N/A LYS 102.A N GLU 98.A O no hydrogen 2.880 N/A LYS 102.A NZ TYR 272.A O no hydrogen 3.085 N/A SER 103.A N HIS 99.A O no hydrogen 3.071 N/A ILE 104.A N LEU 100.A O no hydrogen 3.009 N/A THR 105.A N VAL 101.A O no hydrogen 3.120 N/A THR 105.A OG1 VAL 101.A O no hydrogen 2.649 N/A TRP 106.A N LYS 102.A O no hydrogen 3.020 N/A GLN 107.A N SER 103.A O no hydrogen 3.103 N/A GLN 107.A NE2 SER 103.A O no hydrogen 3.424 N/A GLN 107.A NE2 SER 103.A OG no hydrogen 2.955 N/A GLN 107.A NE2 SER 136.A O no hydrogen 3.105 N/A THR 108.A N ILE 104.A O no hydrogen 3.022 N/A THR 108.A OG1 ILE 104.A O no hydrogen 2.670 N/A LEU 109.A N THR 105.A O no hydrogen 3.001 N/A GLN 110.A N TRP 106.A O no hydrogen 3.101 N/A ALA 111.A N GLN 107.A O no hydrogen 3.085 N/A VAL 112.A N THR 108.A O no hydrogen 2.934 N/A ASN 113.A N LEU 109.A O no hydrogen 2.824 N/A PHE 114.A N GLN 110.A O no hydrogen 3.047 N/A CYS 115.A N ALA 111.A O no hydrogen 3.235 N/A CYS 115.A SG ALA 111.A O no hydrogen 3.421 N/A HIS 116.A N VAL 112.A O no hydrogen 2.999 N/A HIS 116.A NE2 ASP 170.A OD2 no hydrogen 2.673 N/A LYS 117.A N ASN 113.A O no hydrogen 2.876 N/A HIS 118.A N CYS 115.A O no hydrogen 2.903 N/A HIS 118.A ND1 PHE 114.A O no hydrogen 2.943 N/A CYS 120.A N CYS 115.A O no hydrogen 2.934 N/A ILE 121.A N ARG 147.A O no hydrogen 2.806 N/A HIS 122.A N ASP 170.A OD2 no hydrogen 3.025 N/A HIS 122.A NE2 CYS 141.A O no hydrogen 2.829 N/A ARG 123.A N ASP 170.A OD1 no hydrogen 2.924 N/A ASP 124.A N HIS 122.A ND1 no hydrogen 2.901 N/A LYS 126.A NZ GLU 128.A OE2 no hydrogen 3.526 N/A LYS 126.A NZ THR 150.A OG1 no hydrogen 2.994 N/A ASN 129.A N LYS 126.A O no hydrogen 3.080 N/A ASN 129.A ND2 ASP 124.A O no hydrogen 2.760 N/A ASN 129.A ND2 ASP 124.A OD2 no hydrogen 3.192 N/A ASN 129.A ND2 ASP 142.A OD2 no hydrogen 3.193 N/A ILE 130.A N PRO 127.A O no hydrogen 3.209 N/A LEU 131.A N LYS 139.A O no hydrogen 2.823 N/A ILE 132.A N HIS 83.A O no hydrogen 2.749 N/A THR 133.A N VAL 137.A O no hydrogen 2.826 N/A HIS 135.A N THR 133.A OG1 no hydrogen 3.224 N/A SER 136.A N THR 133.A O no hydrogen 3.144 N/A VAL 137.A N THR 133.A OG1 no hydrogen 3.155 N/A ILE 138.A N GLN 107.A OE1 no hydrogen 2.846 N/A LYS 139.A N LEU 131.A O no hydrogen 2.738 N/A LYS 139.A NZ PRO 59.A O no hydrogen 2.775 N/A LEU 140.A N ASN 60.A O no hydrogen 2.781 N/A CYS 141.A N ASN 129.A O no hydrogen 2.965 N/A CYS 141.A SG ASN 129.A O no hydrogen 3.636 N/A ALA 146.A N PHE 143.A O no hydrogen 3.145 N/A ARG 147.A N ILE 121.A O no hydrogen 2.844 N/A ARG 151.A NE GLY 190.A O no hydrogen 3.373 N/A ARG 151.A NH1 ASP 193.A OD1 no hydrogen 2.759 N/A TRP 152.A NE1 GLY 190.A O no hydrogen 3.166 N/A TYR 153.A N THR 150.A O no hydrogen 3.319 N/A TYR 153.A OH GLU 180.A OE1 no hydrogen 2.554 N/A ARG 154.A N ARG 151.A O no hydrogen 3.036 N/A ARG 154.A NH2 LEU 158.A O no hydrogen 3.109 N/A GLU 157.A N GLU 157.A OE1 no hydrogen 2.736 N/A LEU 159.A N SER 155.A O no hydrogen 3.093 N/A VAL 160.A N PRO 156.A O no hydrogen 2.917 N/A ASP 162.A N GLU 157.A O no hydrogen 2.929 N/A GLN 164.A N ASP 162.A OD1 no hydrogen 2.963 N/A VAL 169.A N GLY 166.A O no hydrogen 3.118 N/A ASP 170.A N PRO 167.A O no hydrogen 3.049 N/A TRP 172.A N PRO 168.A O no hydrogen 3.167 N/A ALA 173.A N VAL 169.A O no hydrogen 3.282 N/A ILE 174.A N ASP 170.A O no hydrogen 2.936 N/A GLY 175.A N VAL 171.A O no hydrogen 2.950 N/A CYS 176.A N TRP 172.A O no hydrogen 2.982 N/A CYS 176.A SG TRP 152.A O no hydrogen 3.863 N/A CYS 176.A SG TRP 172.A O no hydrogen 3.477 N/A VAL 177.A N ALA 173.A O no hydrogen 2.911 N/A PHE 178.A N ILE 174.A O no hydrogen 2.770 N/A ALA 179.A N GLY 175.A O no hydrogen 2.989 N/A GLU 180.A N CYS 176.A O no hydrogen 3.097 N/A LEU 181.A N VAL 177.A O no hydrogen 2.821 N/A LEU 182.A N PHE 178.A O no hydrogen 3.062 N/A SER 183.A N ALA 179.A O no hydrogen 3.053 N/A SER 183.A OG ALA 179.A O no hydrogen 3.072 N/A SER 183.A OG VAL 185.A O no hydrogen 3.116 N/A GLY 184.A N GLU 180.A O no hydrogen 2.745 N/A VAL 185.A N SER 183.A OG no hydrogen 3.425 N/A TRP 188.A NE1 THR 203.A OG1 no hydrogen 2.886 N/A GLY 190.A N TRP 188.A O no hydrogen 3.101 N/A GLY 190.A N GLN 196.A OE1 no hydrogen 2.893 N/A LYS 191.A N ASP 195.A OD2 no hydrogen 2.728 N/A ASP 195.A N SER 192.A OG no hydrogen 3.110 N/A GLN 196.A N SER 192.A O no hydrogen 2.673 N/A GLN 196.A NE2 TRP 188.A O no hydrogen 2.822 N/A LEU 197.A N ASP 193.A O no hydrogen 2.977 N/A TYR 198.A N VAL 194.A O no hydrogen 2.972 N/A LEU 199.A N ASP 195.A O no hydrogen 2.872 N/A ILE 200.A N GLN 196.A O no hydrogen 2.942 N/A ARG 201.A N LEU 197.A O no hydrogen 2.989 N/A LYS 202.A N TYR 198.A O no hydrogen 2.984 N/A THR 203.A N ILE 200.A O no hydrogen 3.177 N/A THR 203.A OG1 LEU 199.A O no hydrogen 3.125 N/A THR 203.A OG1 GLU 233.A O no hydrogen 3.490 N/A LEU 204.A N ILE 200.A O no hydrogen 2.865 N/A GLY 205.A N ARG 201.A O no hydrogen 2.918 N/A ARG 210.A NE ASP 162.A OD2 no hydrogen 2.729 N/A ARG 210.A NH2 ASP 162.A OD1 no hydrogen 2.963 N/A ARG 210.A NH2 ASP 162.A OD2 no hydrogen 3.493 N/A GLN 212.A N ILE 208.A O no hydrogen 3.100 N/A GLN 213.A N PRO 209.A O no hydrogen 3.028 N/A VAL 214.A N ARG 210.A O no hydrogen 2.945 N/A PHE 215.A N HIS 211.A O no hydrogen 3.037 N/A SER 216.A N GLN 212.A O no hydrogen 3.052 N/A SER 216.A OG GLN 212.A O no hydrogen 3.034 N/A THR 217.A N VAL 214.A O no hydrogen 3.152 N/A THR 217.A OG1 GLN 213.A O no hydrogen 2.727 N/A THR 217.A OG1 VAL 214.A O no hydrogen 3.095 N/A ASN 218.A N PHE 215.A O no hydrogen 3.217 N/A ASN 218.A ND2 VAL 160.A O no hydrogen 3.045 N/A TYR 220.A N ASN 218.A OD1 no hydrogen 3.353 N/A PHE 221.A N ASN 218.A O no hydrogen 3.259 N/A SER 222.A N GLN 219.A O no hydrogen 3.054 N/A VAL 224.A N PHE 221.A O no hydrogen 2.928 N/A LYS 225.A NZ ILE 226.A O no hydrogen 3.306 N/A GLU 233.A N LYS 202.A O no hydrogen 2.718 N/A GLU 236.A N GLU 236.A OE1 no hydrogen 2.783 N/A LEU 237.A N PRO 234.A O no hydrogen 3.076 N/A LYS 238.A N PRO 234.A O no hydrogen 3.174 N/A LYS 238.A NZ THR 203.A OG1 no hydrogen 2.780 N/A LYS 238.A NZ GLU 233.A O no hydrogen 3.021 N/A LYS 238.A NZ GLU 233.A OE2 no hydrogen 2.813 N/A PHE 239.A N LEU 235.A O no hydrogen 2.834 N/A LEU 247.A N SER 243.A O no hydrogen 3.067 N/A GLY 248.A N TYR 244.A O no hydrogen 3.075 N/A LEU 249.A N PRO 245.A O no hydrogen 3.065 N/A LEU 250.A N ALA 246.A O no hydrogen 3.071 N/A LYS 251.A N LEU 247.A O no hydrogen 2.815 N/A GLY 252.A N GLY 248.A O no hydrogen 2.884 N/A CYS 253.A N LEU 249.A O no hydrogen 3.128 N/A CYS 253.A N LEU 250.A O no hydrogen 3.205 N/A CYS 253.A SG LEU 249.A O no hydrogen 3.278 N/A LEU 254.A N LEU 250.A O no hydrogen 3.088 N/A THR 259.A N ASP 257.A OD1 no hydrogen 3.034 N/A THR 259.A OG1 ASP 257.A OD1 no hydrogen 2.852 N/A GLU 260.A N ASP 257.A O no hydrogen 3.098 N/A ARG 261.A NE HIS 255.A O no hydrogen 2.818 N/A ARG 261.A NH1 GLU 157.A OE1 no hydrogen 3.550 N/A ARG 261.A NH1 GLU 157.A OE2 no hydrogen 2.758 N/A ARG 261.A NH1 PRO 168.A O no hydrogen 2.927 N/A ARG 261.A NH2 GLU 157.A OE1 no hydrogen 2.798 N/A ARG 261.A NH2 GLU 157.A OE2 no hydrogen 3.559 N/A ARG 261.A NH2 HIS 255.A O no hydrogen 3.205 N/A ARG 261.A NH2 MET 256.A O no hydrogen 3.151 N/A LEU 262.A N GLY 252.A O no hydrogen 2.950 N/A THR 263.A N GLN 266.A OE1 no hydrogen 3.012 N/A THR 263.A OG1 GLN 266.A OE1 no hydrogen 3.436 N/A CYS 264.A SG HIS 116.A ND1 no hydrogen 3.831 N/A GLN 266.A N THR 263.A OG1 no hydrogen 3.319 N/A LEU 267.A N THR 263.A O no hydrogen 2.963 N/A LEU 268.A N CYS 264.A O no hydrogen 2.897 N/A HIS 269.A N GLN 266.A O no hydrogen 3.091 N/A HIS 270.A N LEU 267.A O no hydrogen 3.161 N/A TYR 272.A N HIS 270.A ND1 no hydrogen 2.956 N/A PHE 273.A N HIS 270.A O no hydrogen 2.919 N/A GLU 274.A N PRO 271.A O no hydrogen 3.165 N/A