Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1hvy_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 3.A NE2 ARG 248.A O no hydrogen 2.818 N/A GLU 5.A N HIS 3.A ND1 no hydrogen 2.834 N/A LEU 6.A N HIS 3.A O no hydrogen 3.146 N/A GLN 7.A N GLY 4.A O no hydrogen 3.225 N/A GLN 7.A NE2 GLY 4.A O no hydrogen 3.366 N/A GLN 7.A NE2 ARG 38.A O no hydrogen 2.396 N/A TYR 8.A OH MET 193.A O no hydrogen 2.605 N/A LEU 9.A N GLU 5.A O no hydrogen 3.135 N/A GLY 10.A N LEU 6.A O no hydrogen 2.794 N/A GLN 11.A N GLN 7.A O no hydrogen 2.884 N/A ILE 12.A N TYR 8.A O no hydrogen 3.082 N/A GLN 13.A N LEU 9.A O no hydrogen 2.988 N/A HIS 14.A N GLY 10.A O no hydrogen 2.865 N/A ILE 15.A N GLN 11.A O no hydrogen 3.085 N/A LEU 16.A N ILE 12.A O no hydrogen 2.969 N/A ARG 17.A N GLN 13.A O no hydrogen 2.850 N/A VAL 19.A N SER 31.A O no hydrogen 2.776 N/A LYS 21.A N THR 29.A O no hydrogen 2.802 N/A LYS 21.A NZ ASP 228.A OD2 no hydrogen 3.033 N/A THR 25.A N ASP 23.A OD2 no hydrogen 2.885 N/A THR 25.A OG1 ASP 23.A OD1 no hydrogen 3.248 N/A THR 25.A OG1 ASP 23.A OD2 no hydrogen 2.454 N/A THR 25.A OG1 THR 27.A OG1 no hydrogen 3.086 N/A GLY 26.A N ASP 23.A O no hydrogen 2.790 N/A THR 27.A N THR 25.A OG1 no hydrogen 3.214 N/A THR 27.A OG1 THR 25.A OG1 no hydrogen 3.086 N/A GLY 28.A N ASP 23.A OD1 no hydrogen 2.791 N/A THR 29.A N LYS 21.A O no hydrogen 3.040 N/A THR 29.A OG1 LYS 21.A O no hydrogen 3.035 N/A LEU 30.A N ILE 231.A O no hydrogen 2.953 N/A SER 31.A N VAL 19.A O no hydrogen 2.714 N/A SER 31.A OG ASP 228.A OD1 no hydrogen 2.727 N/A VAL 32.A N ALA 229.A O no hydrogen 2.972 N/A GLY 34.A N GLY 227.A O no hydrogen 2.818 N/A MET 35.A N LEU 226.A O no hydrogen 3.185 N/A GLN 36.A NE2 THR 225.A OG1 no hydrogen 3.102 N/A ALA 37.A N HIS 224.A O no hydrogen 2.896 N/A ARG 38.A N GLN 7.A OE1 no hydrogen 2.862 N/A ARG 38.A NH2 ASP 221.A OD1 no hydrogen 3.253 N/A TYR 39.A N PHE 222.A O no hydrogen 2.773 N/A LEU 41.A N GLY 220.A O no hydrogen 2.810 N/A ARG 42.A N SER 40.A OG no hydrogen 3.246 N/A ARG 42.A NE GLU 181.A OE1 no hydrogen 3.049 N/A ARG 42.A NE GLU 181.A OE2 no hydrogen 3.401 N/A ARG 42.A NH1 SER 40.A OG no hydrogen 3.251 N/A ARG 42.A NH1 ASP 221.A OD2 no hydrogen 2.898 N/A ARG 42.A NH2 GLU 181.A OE1 no hydrogen 3.320 N/A ARG 42.A NH2 ASP 221.A OD1 no hydrogen 3.001 N/A PHE 45.A N PRO 251.A O no hydrogen 2.910 N/A LEU 47.A N PHE 45.A O no hydrogen 2.791 N/A THR 49.A N GLU 5.A OE1 no hydrogen 3.123 N/A THR 49.A N GLU 5.A OE2 no hydrogen 2.877 N/A THR 49.A OG1 GLU 5.A OE2 no hydrogen 2.758 N/A THR 49.A OG1 ARG 248.A O no hydrogen 3.228 N/A THR 50.A N GLU 5.A OE1 no hydrogen 2.860 N/A THR 50.A OG1 GLU 5.A OE1 no hydrogen 2.569 N/A LYS 51.A NZ GLY 194.A O no hydrogen 2.952 N/A VAL 53.A N TYR 275.A OH no hydrogen 2.819 N/A TRP 55.A N VAL 53.A O no hydrogen 2.675 N/A LYS 56.A NZ LYS 78.A O no hydrogen 3.263 N/A VAL 58.A N PHE 54.A O no hydrogen 3.217 N/A LEU 59.A N TRP 55.A O no hydrogen 2.959 N/A GLU 60.A N LYS 56.A O no hydrogen 2.938 N/A GLU 61.A N GLY 57.A O no hydrogen 2.828 N/A LEU 62.A N VAL 58.A O no hydrogen 3.143 N/A LEU 63.A N LEU 59.A O no hydrogen 3.023 N/A TRP 64.A N GLU 60.A O no hydrogen 2.996 N/A TRP 64.A NE1 ASN 71.A O no hydrogen 3.008 N/A PHE 65.A N GLU 61.A O no hydrogen 2.856 N/A ILE 66.A N LEU 62.A O no hydrogen 2.956 N/A LYS 67.A N LEU 63.A O no hydrogen 2.997 N/A GLY 68.A N PHE 65.A O no hydrogen 2.893 N/A SER 69.A N TRP 64.A O no hydrogen 3.360 N/A SER 69.A OG ASN 71.A O no hydrogen 3.526 N/A THR 70.A OG1 TYR 120.A OH no hydrogen 2.800 N/A ASN 71.A N SER 69.A OG no hydrogen 3.091 N/A ALA 72.A N GLY 103.A O no hydrogen 2.726 N/A LYS 73.A N ASN 71.A OD1 no hydrogen 2.758 N/A GLU 74.A N ASN 71.A O no hydrogen 3.030 N/A LEU 75.A N ALA 72.A O no hydrogen 3.067 N/A SER 76.A N ALA 72.A O no hydrogen 2.874 N/A SER 76.A OG ASP 84.A OD1 no hydrogen 3.501 N/A SER 76.A OG ASP 84.A OD2 no hydrogen 2.746 N/A SER 77.A N LYS 73.A O no hydrogen 2.886 N/A SER 77.A OG LYS 73.A O no hydrogen 3.378 N/A SER 77.A OG GLU 74.A O no hydrogen 2.930 N/A LYS 78.A N LEU 75.A O no hydrogen 2.877 N/A GLY 79.A N SER 76.A O no hydrogen 2.860 N/A VAL 80.A N LEU 75.A O no hydrogen 3.424 N/A LYS 81.A NZ SER 76.A O no hydrogen 3.288 N/A LYS 81.A NZ SER 76.A OG no hydrogen 3.127 N/A TRP 83.A NE1 GLU 61.A OE2 no hydrogen 2.931 N/A ASP 84.A N LYS 81.A O no hydrogen 3.233 N/A GLY 87.A N ASP 84.A O no hydrogen 2.893 N/A SER 88.A N ALA 85.A O no hydrogen 3.159 N/A SER 88.A OG ALA 85.A O no hydrogen 2.790 N/A ARG 89.A NE ASP 93.A OD1 no hydrogen 2.844 N/A ARG 89.A NE ASP 93.A OD2 no hydrogen 3.307 N/A ARG 89.A NH1 ARG 100.A O no hydrogen 2.820 N/A ARG 89.A NH2 ASP 93.A OD1 no hydrogen 3.012 N/A ARG 89.A NH2 ARG 100.A O no hydrogen 2.812 N/A PHE 91.A N SER 88.A OG no hydrogen 3.380 N/A LEU 92.A N SER 88.A O no hydrogen 2.847 N/A ASP 93.A N ARG 89.A O no hydrogen 2.772 N/A SER 94.A N ASP 90.A O no hydrogen 2.932 N/A SER 94.A OG PHE 91.A O no hydrogen 2.634 N/A LEU 95.A N LEU 92.A O no hydrogen 3.137 N/A GLY 96.A N ASP 93.A O no hydrogen 2.825 N/A PHE 97.A N LEU 92.A O no hydrogen 2.848 N/A ARG 100.A N PHE 97.A O no hydrogen 2.832 N/A ARG 100.A NH1 LEU 163.A O no hydrogen 2.984 N/A ARG 100.A NH2 LEU 163.A O no hydrogen 2.633 N/A GLY 103.A N GLY 87.A O no hydrogen 2.669 N/A ASP 104.A N GLU 101.A O no hydrogen 3.127 N/A LEU 105.A N THR 70.A O no hydrogen 3.026 N/A GLY 106.A N ASP 104.A OD2 no hydrogen 2.963 N/A VAL 108.A N GLY 106.A O no hydrogen 2.698 N/A GLN 112.A N VAL 108.A O no hydrogen 2.949 N/A GLN 112.A NE2 PRO 107.A O no hydrogen 3.151 N/A GLN 112.A NE2 ASP 160.A OD1 no hydrogen 2.736 N/A TRP 113.A N TYR 109.A O no hydrogen 2.807 N/A ARG 114.A N GLY 110.A O no hydrogen 3.316 N/A ARG 114.A NE ASP 133.A OD1 no hydrogen 2.862 N/A ARG 114.A NE ASP 133.A OD2 no hydrogen 3.372 N/A ARG 114.A NH1 ASP 263.A OD1 no hydrogen 3.528 N/A ARG 114.A NH1 ASP 263.A OD2 no hydrogen 3.472 N/A ARG 114.A NH2 ASP 133.A OD2 no hydrogen 3.014 N/A ARG 114.A NH2 ASP 263.A OD1 no hydrogen 3.251 N/A HIS 115.A N PHE 111.A O no hydrogen 2.617 N/A HIS 115.A ND1 GLN 130.A O no hydrogen 2.982 N/A PHE 116.A N VAL 132.A O no hydrogen 3.109 N/A ALA 118.A N HIS 115.A O no hydrogen 2.952 N/A TYR 120.A OH THR 70.A OG1 no hydrogen 2.800 N/A TYR 120.A OH ASP 104.A OD2 no hydrogen 2.537 N/A ARG 121.A N TYR 127.A OH no hydrogen 2.814 N/A ARG 121.A NH1 ASP 126.A O no hydrogen 3.560 N/A ARG 121.A NH1 GLN 130.A OE1 no hydrogen 3.165 N/A ARG 121.A NH2 ASP 126.A O no hydrogen 3.513 N/A ASP 122.A N SER 125.A OG no hydrogen 3.229 N/A MET 123.A N ASP 104.A OD1 no hydrogen 2.930 N/A GLU 124.A N ASP 122.A OD1 no hydrogen 2.666 N/A SER 125.A N ASP 122.A O no hydrogen 3.281 N/A SER 125.A N ASP 122.A OD1 no hydrogen 3.015 N/A SER 125.A OG ASP 122.A O no hydrogen 3.424 N/A SER 125.A OG ASP 122.A OD1 no hydrogen 3.346 N/A TYR 127.A OH ASP 122.A O no hydrogen 2.790 N/A SER 128.A N ASP 126.A OD1 no hydrogen 2.848 N/A SER 128.A OG ASP 126.A OD1 no hydrogen 2.976 N/A SER 128.A OG ASP 126.A OD2 no hydrogen 3.265 N/A GLN 130.A N TYR 127.A O no hydrogen 2.741 N/A VAL 132.A N PHE 116.A O no hydrogen 2.827 N/A GLN 134.A NE2 GLN 112.A O no hydrogen 2.697 N/A GLN 134.A NE2 CYS 154.A O no hydrogen 2.616 N/A LEU 135.A N TRP 113.A O no hydrogen 3.194 N/A GLN 136.A N ASP 133.A OD1 no hydrogen 3.014 N/A GLN 136.A NE2 ASP 140.A OD2 no hydrogen 2.772 N/A ARG 137.A N ASP 133.A O no hydrogen 3.197 N/A VAL 138.A N GLN 134.A O no hydrogen 2.809 N/A ILE 139.A N LEU 135.A O no hydrogen 3.010 N/A ASP 140.A N GLN 136.A O no hydrogen 2.760 N/A THR 141.A N ARG 137.A O no hydrogen 2.916 N/A THR 141.A OG1 ARG 137.A O no hydrogen 3.077 N/A ILE 142.A N VAL 138.A O no hydrogen 2.974 N/A LYS 143.A N ILE 139.A O no hydrogen 3.139 N/A THR 144.A N ASP 140.A O no hydrogen 3.118 N/A THR 144.A N THR 141.A O no hydrogen 3.114 N/A THR 144.A OG1 ASP 140.A O no hydrogen 2.855 N/A ASN 145.A N THR 141.A O no hydrogen 2.714 N/A ASP 148.A N ASN 145.A O no hydrogen 3.022 N/A ARG 150.A N ASP 148.A OD2 no hydrogen 2.547 N/A MET 153.A N CYS 173.A O no hydrogen 2.978 N/A CYS 154.A N GLN 134.A OE1 no hydrogen 2.750 N/A CYS 154.A SG TRP 156.A O no hydrogen 3.632 N/A CYS 154.A SG ALA 171.A O no hydrogen 3.734 N/A ALA 155.A N ALA 171.A O no hydrogen 2.947 N/A TRP 156.A N ALA 171.A O no hydrogen 3.164 N/A ASN 157.A ND2 GLN 112.A OE1 no hydrogen 3.380 N/A ARG 159.A N ASN 157.A OD1 no hydrogen 3.176 N/A ARG 159.A NE ASP 160.A OD2 no hydrogen 3.105 N/A ARG 159.A NH1 GLY 117.A O no hydrogen 2.922 N/A ARG 159.A NH2 ALA 118.A O no hydrogen 2.826 N/A ARG 159.A NH2 ASP 160.A OD2 no hydrogen 3.249 N/A ASP 160.A N ASN 157.A O no hydrogen 2.856 N/A LEU 161.A N ASN 157.A O no hydrogen 3.073 N/A LEU 163.A N ASP 160.A O no hydrogen 2.755 N/A MET 164.A N LEU 161.A O no hydrogen 2.976 N/A ALA 165.A N LEU 105.A O no hydrogen 3.285 N/A HIS 170.A N TYR 109.A OH no hydrogen 2.903 N/A CYS 173.A N MET 153.A O no hydrogen 3.072 N/A CYS 173.A SG MET 153.A O no hydrogen 3.952 N/A GLN 174.A N GLN 185.A O no hydrogen 2.818 N/A PHE 175.A N ILE 151.A O no hydrogen 2.900 N/A TYR 176.A N SER 183.A O no hydrogen 2.896 N/A VAL 178.A N GLU 181.A O no hydrogen 3.220 N/A GLU 181.A N VAL 178.A O no hydrogen 2.897 N/A LEU 182.A N LYS 218.A O no hydrogen 2.804 N/A SER 183.A N TYR 176.A O no hydrogen 2.745 N/A CYS 184.A N ASP 221.A O no hydrogen 2.866 N/A GLN 185.A N GLN 174.A O no hydrogen 2.852 N/A GLN 185.A NE2 THR 225.A OG1 no hydrogen 2.623 N/A LEU 186.A N ILE 223.A O no hydrogen 2.921 N/A TYR 187.A N LEU 172.A O no hydrogen 2.829 N/A GLN 188.A N THR 225.A O no hydrogen 2.911 N/A GLN 188.A NE2 SER 190.A O no hydrogen 2.976 N/A GLN 188.A NE2 ASN 200.A OD1 no hydrogen 2.805 N/A ARG 189.A N CYS 169.A O no hydrogen 2.794 N/A ARG 189.A NE PRO 168.A O no hydrogen 2.736 N/A ARG 189.A NH2 PRO 167.A O no hydrogen 2.803 N/A GLY 191.A N ASP 228.A O no hydrogen 2.908 N/A MET 193.A N HIS 230.A O no hydrogen 2.932 N/A LEU 195.A N ASP 192.A OD2 no hydrogen 3.201 N/A VAL 197.A N ASP 192.A O no hydrogen 3.029 N/A ASN 200.A N GLY 196.A O no hydrogen 2.670 N/A ILE 201.A N VAL 197.A O no hydrogen 2.820 N/A ALA 202.A N PRO 198.A O no hydrogen 3.289 N/A SER 203.A N PHE 199.A O no hydrogen 2.945 N/A TYR 204.A N ASN 200.A O no hydrogen 3.061 N/A ALA 205.A N ILE 201.A O no hydrogen 3.147 N/A LEU 206.A N ALA 202.A O no hydrogen 2.942 N/A LEU 207.A N SER 203.A O no hydrogen 3.024 N/A THR 208.A N TYR 204.A O no hydrogen 3.024 N/A THR 208.A OG1 TYR 204.A O no hydrogen 2.766 N/A TYR 209.A N ALA 205.A O no hydrogen 2.971 N/A TYR 209.A OH LEU 41.A O no hydrogen 2.758 N/A TYR 209.A OH GLU 44.A O no hydrogen 2.882 N/A MET 210.A N LEU 206.A O no hydrogen 2.886 N/A ILE 211.A N LEU 207.A O no hydrogen 2.897 N/A ALA 212.A N THR 208.A O no hydrogen 2.858 N/A HIS 213.A N TYR 209.A O no hydrogen 2.952 N/A ILE 214.A N MET 210.A O no hydrogen 3.106 N/A THR 215.A N ILE 211.A O no hydrogen 3.011 N/A THR 215.A OG1 ILE 211.A O no hydrogen 2.692 N/A THR 215.A OG1 ALA 212.A O no hydrogen 3.326 N/A GLY 216.A N HIS 213.A O no hydrogen 3.332 N/A LEU 217.A N ALA 212.A O no hydrogen 2.824 N/A LYS 218.A N SER 180.A O no hydrogen 2.966 N/A GLY 220.A N LEU 182.A O no hydrogen 2.704 N/A ASP 221.A N SER 183.A OG no hydrogen 2.865 N/A PHE 222.A N TYR 39.A O no hydrogen 2.885 N/A ILE 223.A N CYS 184.A O no hydrogen 2.768 N/A HIS 224.A N ALA 37.A O no hydrogen 2.757 N/A HIS 224.A NE2 GLN 188.A OE1 no hydrogen 2.729 N/A THR 225.A N LEU 186.A O no hydrogen 2.951 N/A LEU 226.A N MET 35.A O no hydrogen 2.895 N/A GLY 227.A N GLN 188.A O no hydrogen 2.871 N/A ASP 228.A N ARG 189.A O no hydrogen 2.910 N/A ALA 229.A N VAL 32.A O no hydrogen 2.801 N/A HIS 230.A N GLY 191.A O no hydrogen 2.922 N/A HIS 230.A ND1 ASP 228.A O no hydrogen 2.905 N/A HIS 230.A ND1 ASP 228.A OD1 no hydrogen 3.132 N/A ILE 231.A N LEU 30.A O no hydrogen 2.956 N/A LEU 233.A N GLY 28.A O no hydrogen 3.106 N/A ASN 234.A ND2 GLU 284.A O no hydrogen 3.678 N/A HIS 235.A N TYR 232.A O no hydrogen 3.147 N/A HIS 235.A NE2 GLU 284.A O no hydrogen 2.609 N/A ILE 236.A N LEU 233.A O no hydrogen 3.323 N/A LEU 239.A N HIS 235.A O no hydrogen 2.936 N/A LYS 240.A N ILE 236.A O no hydrogen 3.011 N/A ILE 241.A N GLU 237.A O no hydrogen 3.238 N/A GLN 242.A N PRO 238.A O no hydrogen 2.993 N/A GLN 242.A NE2 THR 50.A OG1 no hydrogen 2.859 N/A LEU 243.A N LEU 239.A O no hydrogen 2.859 N/A GLN 244.A N ILE 241.A O no hydrogen 3.027 N/A ARG 245.A N GLN 242.A O no hydrogen 2.997 N/A ARG 245.A NH1 THR 50.A O no hydrogen 3.013 N/A ARG 245.A NH1 PRO 279.A O no hydrogen 2.613 N/A ARG 248.A N THR 49.A OG1 no hydrogen 2.927 N/A ARG 248.A NH1 ASN 276.A O no hydrogen 2.997 N/A LYS 252.A N GLU 273.A O no hydrogen 2.918 N/A LYS 252.A NZ ASP 43.A O no hydrogen 3.029 N/A ARG 254.A N GLN 271.A O no hydrogen 2.815 N/A ARG 254.A NH2 GLU 273.A OE2 no hydrogen 2.940 N/A LEU 256.A N ASP 269.A O no hydrogen 2.743 N/A ARG 257.A NE ASP 269.A OD1 no hydrogen 3.209 N/A ARG 257.A NE ASP 269.A OD2 no hydrogen 2.662 N/A ARG 257.A NH2 ASP 269.A OD1 no hydrogen 2.980 N/A VAL 259.A N HIS 213.A NE2 no hydrogen 2.890 N/A LYS 261.A N ASP 264.A OD1 no hydrogen 3.036 N/A ASP 264.A N LYS 261.A O no hydrogen 2.779 N/A PHE 265.A N ILE 262.A O no hydrogen 3.446 N/A LYS 266.A N ASP 269.A OD1 no hydrogen 2.900 N/A LYS 266.A NZ ASP 264.A O no hydrogen 3.129 N/A ASP 269.A N LYS 266.A O no hydrogen 2.937 N/A PHE 270.A N ALA 267.A O no hydrogen 3.227 N/A GLN 271.A N ARG 254.A O no hydrogen 2.867 N/A GLU 273.A N LYS 252.A O no hydrogen 2.858 N/A TYR 275.A OH LEU 48.A O no hydrogen 2.796 N/A HIS 278.A N THR 49.A O no hydrogen 2.707 N/A HIS 278.A NE2 GLU 246.A O no hydrogen 2.679 N/A