Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3hq9_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 5.A N ALA 1.A O no hydrogen 3.196 N/A GLN 5.A NE2 TYR 174.A O no hydrogen 2.844 N/A GLN 6.A N ASP 2.A O no hydrogen 3.147 N/A ARG 7.A N GLU 3.A O no hydrogen 3.085 N/A ARG 7.A NH1 ASP 195.A OD1 no hydrogen 2.932 N/A ALA 8.A N LEU 4.A O no hydrogen 3.109 N/A GLN 9.A N GLN 5.A O no hydrogen 2.966 N/A GLN 9.A NE2 LEU 175.A O no hydrogen 2.889 N/A GLY 10.A N ARG 7.A O no hydrogen 3.184 N/A LEU 11.A N ARG 7.A O no hydrogen 3.172 N/A LEU 11.A N ALA 8.A O no hydrogen 3.083 N/A PHE 12.A N ALA 8.A O no hydrogen 3.052 N/A VAL 15.A N ASP 172.A OD2 no hydrogen 2.820 N/A ASN 25.A N LEU 22.A O no hydrogen 3.035 N/A ASN 25.A ND2 LYS 155.A O no hydrogen 2.981 N/A LYS 31.A N SER 28.A OG no hydrogen 3.201 N/A LYS 31.A NZ ASN 25.A OD1 no hydrogen 2.891 N/A LYS 31.A NZ PRO 26.A O no hydrogen 2.805 N/A VAL 32.A N SER 28.A O no hydrogen 3.008 N/A GLU 33.A N PRO 29.A O no hydrogen 2.974 N/A LEU 34.A N VAL 30.A O no hydrogen 2.891 N/A GLY 35.A N LYS 31.A O no hydrogen 2.828 N/A LYS 36.A N VAL 32.A O no hydrogen 2.862 N/A LYS 36.A NZ GLU 33.A OE1 no hydrogen 3.397 N/A LYS 36.A NZ VAL 296.A O no hydrogen 2.725 N/A MET 37.A N GLU 33.A O no hydrogen 2.947 N/A LEU 38.A N LEU 34.A O no hydrogen 2.927 N/A TYR 39.A N GLY 35.A O no hydrogen 2.981 N/A TYR 39.A OH HIS 56.A O no hydrogen 2.680 N/A PHE 40.A N LYS 36.A O no hydrogen 3.215 N/A ASP 41.A N LEU 38.A O no hydrogen 3.132 N/A ARG 43.A N ASP 41.A OD1 no hydrogen 2.886 N/A ARG 43.A NE ASP 41.A OD1 no hydrogen 2.895 N/A ARG 43.A NE ASP 41.A OD2 no hydrogen 3.394 N/A ARG 43.A NH1 PRO 301.A O no hydrogen 2.796 N/A ARG 43.A NH1 SER 303.A OG no hydrogen 2.950 N/A ARG 43.A NH2 ASP 41.A OD2 no hydrogen 2.798 N/A ARG 43.A NH2 PRO 301.A O no hydrogen 2.748 N/A LEU 44.A N ASP 41.A O no hydrogen 3.131 N/A SER 45.A N PRO 42.A O no hydrogen 3.006 N/A SER 45.A OG PRO 42.A O no hydrogen 2.678 N/A SER 45.A OG SER 47.A OG no hydrogen 3.287 N/A SER 45.A OG ILE 50.A O no hydrogen 3.076 N/A ALA 46.A N MET 116.A O no hydrogen 2.953 N/A SER 47.A OG SER 45.A OG no hydrogen 3.287 N/A HIS 48.A N SER 45.A O no hydrogen 3.270 N/A LEU 49.A N SER 47.A OG no hydrogen 3.045 N/A ILE 50.A N SER 45.A OG no hydrogen 3.244 N/A SER 51.A N THR 54.A OG1 no hydrogen 2.996 N/A ASN 53.A N TYR 39.A O no hydrogen 3.284 N/A THR 54.A N SER 51.A O no hydrogen 2.987 N/A THR 54.A OG1 SER 51.A O no hydrogen 3.324 N/A CYS 55.A N CYS 52.A O no hydrogen 3.224 N/A HIS 56.A N CYS 52.A O no hydrogen 2.911 N/A HIS 56.A ND1 PRO 82.A O no hydrogen 2.865 N/A ASN 57.A N GLY 63.A O no hydrogen 2.856 N/A VAL 58.A N ASN 53.A OD1 no hydrogen 2.941 N/A GLY 59.A N ASN 57.A OD1 no hydrogen 3.024 N/A LEU 60.A N ASN 57.A O no hydrogen 2.960 N/A GLY 62.A N ASN 57.A O no hydrogen 2.866 N/A GLY 63.A N LEU 60.A O no hydrogen 3.308 N/A GLN 66.A N ASP 64.A OD1 no hydrogen 2.997 N/A GLN 66.A NE2 ASP 64.A O no hydrogen 3.538 N/A THR 68.A OG1 GLY 77.A O no hydrogen 2.630 N/A SER 69.A N ARG 79.A O no hydrogen 3.153 N/A SER 69.A OG ASP 64.A OD2 no hydrogen 2.679 N/A GLY 71.A N GLN 75.A O no hydrogen 2.959 N/A HIS 72.A N GLU 115.A O no hydrogen 2.904 N/A GLN 75.A N GLY 71.A O no hydrogen 3.439 N/A LYS 76.A NZ THR 68.A OG1 no hydrogen 2.704 N/A GLY 77.A N SER 69.A O no hydrogen 2.706 N/A ARG 79.A NE ASP 96.A OD1 no hydrogen 2.753 N/A ARG 79.A NH1 PRO 78.A O no hydrogen 2.894 N/A ARG 79.A NH2 ASP 96.A OD1 no hydrogen 3.505 N/A ARG 79.A NH2 ASP 96.A OD2 no hydrogen 2.781 N/A ASN 80.A N HIS 250.A O no hydrogen 2.838 N/A ASN 80.A ND2 ALA 67.A O no hydrogen 2.889 N/A THR 83.A OG1 GLY 61.A O no hydrogen 2.612 N/A VAL 84.A N GLY 62.A O no hydrogen 3.047 N/A LEU 85.A N THR 83.A OG1 no hydrogen 2.967 N/A ASN 86.A N LEU 164.A O no hydrogen 2.889 N/A ASN 86.A ND2 THR 166.A OG1 no hydrogen 2.922 N/A SER 87.A N VAL 84.A O no hydrogen 2.995 N/A SER 87.A OG VAL 84.A O no hydrogen 2.749 N/A PHE 89.A N ASN 86.A O no hydrogen 3.069 N/A ASN 90.A N SER 87.A O no hydrogen 3.019 N/A THR 91.A N GLY 209.A O no hydrogen 2.954 N/A ALA 92.A N GLY 209.A O no hydrogen 3.014 N/A PHE 94.A N TYR 212.A OH no hydrogen 3.097 N/A TRP 95.A NE1 ASN 80.A O no hydrogen 2.757 N/A GLY 97.A N VAL 233.A O no hydrogen 2.969 N/A ARG 98.A NE ASP 101.A OD2 no hydrogen 2.950 N/A ARG 98.A NH2 ASP 101.A OD1 no hydrogen 3.464 N/A ARG 98.A NH2 ASP 101.A OD2 no hydrogen 3.251 N/A ALA 99.A N GLU 231.A O no hydrogen 2.819 N/A ASP 101.A N ARG 98.A O no hydrogen 2.951 N/A LEU 102.A N ARG 98.A O no hydrogen 2.984 N/A ALA 103.A N ALA 99.A O no hydrogen 2.959 N/A GLU 115.A N GLU 115.A OE2 no hydrogen 2.823 N/A MET 116.A N ALA 112.A O no hydrogen 2.878 N/A ASN 117.A N PRO 113.A O no hydrogen 2.724 N/A ASN 118.A ND2 LEU 44.A O no hydrogen 3.021 N/A THR 119.A N GLN 122.A OE1.B no hydrogen 2.892 N/A GLN 122.A N THR 119.A OG1 no hydrogen 3.219 N/A VAL 123.A N THR 119.A O no hydrogen 3.099 N/A VAL 124.A N PRO 120.A O no hydrogen 3.047 N/A LYS 125.A N ASP 121.A O no hydrogen 2.873 N/A THR 126.A N GLN 122.A O no hydrogen 3.022 N/A THR 126.A OG1 GLN 122.A O no hydrogen 2.885 N/A LEU 127.A N VAL 123.A O no hydrogen 2.984 N/A ASN 128.A N VAL 124.A O no hydrogen 2.828 N/A SER 129.A N LYS 125.A O no hydrogen 3.018 N/A SER 129.A N THR 126.A O no hydrogen 3.240 N/A SER 129.A OG THR 126.A O no hydrogen 2.658 N/A SER 129.A OG THR 307.A OG1 no hydrogen 2.797 N/A ILE 130.A N LEU 127.A O no hydrogen 3.242 N/A TYR 133.A N ILE 130.A O no hydrogen 2.905 N/A TYR 133.A OH ASP 41.A OD2 no hydrogen 2.614 N/A VAL 134.A N ILE 130.A O no hydrogen 3.162 N/A ALA 135.A N PRO 131.A O no hydrogen 2.861 N/A LEU 136.A N ASP 132.A O no hydrogen 2.940 N/A PHE 137.A N TYR 133.A O no hydrogen 2.881 N/A LYS 138.A N VAL 134.A O no hydrogen 3.156 N/A LYS 139.A N ALA 135.A O no hydrogen 3.104 N/A ALA 140.A N LEU 136.A O no hydrogen 2.863 N/A PHE 141.A N PHE 137.A O no hydrogen 2.755 N/A VAL 148.A N ASP 146.A OD1 no hydrogen 3.388 N/A THR 149.A N PRO 147.A O no hydrogen 3.042 N/A ASN 152.A N THR 149.A OG1 no hydrogen 3.019 N/A ASN 152.A ND2 GLU 144.A OE1 no hydrogen 2.908 N/A ASN 152.A ND2 PRO 147.A O no hydrogen 2.712 N/A MET 153.A N THR 149.A O no hydrogen 2.867 N/A ALA 154.A N PHE 150.A O no hydrogen 2.957 N/A LYS 155.A N ASP 151.A O no hydrogen 2.779 N/A LYS 155.A NZ ASP 151.A OD2 no hydrogen 2.618 N/A ALA 156.A N ASN 152.A O no hydrogen 2.850 N/A ILE 157.A N MET 153.A O no hydrogen 2.960 N/A GLU 158.A N ALA 154.A O no hydrogen 2.775 N/A VAL 159.A N LYS 155.A O no hydrogen 2.977 N/A PHE 160.A N ALA 156.A O no hydrogen 3.139 N/A GLU 161.A N ILE 157.A O no hydrogen 2.766 N/A ALA 162.A N GLU 158.A O no hydrogen 2.856 N/A THR 163.A N PHE 160.A O no hydrogen 2.943 N/A THR 163.A OG1 PHE 160.A O no hydrogen 2.708 N/A LEU 164.A N GLU 161.A O no hydrogen 2.910 N/A THR 166.A N ASN 86.A OD1 no hydrogen 2.965 N/A THR 166.A OG1 THR 166.A O no hydrogen 2.588 N/A PHE 171.A N SER 287.A O no hydrogen 2.992 N/A ASP 172.A N SER 169.A OG no hydrogen 3.150 N/A GLN 173.A N SER 169.A O no hydrogen 3.009 N/A TYR 174.A N PRO 170.A O no hydrogen 2.911 N/A LEU 175.A N PHE 171.A O no hydrogen 2.762 N/A LYS 176.A N ASP 172.A O no hydrogen 2.899 N/A LYS 176.A NZ GLN 173.A OE1 no hydrogen 3.155 N/A GLY 177.A N TYR 174.A O no hydrogen 3.061 N/A LYS 178.A N GLN 173.A O no hydrogen 3.015 N/A LYS 179.A NZ GLN 5.A OE1 no hydrogen 2.730 N/A ALA 181.A N LYS 178.A O no hydrogen 3.013 N/A LEU 182.A N LYS 179.A O no hydrogen 3.397 N/A ASP 183.A N GLN 186.A OE1 no hydrogen 2.955 N/A GLN 186.A N ASP 183.A OD1 no hydrogen 2.838 N/A GLN 186.A NE2 ALA 283.A O no hydrogen 3.590 N/A THR 187.A N ASP 183.A O no hydrogen 2.925 N/A THR 187.A OG1 ASP 183.A O no hydrogen 2.569 N/A ALA 188.A N GLY 184.A O no hydrogen 2.936 N/A GLY 189.A N LYS 185.A O no hydrogen 2.813 N/A LEU 190.A N GLN 186.A O no hydrogen 2.894 N/A LYS 191.A N THR 187.A O no hydrogen 3.193 N/A LYS 191.A NZ ASP 195.A OD2 no hydrogen 2.799 N/A LEU 192.A N ALA 188.A O no hydrogen 3.192 N/A PHE 193.A N GLY 189.A O no hydrogen 2.813 N/A LEU 194.A N LEU 190.A O no hydrogen 3.040 N/A ASP 195.A N LYS 191.A O no hydrogen 2.778 N/A LYS 196.A N LEU 192.A O no hydrogen 2.799 N/A LYS 196.A NZ LYS 272.A O no hydrogen 2.689 N/A GLY 197.A N LEU 194.A O no hydrogen 3.234 N/A ALA 200.A N GLY 197.A O no hydrogen 3.052 N/A CYS 201.A N CYS 198.A O no hydrogen 3.213 N/A HIS 202.A N CYS 198.A O no hydrogen 3.044 N/A HIS 202.A ND1 PRO 237.A O no hydrogen 2.921 N/A GLY 204.A N LEU 11.A O no hydrogen 3.262 N/A ASN 206.A ND2 ASN 86.A O no hydrogen 2.877 N/A ASN 206.A ND2 ASN 90.A OD1 no hydrogen 2.772 N/A LEU 207.A N GLY 204.A O no hydrogen 3.217 N/A GLY 208.A N GLY 203.A O no hydrogen 3.005 N/A GLY 209.A N ALA 236.A O no hydrogen 2.783 N/A PHE 213.A N PHE 234.A O no hydrogen 2.801 N/A GLY 216.A N THR 225.A O no hydrogen 3.155 N/A VAL 218.A N ALA 223.A O no hydrogen 2.857 N/A ALA 223.A N VAL 218.A O no hydrogen 2.857 N/A THR 225.A N GLY 216.A O no hydrogen 2.786 N/A THR 227.A N PRO 214.A O no hydrogen 2.817 N/A THR 227.A OG1 TYR 232.A O no hydrogen 2.657 N/A ALA 228.A N ASN 226.A OD1 no hydrogen 2.938 N/A LYS 229.A NZ ASN 226.A O no hydrogen 3.410 N/A ASP 230.A N THR 227.A O no hydrogen 3.035 N/A GLU 231.A N ALA 228.A O no hydrogen 2.908 N/A TYR 232.A N THR 227.A O no hydrogen 3.286 N/A TYR 232.A OH ASP 96.A OD2 no hydrogen 2.499 N/A VAL 233.A N GLY 97.A O no hydrogen 2.862 N/A PHE 234.A N PHE 213.A O no hydrogen 2.770 N/A ARG 235.A N TRP 95.A O no hydrogen 2.787 N/A ARG 235.A NH1 ALA 92.A O no hydrogen 2.920 N/A ALA 236.A N GLY 211.A O no hydrogen 3.020 N/A SER 238.A OG ASN 206.A O no hydrogen 2.575 N/A LEU 239.A N LEU 207.A O no hydrogen 2.953 N/A ARG 240.A N SER 238.A OG no hydrogen 3.340 N/A ARG 240.A NE LEU 205.A O no hydrogen 2.777 N/A ARG 240.A NH1 ASP 172.A OD1 no hydrogen 2.990 N/A ARG 240.A NH2 LYS 13.A O no hydrogen 2.878 N/A ARG 240.A NH2 ASP 172.A OD1 no hydrogen 3.062 N/A ARG 240.A NH2 LEU 205.A O no hydrogen 2.957 N/A ASN 241.A N LEU 288.A O no hydrogen 3.036 N/A ASN 241.A ND2 THR 166.A OG1 no hydrogen 2.933 N/A VAL 242.A N LEU 239.A O no hydrogen 3.078 N/A ILE 244.A N ASN 241.A O no hydrogen 2.915 N/A THR 245.A N VAL 242.A O no hydrogen 3.177 N/A THR 245.A OG1 VAL 242.A O no hydrogen 3.392 N/A TYR 248.A N VAL 254.A O no hydrogen 2.703 N/A TYR 248.A OH VAL 242.A O no hydrogen 2.618 N/A GLY 252.A N PHE 249.A O no hydrogen 3.040 N/A LYS 258.A NZ ASP 275.A OD1 no hydrogen 2.938 N/A LYS 258.A NZ GLU 279.A OE1 no hydrogen 2.634 N/A GLU 259.A N SER 256.A OG no hydrogen 3.115 N/A ALA 260.A N SER 256.A O no hydrogen 2.915 N/A VAL 261.A N LEU 257.A O no hydrogen 2.911 N/A ALA 262.A N LYS 258.A O no hydrogen 2.923 N/A VAL 263.A N GLU 259.A O no hydrogen 2.871 N/A MET 264.A N ALA 260.A O no hydrogen 3.082 N/A GLY 265.A N VAL 261.A O no hydrogen 3.009 N/A GLY 265.A N ALA 262.A O no hydrogen 3.124 N/A GLN 268.A N SER 266.A OG no hydrogen 3.066 N/A GLN 268.A NE2 VAL 224.A O no hydrogen 3.258 N/A PHE 269.A N SER 266.A O no hydrogen 2.903 N/A GLY 270.A N ALA 267.A O no hydrogen 2.980 N/A ILE 271.A N SER 266.A O no hydrogen 3.044 N/A SER 274.A N GLU 277.A OE1 no hydrogen 2.789 N/A GLU 277.A N SER 274.A OG no hydrogen 3.089 N/A SER 278.A N SER 274.A O no hydrogen 2.963 N/A SER 278.A OG SER 274.A O no hydrogen 3.401 N/A GLU 279.A N ASP 275.A O no hydrogen 2.927 N/A ALA 280.A N ASP 276.A O no hydrogen 2.936 N/A ILE 281.A N GLU 277.A O no hydrogen 2.925 N/A ALA 282.A N SER 278.A O no hydrogen 2.877 N/A ALA 283.A N GLU 279.A O no hydrogen 2.939 N/A PHE 284.A N ALA 280.A O no hydrogen 2.959 N/A LEU 285.A N ILE 281.A O no hydrogen 2.812 N/A GLY 286.A N ALA 282.A O no hydrogen 3.033 N/A SER 287.A N PHE 284.A O no hydrogen 2.846 N/A SER 287.A OG PHE 284.A O no hydrogen 2.626 N/A LEU 288.A N LEU 285.A O no hydrogen 3.083 N/A THR 289.A N GLY 286.A O no hydrogen 3.465 N/A THR 289.A OG1 GLY 286.A O no hydrogen 3.518 N/A GLY 290.A N ASN 241.A OD1 no hydrogen 2.978 N/A LYS 291.A N PRO 167.A O no hydrogen 2.945 N/A LYS 291.A NZ ASP 168.A OD2 no hydrogen 3.552 N/A GLN 292.A NE2 ASN 241.A OD1 no hydrogen 3.263 N/A GLN 292.A NE2 GLY 290.A O no hydrogen 2.930 N/A THR 304.A N THR 307.A OG1 no hydrogen 2.840 N/A THR 304.A OG1 SER 129.A O no hydrogen 2.642 N/A ALA 306.A N THR 304.A OG1 no hydrogen 3.237 N/A THR 307.A N THR 304.A O no hydrogen 2.959 N/A THR 307.A OG1 SER 129.A OG no hydrogen 2.797 N/A THR 307.A OG1 THR 304.A O no hydrogen 3.202 N/A ARG 311.A N ALA 46.A O no hydrogen 2.846 N/A