Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4ls3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 3.A N ILE 14.A O no hydrogen 2.966 N/A VAL 5.A N GLN 12.A O no hydrogen 2.936 N/A ASP 7.A N GLY 10.A O no hydrogen 2.852 N/A TYR 8.A N SER 109.A O no hydrogen 2.834 N/A PHE 9.A N ASP 7.A OD1 no hydrogen 2.787 N/A GLY 10.A N ASP 7.A O no hydrogen 3.116 N/A GLN 12.A N VAL 5.A O no hydrogen 2.745 N/A GLN 12.A NE2 ASP 7.A OD1 no hydrogen 2.965 N/A ILE 14.A N VAL 3.A O no hydrogen 2.840 N/A LEU 16.A N GLN 1.A O no hydrogen 2.811 N/A SER 19.A N ASP 85.A OD2 no hydrogen 2.845 N/A LYS 20.A N ASP 85.A OD2 no hydrogen 2.854 N/A ILE 21.A N ARG 39.A O no hydrogen 2.786 N/A ILE 22.A N LEU 86.A O no hydrogen 2.966 N/A TYR 23.A N GLY 42.A O no hydrogen 3.049 N/A TYR 23.A OH GLN 125.A OE1 no hydrogen 3.285 N/A LEU 24.A N VAL 88.A O no hydrogen 2.762 N/A GLY 25.A N SER 44.A OG no hydrogen 2.772 N/A SER 26.A OG GLU 112.A OE2 no hydrogen 2.511 N/A ALA 28.A N ASP 250.A OD2 no hydrogen 3.162 N/A VAL 30.A N PHE 27.A O no hydrogen 3.064 N/A MET 33.A N GLU 29.A O no hydrogen 3.237 N/A PHE 34.A N VAL 30.A O no hydrogen 3.072 N/A HIS 35.A NE2 ASP 290.A OD2 no hydrogen 2.702 N/A THR 36.A N PRO 31.A O no hydrogen 3.017 N/A TRP 37.A NE1 THR 56.A OG1 no hydrogen 2.930 N/A ARG 39.A N THR 36.A O no hydrogen 2.937 N/A ARG 39.A NE SER 19.A O no hydrogen 3.142 N/A ARG 39.A NH1 ASP 38.A OD2 no hydrogen 2.868 N/A ARG 39.A NH2 SER 19.A O no hydrogen 3.141 N/A VAL 40.A N TRP 37.A O no hydrogen 3.059 N/A VAL 41.A N ILE 21.A O no hydrogen 2.888 N/A ILE 43.A N LYS 64.A O no hydrogen 3.011 N/A SER 44.A N TYR 23.A O no hydrogen 2.979 N/A SER 44.A OG SER 67.A O no hydrogen 2.762 N/A ASP 45.A N MET 66.A O no hydrogen 2.865 N/A TYR 46.A N SER 68.A OG no hydrogen 3.089 N/A TYR 46.A OH ASP 250.A OD1 no hydrogen 3.282 N/A TYR 46.A OH ASP 250.A OD2 no hydrogen 2.754 N/A ALA 47.A N SER 44.A O no hydrogen 2.990 N/A PHE 48.A N ASP 45.A O no hydrogen 3.361 N/A LYS 49.A N TYR 46.A O no hydrogen 3.065 N/A SER 50.A N ALA 47.A O no hydrogen 3.008 N/A SER 50.A OG GLU 29.A OE2 no hydrogen 2.614 N/A VAL 53.A N SER 50.A OG no hydrogen 3.340 N/A LYS 54.A N SER 50.A O no hydrogen 2.957 N/A ALA 55.A N ASP 51.A O no hydrogen 3.068 N/A THR 56.A N ILE 52.A O no hydrogen 3.080 N/A THR 56.A OG1 ILE 52.A O no hydrogen 2.788 N/A LEU 57.A N VAL 53.A O no hydrogen 3.006 N/A LYS 58.A NZ ALA 55.A O no hydrogen 3.105 N/A GLU 61.A N GLU 61.A OE1 no hydrogen 2.758 N/A ARG 62.A N ASP 59.A O no hydrogen 2.987 N/A ARG 62.A NE ASP 59.A OD2 no hydrogen 2.922 N/A ARG 62.A NH1 VAL 40.A O no hydrogen 2.794 N/A ARG 62.A NH2 TRP 37.A O no hydrogen 2.700 N/A ARG 62.A NH2 VAL 40.A O no hydrogen 3.432 N/A ILE 63.A N PRO 60.A O no hydrogen 3.116 N/A LYS 64.A N VAL 41.A O no hydrogen 3.053 N/A MET 66.A N ILE 43.A O no hydrogen 2.749 N/A SER 68.A OG ASP 45.A OD1 no hydrogen 2.595 N/A ASP 69.A N SER 67.A OG no hydrogen 2.994 N/A VAL 71.A N ASP 69.A OD1 no hydrogen 2.747 N/A ALA 72.A N ASP 69.A OD1 no hydrogen 3.182 N/A VAL 76.A N LEU 74.A O no hydrogen 2.900 N/A LEU 78.A N ASN 75.A OD1 no hydrogen 3.154 N/A LEU 79.A N ASN 75.A O no hydrogen 3.005 N/A LYS 80.A N VAL 76.A O no hydrogen 2.946 N/A LYS 81.A N GLU 77.A O no hydrogen 3.214 N/A LEU 82.A N LEU 78.A O no hydrogen 3.095 N/A SER 83.A N LEU 79.A O no hydrogen 3.249 N/A SER 83.A N LYS 80.A O no hydrogen 3.271 N/A SER 83.A OG LYS 80.A O no hydrogen 3.419 N/A ASP 85.A N LYS 20.A O no hydrogen 2.843 N/A LEU 86.A N LYS 20.A O no hydrogen 3.319 N/A VAL 87.A N SER 106.A O no hydrogen 2.847 N/A VAL 88.A N ILE 22.A O no hydrogen 2.746 N/A THR 89.A N LEU 108.A O no hydrogen 2.927 N/A THR 89.A OG1 LEU 24.A O no hydrogen 3.363 N/A THR 89.A OG1 PHE 90.A O no hydrogen 3.455 N/A PHE 90.A N LEU 24.A O no hydrogen 2.945 N/A VAL 91.A N PHE 110.A O no hydrogen 2.792 N/A ASN 93.A ND2 VAL 71.A O no hydrogen 2.911 N/A ALA 96.A N ASN 93.A OD1 no hydrogen 3.168 N/A VAL 97.A N ASN 93.A O no hydrogen 3.009 N/A GLU 98.A N PRO 94.A O no hydrogen 2.870 N/A HIS 99.A N LYS 95.A O no hydrogen 2.894 N/A ALA 100.A N ALA 96.A O no hydrogen 2.960 N/A LYS 101.A N VAL 97.A O no hydrogen 2.879 N/A LYS 102.A N HIS 99.A O no hydrogen 3.196 N/A LEU 108.A N VAL 87.A O no hydrogen 2.770 N/A SER 109.A N ASP 7.A OD2 no hydrogen 2.820 N/A PHE 110.A N THR 89.A O no hydrogen 2.841 N/A GLN 111.A NE2 VAL 91.A O no hydrogen 2.943 N/A GLU 112.A N GLU 112.A OE1 no hydrogen 2.645 N/A LYS 113.A N GLU 117.A OE1 no hydrogen 2.864 N/A LYS 113.A NZ GLN 111.A O no hydrogen 3.464 N/A LYS 113.A NZ GLU 117.A OE1 no hydrogen 2.904 N/A LYS 113.A NZ GLU 117.A OE2 no hydrogen 3.468 N/A ILE 115.A N ASP 178.A OD2 no hydrogen 2.839 N/A GLU 117.A N THR 114.A OG1 no hydrogen 3.024 N/A VAL 118.A N THR 114.A O no hydrogen 2.900 N/A MET 119.A N ILE 115.A O no hydrogen 3.041 N/A GLU 120.A N ALA 116.A O no hydrogen 3.157 N/A ASP 121.A N GLU 117.A O no hydrogen 2.857 N/A ILE 122.A N VAL 118.A O no hydrogen 2.844 N/A ASP 123.A N MET 119.A O no hydrogen 2.997 N/A THR 124.A N GLU 120.A O no hydrogen 3.007 N/A THR 124.A OG1 GLU 120.A O no hydrogen 3.217 N/A GLN 125.A N ASP 121.A O no hydrogen 3.077 N/A GLN 125.A NE2 ASP 121.A O no hydrogen 3.118 N/A ALA 126.A N ILE 122.A O no hydrogen 2.891 N/A LYS 127.A N ASP 123.A O no hydrogen 3.110 N/A ALA 128.A N THR 124.A O no hydrogen 3.314 N/A LEU 129.A N GLN 125.A O no hydrogen 2.940 N/A GLU 130.A N LYS 127.A O no hydrogen 3.302 N/A VAL 131.A N ALA 126.A O no hydrogen 2.958 N/A SER 134.A N ASP 132.A OD1 no hydrogen 3.004 N/A SER 134.A OG ASP 132.A OD1 no hydrogen 2.678 N/A LYS 136.A NZ MET 33.A O no hydrogen 2.506 N/A LYS 136.A NZ VAL 288.A O no hydrogen 3.446 N/A LYS 136.A NZ ASP 290.A OD2 no hydrogen 2.754 N/A LEU 137.A N ALA 133.A O no hydrogen 2.875 N/A ALA 138.A N SER 134.A O no hydrogen 2.948 N/A LYS 139.A N LYS 135.A O no hydrogen 3.104 N/A LYS 139.A NZ GLU 142.A OE1 no hydrogen 2.997 N/A LYS 139.A NZ ASP 283.A OD2 no hydrogen 2.701 N/A MET 140.A N LYS 136.A O no hydrogen 3.138 N/A GLN 141.A N LEU 137.A O no hydrogen 2.970 N/A GLN 141.A NE2 ASP 145.A OD1 no hydrogen 2.734 N/A GLU 142.A N ALA 138.A O no hydrogen 2.789 N/A THR 143.A N LYS 139.A O no hydrogen 3.020 N/A THR 143.A OG1 LYS 139.A O no hydrogen 2.826 N/A LEU 144.A N MET 140.A O no hydrogen 3.061 N/A ASP 145.A N GLN 141.A O no hydrogen 2.857 N/A PHE 146.A N GLU 142.A O no hydrogen 2.935 N/A ILE 147.A N THR 143.A O no hydrogen 3.016 N/A ALA 148.A N LEU 144.A O no hydrogen 3.008 N/A GLU 149.A N ASP 145.A O no hydrogen 2.961 N/A ARG 150.A N PHE 146.A O no hydrogen 3.084 N/A ARG 150.A NE ALA 271.A O no hydrogen 2.837 N/A ARG 150.A NH2 ALA 271.A O no hydrogen 3.064 N/A LEU 151.A N ILE 147.A O no hydrogen 2.981 N/A LYS 152.A N GLU 149.A O no hydrogen 3.339 N/A VAL 154.A N LEU 151.A O no hydrogen 2.929 N/A LYS 157.A N GLY 184.A O no hydrogen 3.118 N/A LYS 157.A NZ ALA 267.A O no hydrogen 2.828 N/A LYS 158.A N GLU 211.A OE1 no hydrogen 3.077 N/A LYS 158.A NZ GLU 208.A O no hydrogen 2.831 N/A LYS 158.A NZ GLU 208.A OE1 no hydrogen 2.914 N/A GLY 159.A N ASP 186.A O no hydrogen 2.950 N/A LEU 162.A N PHE 214.A O no hydrogen 2.815 N/A PHE 163.A N LYS 168.A O no hydrogen 2.999 N/A LYS 165.A NZ ASP 199.A OD1 no hydrogen 3.352 N/A LYS 165.A NZ ASP 199.A OD2 no hydrogen 2.599 N/A ASN 167.A ND2 ILE 200.A O no hydrogen 3.342 N/A LYS 168.A N LYS 165.A O no hydrogen 3.251 N/A ILE 169.A N ALA 198.A O no hydrogen 2.922 N/A SER 170.A OG SER 177.A OG no hydrogen 2.799 N/A GLY 171.A N GLY 196.A O no hydrogen 2.859 N/A HIS 172.A N VAL 193.A O no hydrogen 3.088 N/A SER 177.A N ALA 174.A O no hydrogen 2.913 N/A SER 177.A OG SER 170.A OG no hydrogen 2.799 N/A SER 177.A OG GLY 171.A O no hydrogen 2.669 N/A ASP 178.A N ALA 174.A O no hydrogen 3.287 N/A ILE 179.A N LEU 175.A O no hydrogen 2.961 N/A LEU 180.A N ASP 176.A O no hydrogen 2.872 N/A GLU 181.A N SER 177.A O no hydrogen 2.930 N/A LYS 182.A N ASP 178.A O no hydrogen 2.901 N/A LYS 182.A NZ ASP 178.A OD1 no hydrogen 2.824 N/A LYS 182.A NZ GLU 181.A OE1 no hydrogen 2.978 N/A GLY 183.A N ILE 179.A O no hydrogen 3.113 N/A GLY 183.A N LEU 180.A O no hydrogen 2.995 N/A GLY 184.A N GLU 181.A O no hydrogen 3.013 N/A ILE 185.A N LEU 180.A O no hydrogen 3.048 N/A ASP 186.A N LYS 157.A O no hydrogen 2.762 N/A ASN 187.A ND2 SER 170.A O no hydrogen 3.025 N/A PHE 188.A N GLY 159.A O no hydrogen 3.089 N/A GLY 189.A N ASN 187.A OD1 no hydrogen 2.936 N/A LEU 190.A N ASN 187.A O no hydrogen 3.167 N/A LYS 191.A N PHE 188.A O no hydrogen 2.916 N/A LYS 191.A NZ GLU 208.A OE2 no hydrogen 2.599 N/A TYR 192.A N GLY 189.A O no hydrogen 3.041 N/A TYR 192.A OH GLU 208.A OE2 no hydrogen 2.578 N/A VAL 193.A N GLY 189.A O no hydrogen 2.917 N/A GLY 196.A N HIS 172.A O no hydrogen 2.854 N/A ARG 197.A NE ASP 176.A OD2 no hydrogen 2.759 N/A ARG 197.A NH2 ASP 176.A OD1 no hydrogen 3.010 N/A ARG 197.A NH2 ASP 176.A OD2 no hydrogen 3.050 N/A ALA 198.A N ILE 169.A O no hydrogen 2.914 N/A ILE 200.A N ASN 167.A O no hydrogen 2.881 N/A LYS 204.A N SER 201.A O no hydrogen 2.997 N/A ILE 205.A N SER 201.A O no hydrogen 3.346 N/A VAL 206.A N VAL 202.A O no hydrogen 2.944 N/A LYS 207.A N GLU 203.A O no hydrogen 2.984 N/A GLU 208.A N LYS 204.A O no hydrogen 2.874 N/A ASN 209.A N ILE 205.A O no hydrogen 2.944 N/A GLU 211.A N LYS 158.A O no hydrogen 2.830 N/A ILE 213.A N GLN 242.A O no hydrogen 2.965 N/A PHE 214.A N VAL 160.A O no hydrogen 2.994 N/A ILE 215.A N TYR 244.A O no hydrogen 2.906 N/A TRP 216.A N LEU 162.A O no hydrogen 2.977 N/A SER 219.A N TRP 216.A O no hydrogen 2.956 N/A SER 219.A OG PHE 163.A O no hydrogen 2.546 N/A LEU 221.A N SER 219.A OG no hydrogen 3.016 N/A SER 222.A N ASP 225.A OD2 no hydrogen 2.908 N/A ASP 225.A N SER 222.A OG no hydrogen 3.101 N/A VAL 226.A N PRO 223.A O no hydrogen 3.210 N/A LEU 227.A N PRO 223.A O no hydrogen 2.836 N/A ASN 228.A N GLU 224.A O no hydrogen 2.868 N/A ASN 229.A N VAL 226.A O no hydrogen 3.129 N/A LYS 231.A N ASN 229.A OD1 no hydrogen 3.006 N/A PHE 232.A N ASN 229.A O no hydrogen 2.850 N/A ALA 233.A N PRO 230.A O no hydrogen 3.354 N/A ILE 235.A N PHE 232.A O no hydrogen 3.062 N/A LYS 236.A N ASN 209.A OD1 no hydrogen 2.837 N/A ALA 237.A N PRO 210.A O no hydrogen 3.008 N/A ILE 238.A N ILE 235.A O no hydrogen 2.969 N/A LYS 239.A N ILE 235.A O no hydrogen 2.984 N/A LYS 239.A NZ THR 234.A O no hydrogen 3.399 N/A ASN 240.A N LYS 236.A O no hydrogen 2.850 N/A LYS 241.A N ILE 238.A O no hydrogen 3.069 N/A GLN 242.A N ALA 237.A O no hydrogen 2.696 N/A GLN 242.A NE2 ASN 240.A O no hydrogen 2.969 N/A TYR 244.A N ILE 213.A O no hydrogen 2.921 N/A TYR 244.A OH GLN 242.A OE1 no hydrogen 2.930 N/A LYS 245.A NZ SER 219.A O no hydrogen 2.697 N/A LYS 245.A NZ LEU 221.A O no hydrogen 2.854 N/A LEU 246.A N ILE 215.A O no hydrogen 2.940 N/A MET 249.A N PRO 247.A O no hydrogen 2.723 N/A ASP 250.A N GLU 29.A OE2 no hydrogen 2.965 N/A GLY 253.A N ILE 251.A O no hydrogen 3.017 N/A ARG 255.A NE GLU 29.A OE1 no hydrogen 2.940 N/A ARG 255.A NH1 ASP 51.A OD1 no hydrogen 2.948 N/A ARG 255.A NH1 TYR 285.A OH no hydrogen 2.824 N/A ARG 255.A NH2 GLU 29.A OE2 no hydrogen 2.917 N/A ARG 255.A NH2 ASP 51.A OD1 no hydrogen 2.840 N/A ALA 256.A N GLY 253.A O no hydrogen 3.138 N/A ILE 259.A N ARG 255.A O no hydrogen 3.235 N/A SER 260.A N ALA 256.A O no hydrogen 3.179 N/A SER 260.A OG ILE 179.A O no hydrogen 2.848 N/A LEU 261.A N PRO 257.A O no hydrogen 2.911 N/A PHE 262.A N LEU 258.A O no hydrogen 2.867 N/A ILE 263.A N ILE 259.A O no hydrogen 3.013 N/A ALA 264.A N SER 260.A O no hydrogen 2.923 N/A LEU 265.A N LEU 261.A O no hydrogen 2.876 N/A LYS 266.A N PHE 262.A O no hydrogen 3.027 N/A ALA 267.A N ILE 263.A O no hydrogen 2.816 N/A HIS 268.A N ALA 264.A O no hydrogen 2.743 N/A HIS 268.A NE2 GLY 184.A O no hydrogen 2.924 N/A ALA 271.A N HIS 268.A O no hydrogen 2.921 N/A PHE 272.A N PRO 269.A O no hydrogen 3.115 N/A ASN 278.A ND2 TRP 301.A O no hydrogen 3.048 N/A ALA 279.A N ASP 276.A O no hydrogen 3.206 N/A ALA 279.A N ASP 276.A OD1 no hydrogen 3.247 N/A ILE 280.A N ASP 276.A O no hydrogen 3.308 N/A VAL 281.A N ILE 277.A O no hydrogen 2.845 N/A LYS 282.A N ASN 278.A O no hydrogen 2.793 N/A ASP 283.A N ALA 279.A O no hydrogen 3.043 N/A TYR 284.A N ILE 280.A O no hydrogen 2.970 N/A TYR 284.A OH PRO 254.A O no hydrogen 2.490 N/A TYR 285.A N VAL 281.A O no hydrogen 3.074 N/A LYS 286.A N LYS 282.A O no hydrogen 3.033 N/A LYS 286.A NZ ASP 293.A OD2 no hydrogen 2.964 N/A VAL 287.A N ASP 283.A O no hydrogen 3.020 N/A VAL 288.A N TYR 284.A O no hydrogen 2.891 N/A PHE 289.A N TYR 285.A O no hydrogen 2.984 N/A ASN 292.A N GLU 295.A OE1 no hydrogen 2.892 N/A GLU 295.A N ASN 292.A OD1 no hydrogen 2.943 N/A VAL 296.A N ASN 292.A O no hydrogen 2.913 N/A GLU 297.A N ALA 294.A O no hydrogen 3.352 N/A PHE 299.A N VAL 296.A O no hydrogen 2.819 N/A LEU 300.A N GLU 297.A O no hydrogen 3.096 N/A TRP 301.A N ASN 278.A OD1 no hydrogen 2.831 N/A