Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4lls_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 7.A N THR 4.A O no hydrogen 2.950 N/A TYR 8.A N GLU 5.A O no hydrogen 3.168 N/A GLN 10.A N GLU 290.A OE2 no hydrogen 2.892 N/A THR 14.A N GLN 10.A O no hydrogen 2.918 N/A THR 14.A OG1 GLN 10.A O no hydrogen 3.240 N/A GLN 15.A N SER 11.A O no hydrogen 2.891 N/A ARG 16.A N MET 12.A O no hydrogen 2.918 N/A LEU 17.A N PHE 13.A O no hydrogen 2.869 N/A ASP 18.A N THR 14.A O no hydrogen 3.040 N/A ALA 19.A N GLN 15.A O no hydrogen 2.879 N/A ALA 20.A N ARG 16.A O no hydrogen 2.913 N/A ALA 21.A N LEU 17.A O no hydrogen 2.971 N/A ALA 22.A N ASP 18.A O no hydrogen 3.143 N/A ALA 23.A N ALA 19.A O no hydrogen 2.876 N/A VAL 24.A N ALA 20.A O no hydrogen 2.863 N/A GLN 25.A N ALA 21.A O no hydrogen 3.083 N/A GLN 25.A NE2 GLN 25.A O no hydrogen 3.360 N/A GLN 25.A NE2 ASP 29.A OD1 no hydrogen 2.989 N/A ALA 26.A N ALA 22.A O no hydrogen 2.916 N/A HIS 27.A N ALA 23.A O no hydrogen 3.022 N/A PHE 28.A N VAL 24.A O no hydrogen 2.990 N/A ASP 29.A N GLN 25.A O no hydrogen 2.920 N/A LYS 30.A N ALA 26.A O no hydrogen 2.990 N/A VAL 31.A N HIS 27.A O no hydrogen 2.939 N/A LEU 32.A N PHE 28.A O no hydrogen 2.930 N/A ALA 33.A N ASP 29.A O no hydrogen 3.084 N/A ALA 34.A N VAL 31.A O no hydrogen 3.391 N/A PHE 35.A N LEU 32.A O no hydrogen 2.990 N/A LEU 38.A N GLU 36.A O no hydrogen 2.820 N/A GLU 42.A N LEU 38.A O no hydrogen 2.989 N/A ALA 43.A N PRO 39.A O no hydrogen 2.806 N/A MET 44.A N ILE 40.A O no hydrogen 2.938 N/A ALA 45.A N VAL 41.A O no hydrogen 3.028 N/A HIS 46.A N GLU 42.A O no hydrogen 2.888 N/A ALA 47.A N ALA 43.A O no hydrogen 2.936 N/A THR 48.A N MET 44.A O no hydrogen 3.216 N/A THR 48.A N ALA 45.A O no hydrogen 3.340 N/A THR 48.A OG1 MET 44.A O no hydrogen 2.832 N/A THR 48.A OG1 ALA 45.A O no hydrogen 3.323 N/A SER 49.A N HIS 46.A O no hydrogen 3.430 N/A SER 49.A OG HIS 46.A O no hydrogen 2.844 N/A LYS 52.A NZ HIS 300.A O no hydrogen 2.768 N/A ARG 53.A NH1 THR 48.A O no hydrogen 2.959 N/A ARG 53.A NH1 GLU 81.A OE1 no hydrogen 3.280 N/A ARG 53.A NH2 THR 48.A O no hydrogen 2.756 N/A GLY 56.A N GLU 81.A OE2 no hydrogen 2.904 N/A PHE 57.A N ARG 53.A O no hydrogen 2.748 N/A LEU 58.A N LEU 54.A O no hydrogen 2.887 N/A VAL 59.A N ARG 55.A O no hydrogen 3.164 N/A LEU 60.A N GLY 56.A O no hydrogen 2.976 N/A GLU 61.A N PHE 57.A O no hydrogen 2.797 N/A THR 62.A N LEU 58.A O no hydrogen 2.905 N/A THR 62.A OG1 LEU 58.A O no hydrogen 2.822 N/A THR 62.A OG1 VAL 59.A O no hydrogen 3.329 N/A THR 62.A OG1 ALA 198.A O no hydrogen 3.406 N/A ALA 63.A N VAL 59.A O no hydrogen 2.914 N/A ARG 64.A N LEU 60.A O no hydrogen 2.978 N/A ARG 64.A NE GLU 61.A OE1 no hydrogen 3.381 N/A ARG 64.A NE GLU 61.A OE2 no hydrogen 2.954 N/A ARG 64.A NH2 GLU 61.A OE1 no hydrogen 2.897 N/A LEU 65.A N GLU 61.A O no hydrogen 3.015 N/A HIS 66.A N THR 62.A O no hydrogen 3.204 N/A HIS 66.A N ALA 63.A O no hydrogen 2.925 N/A HIS 66.A ND1 THR 62.A O no hydrogen 3.300 N/A ASP 67.A N ARG 64.A O no hydrogen 2.968 N/A ILE 68.A N ALA 63.A O no hydrogen 2.890 N/A GLU 72.A N ALA 69.A O no hydrogen 3.071 N/A ALA 73.A N ALA 69.A O no hydrogen 2.965 N/A ILE 74.A N ALA 70.A O no hydrogen 2.949 N/A TRP 75.A N GLU 72.A O no hydrogen 3.136 N/A ALA 77.A N ALA 73.A O no hydrogen 2.973 N/A THR 78.A N ILE 74.A O no hydrogen 2.905 N/A THR 78.A OG1 ILE 74.A O no hydrogen 2.828 N/A ALA 79.A N TRP 75.A O no hydrogen 2.919 N/A ILE 80.A N SER 76.A O no hydrogen 3.025 N/A GLU 81.A N ALA 77.A O no hydrogen 3.214 N/A ALA 82.A N THR 78.A O no hydrogen 2.853 N/A LEU 83.A N ALA 79.A O no hydrogen 2.983 N/A HIS 84.A N ILE 80.A O no hydrogen 2.871 N/A ALA 85.A N GLU 81.A O no hydrogen 2.865 N/A TYR 86.A N ALA 82.A O no hydrogen 2.934 N/A SER 87.A N LEU 83.A O no hydrogen 3.080 N/A SER 87.A OG HIS 84.A O no hydrogen 2.703 N/A LEU 88.A N HIS 84.A O no hydrogen 3.141 N/A LEU 88.A N ALA 85.A O no hydrogen 3.151 N/A VAL 89.A N ALA 85.A O no hydrogen 3.055 N/A HIS 90.A N TYR 86.A O no hydrogen 3.064 N/A HIS 90.A NE2 VAL 118.A O no hydrogen 2.918 N/A ASP 91.A N SER 87.A O no hydrogen 2.880 N/A ASP 92.A N LEU 88.A O no hydrogen 2.941 N/A LEU 93.A N HIS 90.A O no hydrogen 3.115 N/A MET 96.A N LEU 93.A O no hydrogen 2.832 N/A ASP 97.A N ASP 91.A O no hydrogen 2.861 N/A ASN 98.A N LEU 93.A O no hydrogen 2.861 N/A ASP 99.A N ASP 92.A O no hydrogen 2.931 N/A ARG 102.A N GLN 105.A O no hydrogen 2.885 N/A ARG 102.A NE ASP 92.A OD1 no hydrogen 3.020 N/A ARG 102.A NH1 ASP 92.A OD2 no hydrogen 2.827 N/A ARG 103.A NH2 SER 49.A O no hydrogen 3.106 N/A GLY 104.A N GLY 240.A O no hydrogen 2.934 N/A GLN 105.A N ARG 102.A O no hydrogen 3.046 N/A THR 107.A N ASP 100.A O no hydrogen 2.995 N/A THR 107.A OG1 ASP 99.A O no hydrogen 2.842 N/A THR 107.A OG1 HIS 109.A NE2 no hydrogen 3.254 N/A HIS 109.A NE2 ASP 99.A O no hydrogen 3.012 N/A LYS 110.A N THR 107.A O no hydrogen 3.072 N/A LYS 111.A N THR 107.A O no hydrogen 2.984 N/A TRP 112.A N VAL 108.A O no hydrogen 2.833 N/A THR 116.A N ASP 113.A OD2 no hydrogen 2.896 N/A THR 116.A OG1 ASP 113.A OD2 no hydrogen 2.653 N/A ALA 117.A N ASP 113.A O no hydrogen 3.116 N/A VAL 118.A N ASP 114.A O no hydrogen 2.874 N/A LEU 119.A N ALA 115.A O no hydrogen 2.952 N/A ALA 120.A N THR 116.A O no hydrogen 2.778 N/A GLY 121.A N ALA 117.A O no hydrogen 2.980 N/A ASP 122.A N VAL 118.A O no hydrogen 2.957 N/A ALA 123.A N LEU 119.A O no hydrogen 2.887 N/A LEU 124.A N ALA 120.A O no hydrogen 2.972 N/A GLN 125.A N GLY 121.A O no hydrogen 3.050 N/A THR 126.A N ASP 122.A O no hydrogen 3.150 N/A THR 126.A OG1 ASP 122.A O no hydrogen 2.949 N/A LEU 127.A N ALA 123.A O no hydrogen 2.884 N/A ALA 128.A N LEU 124.A O no hydrogen 3.035 N/A PHE 129.A N GLN 125.A O no hydrogen 3.435 N/A GLU 130.A N THR 126.A O no hydrogen 3.008 N/A LEU 131.A N LEU 127.A O no hydrogen 2.854 N/A VAL 132.A N ALA 128.A O no hydrogen 3.161 N/A THR 133.A N PHE 129.A O no hydrogen 3.271 N/A THR 133.A OG1 PHE 129.A O no hydrogen 2.803 N/A THR 133.A OG1 GLU 130.A O no hydrogen 3.534 N/A HIS 134.A N GLU 130.A O no hydrogen 2.979 N/A GLY 136.A N HIS 134.A ND1 no hydrogen 2.875 N/A ALA 137.A N HIS 134.A O no hydrogen 2.932 N/A SER 138.A OG SER 140.A O no hydrogen 3.464 N/A SER 140.A N SER 138.A OG no hydrogen 3.027 N/A VAL 143.A N SER 140.A OG no hydrogen 3.140 N/A ARG 144.A N SER 140.A O no hydrogen 3.109 N/A ARG 144.A NE THR 133.A O no hydrogen 2.957 N/A ARG 144.A NH1 SER 138.A O no hydrogen 2.870 N/A ALA 145.A N ALA 141.A O no hydrogen 2.881 N/A ASP 146.A N GLU 142.A O no hydrogen 3.008 N/A LEU 147.A N VAL 143.A O no hydrogen 2.792 N/A ALA 148.A N ARG 144.A O no hydrogen 3.012 N/A LEU 149.A N ALA 145.A O no hydrogen 2.916 N/A SER 150.A N ASP 146.A O no hydrogen 2.945 N/A SER 150.A OG ASP 146.A O no hydrogen 2.861 N/A SER 150.A OG LEU 147.A O no hydrogen 3.080 N/A LEU 151.A N LEU 147.A O no hydrogen 2.940 N/A ALA 152.A N ALA 148.A O no hydrogen 2.922 N/A ARG 153.A N LEU 149.A O no hydrogen 3.011 N/A ALA 154.A N SER 150.A O no hydrogen 2.915 N/A SER 155.A N LEU 151.A O no hydrogen 2.910 N/A SER 155.A N ALA 152.A O no hydrogen 3.296 N/A SER 155.A OG LEU 151.A O no hydrogen 2.787 N/A GLY 156.A N ALA 152.A O no hydrogen 3.019 N/A GLY 159.A N GLY 156.A O no hydrogen 2.886 N/A MET 160.A N ALA 154.A O no hydrogen 2.876 N/A VAL 161.A N SER 155.A O no hydrogen 3.363 N/A VAL 161.A N GLY 156.A O no hydrogen 3.018 N/A GLY 163.A N GLY 159.A O no hydrogen 2.964 N/A GLN 164.A N MET 160.A O no hydrogen 3.051 N/A GLN 164.A NE2 ASP 91.A OD1 no hydrogen 2.715 N/A ALA 165.A N VAL 161.A O no hydrogen 2.855 N/A LEU 166.A N LEU 162.A O no hydrogen 2.923 N/A ASP 167.A N GLY 163.A O no hydrogen 2.951 N/A ILE 168.A N GLN 164.A O no hydrogen 2.934 N/A ALA 169.A N ALA 165.A O no hydrogen 3.060 N/A ALA 170.A N LEU 166.A O no hydrogen 3.097 N/A GLU 171.A N ASP 167.A O no hydrogen 2.849 N/A THR 172.A N ILE 168.A O no hydrogen 3.016 N/A THR 172.A OG1 ILE 168.A O no hydrogen 3.041 N/A ALA 173.A N ALA 169.A O no hydrogen 3.498 N/A ARG 174.A N GLU 171.A O no hydrogen 3.130 N/A ARG 174.A NH1 SER 248.A O no hydrogen 2.920 N/A ARG 174.A NH2 SER 248.A O no hydrogen 3.043 N/A ALA 175.A N ALA 170.A O no hydrogen 3.113 N/A SER 178.A N GLU 181.A OE1 no hydrogen 2.936 N/A SER 178.A OG GLU 181.A OE1 no hydrogen 3.357 N/A GLU 181.A N SER 178.A OG no hydrogen 3.111 N/A ILE 182.A N SER 178.A O no hydrogen 3.011 N/A THR 183.A N LEU 179.A O no hydrogen 2.959 N/A THR 183.A OG1 LEU 179.A O no hydrogen 2.763 N/A ARG 184.A N ASP 180.A O no hydrogen 2.965 N/A LEU 185.A N GLU 181.A O no hydrogen 3.072 N/A GLN 186.A N ILE 182.A O no hydrogen 2.896 N/A GLN 186.A NE2 THR 183.A O no hydrogen 3.309 N/A GLN 187.A N THR 183.A O no hydrogen 2.943 N/A GLY 188.A N ARG 184.A O no hydrogen 3.439 N/A LYS 189.A N LEU 185.A O no hydrogen 2.825 N/A LYS 189.A NZ ASP 167.A OD2 no hydrogen 2.847 N/A THR 190.A N GLN 186.A O no hydrogen 2.921 N/A THR 190.A OG1 GLN 186.A O no hydrogen 3.279 N/A THR 190.A OG1 GLN 224.A OE1 no hydrogen 3.099 N/A GLY 191.A N GLN 186.A O no hydrogen 2.821 N/A GLY 195.A N GLY 191.A O no hydrogen 2.820 N/A TRP 196.A N ALA 192.A O no hydrogen 2.965 N/A TRP 196.A NE1 LEU 147.A O no hydrogen 3.272 N/A TRP 196.A NE1 SER 150.A OG no hydrogen 2.971 N/A SER 197.A N LEU 193.A O no hydrogen 3.023 N/A SER 197.A OG ARG 55.A O no hydrogen 3.550 N/A SER 197.A OG LEU 193.A O no hydrogen 2.851 N/A ALA 198.A N ILE 194.A O no hydrogen 2.984 N/A GLN 199.A N GLY 195.A O no hydrogen 3.025 N/A GLN 199.A NE2 GLY 195.A O no hydrogen 3.343 N/A ALA 200.A N SER 197.A O no hydrogen 3.335 N/A GLY 201.A N THR 62.A OG1 no hydrogen 2.934 N/A ARG 203.A N GLN 199.A O no hydrogen 2.943 N/A LEU 204.A N ALA 200.A O no hydrogen 2.836 N/A ALA 205.A N GLY 201.A O no hydrogen 3.259 N/A ALA 205.A N ALA 202.A O no hydrogen 3.016 N/A GLN 206.A N ARG 203.A O no hydrogen 3.046 N/A ALA 207.A N ALA 202.A O no hydrogen 2.906 N/A THR 209.A OG1 GLN 199.A OE1 no hydrogen 3.349 N/A ALA 210.A N ASP 208.A OD2 no hydrogen 2.958 N/A LYS 213.A N THR 209.A O no hydrogen 2.816 N/A ARG 214.A N.A ALA 210.A O no hydrogen 2.994 N/A ARG 214.A N.B ALA 210.A O no hydrogen 2.989 N/A TYR 215.A N ALA 211.A O no hydrogen 2.909 N/A TYR 215.A OH LEU 288.A O no hydrogen 2.750 N/A ALA 216.A N LEU 212.A O no hydrogen 2.929 N/A GLN 217.A N LYS 213.A O no hydrogen 2.964 N/A ALA 218.A N ARG 214.A O.A no hydrogen 3.286 N/A ALA 218.A N ARG 214.A O.B no hydrogen 3.310 N/A LEU 219.A N TYR 215.A O no hydrogen 2.858 N/A GLY 220.A N ALA 216.A O no hydrogen 2.815 N/A LEU 221.A N GLN 217.A O no hydrogen 3.239 N/A ALA 222.A N ALA 218.A O no hydrogen 2.935 N/A PHE 223.A N LEU 219.A O no hydrogen 2.821 N/A GLN 224.A N GLY 220.A O no hydrogen 2.996 N/A GLN 224.A NE2 ASP 227.A OD1 no hydrogen 3.512 N/A GLN 224.A NE2 ASP 228.A OD1 no hydrogen 2.908 N/A ILE 225.A N LEU 221.A O no hydrogen 2.948 N/A ALA 226.A N ALA 222.A O no hydrogen 2.928 N/A ASP 227.A N PHE 223.A O no hydrogen 2.892 N/A ASP 228.A N GLN 224.A O no hydrogen 2.893 N/A ILE 229.A N ILE 225.A O no hydrogen 2.867 N/A LEU 230.A N ALA 226.A O no hydrogen 2.955 N/A ASP 231.A N ASP 227.A O no hydrogen 3.145 N/A VAL 232.A N ILE 229.A O no hydrogen 2.888 N/A THR 233.A N ILE 229.A O no hydrogen 2.827 N/A THR 233.A OG1 ILE 229.A O no hydrogen 3.058 N/A GLY 234.A N LEU 230.A O no hydrogen 2.838 N/A SER 236.A OG LYS 241.A O no hydrogen 3.264 N/A ALA 237.A N ASP 235.A OD1 no hydrogen 3.081 N/A GLN 238.A N ASP 235.A O no hydrogen 2.849 N/A GLN 238.A NE2 ASP 1.A O no hydrogen 3.082 N/A VAL 239.A N ASP 235.A O no hydrogen 2.831 N/A GLY 240.A N SER 236.A O no hydrogen 2.777 N/A LYS 241.A NZ ASP 227.A OD2 no hydrogen 2.800 N/A GLY 244.A N ASP 231.A O no hydrogen 2.761 N/A LYS 245.A N ASP 231.A OD1 no hydrogen 2.998 N/A LYS 245.A NZ ASP 99.A OD1 no hydrogen 3.375 N/A LYS 245.A NZ ASP 99.A OD2 no hydrogen 2.836 N/A LYS 245.A NZ ALA 242.A O no hydrogen 3.119 N/A ASP 246.A N ASP 231.A OD2 no hydrogen 2.938 N/A ALA 249.A N LYS 245.A O no hydrogen 3.160 N/A GLY 250.A N ALA 247.A O no hydrogen 2.885 N/A LYS 251.A N ASP 246.A O no hydrogen 2.956 N/A LYS 251.A NZ ASP 167.A OD1 no hydrogen 2.825 N/A THR 253.A N SER 256.A OG no hydrogen 2.839 N/A PHE 254.A N ASP 228.A OD2 no hydrogen 3.203 N/A VAL 255.A N THR 253.A OG1 no hydrogen 3.150 N/A SER 256.A N THR 253.A OG1 no hydrogen 3.227 N/A SER 256.A OG THR 253.A O no hydrogen 3.284 N/A LEU 257.A N THR 253.A O no hydrogen 3.018 N/A LEU 258.A N PHE 254.A O no hydrogen 2.950 N/A GLY 259.A N VAL 255.A O no hydrogen 2.790 N/A ALA 263.A N GLY 259.A O no hydrogen 2.924 N/A ARG 264.A N LEU 260.A O no hydrogen 2.876 N/A ALA 265.A N ASP 261.A O no hydrogen 2.961 N/A ARG 266.A N ALA 262.A O no hydrogen 2.961 N/A ARG 266.A NH2 GLU 273.A OE2 no hydrogen 3.021 N/A ALA 267.A N ALA 263.A O no hydrogen 2.938 N/A MET 268.A N ARG 264.A O no hydrogen 2.905 N/A SER 269.A N ALA 265.A O no hydrogen 2.961 N/A SER 269.A OG ALA 265.A O no hydrogen 3.365 N/A LEU 270.A N ARG 266.A O no hydrogen 2.956 N/A ILE 271.A N ALA 267.A O no hydrogen 3.070 N/A ASP 272.A N MET 268.A O no hydrogen 3.463 N/A GLU 273.A N SER 269.A O no hydrogen 3.035 N/A ALA 274.A N LEU 270.A O no hydrogen 2.776 N/A CYS 275.A N ILE 271.A O no hydrogen 2.865 N/A CYS 275.A SG ILE 271.A O no hydrogen 3.366 N/A CYS 275.A SG ARG 289.A O no hydrogen 3.873 N/A ASP 276.A N ASP 272.A O no hydrogen 2.853 N/A SER 277.A N GLU 273.A O no hydrogen 3.080 N/A SER 277.A OG GLU 273.A O no hydrogen 3.013 N/A LEU 278.A N CYS 275.A O no hydrogen 2.999 N/A ALA 279.A N ASP 276.A O no hydrogen 3.128 N/A TYR 281.A N LEU 278.A O no hydrogen 2.901 N/A GLY 282.A N ALA 279.A O no hydrogen 3.060 N/A LYS 284.A NZ LEU 65.A O no hydrogen 3.034 N/A LYS 284.A NZ ASP 67.A OD1 no hydrogen 2.749 N/A ALA 285.A N GLY 282.A O no hydrogen 3.146 N/A ASP 286.A N ALA 283.A O no hydrogen 2.973 N/A ARG 289.A N ALA 285.A O no hydrogen 2.991 N/A ARG 289.A NH1 GLY 282.A O no hydrogen 3.004 N/A ARG 289.A NH2 GLY 282.A O no hydrogen 2.844 N/A ARG 289.A NH2 ASP 286.A OD1 no hydrogen 2.776 N/A GLU 290.A N ASP 286.A O no hydrogen 3.069 N/A THR 291.A N THR 287.A O no hydrogen 2.936 N/A THR 291.A OG1 THR 287.A O no hydrogen 2.780 N/A ALA 292.A N LEU 288.A O no hydrogen 3.334 N/A ALA 292.A N ARG 289.A O no hydrogen 3.090 N/A ARG 293.A N ARG 289.A O no hydrogen 3.387 N/A ARG 293.A NH2 GLU 290.A OE1 no hydrogen 2.619 N/A PHE 294.A N GLU 290.A O no hydrogen 2.861 N/A VAL 295.A N THR 291.A O no hydrogen 2.883 N/A VAL 296.A N ARG 293.A O no hydrogen 3.233 N/A ARG 297.A N ARG 293.A O no hydrogen 2.892 N/A ARG 298.A N PHE 294.A O no hydrogen 2.929 N/A ARG 298.A NE VAL 295.A O no hydrogen 2.833 N/A ARG 298.A NH1 HIS 300.A OXT no hydrogen 2.784 N/A ARG 298.A NH2 PHE 223.A O no hydrogen 3.274 N/A THR 299.A OG1 LEU 2.A O no hydrogen 2.459 N/A THR 299.A OG1 HIS 300.A ND1 no hydrogen 3.162 N/A HIS 300.A ND1 THR 299.A OG1 no hydrogen 3.162 N/A