Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3lwq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 2.A N ASP 5.A OD2 no hydrogen 3.166 N/A ASP 5.A N LEU 2.A O no hydrogen 2.947 N/A ILE 6.A N PRO 3.A O no hydrogen 3.274 N/A ARG 8.A NH2 HIS 231.A O no hydrogen 2.769 N/A LEU 11.A N LEU 259.A O no hydrogen 2.761 N/A LYS 13.A N ALA 257.A O no hydrogen 2.936 N/A LYS 13.A NZ LEU 292.A O no hydrogen 3.475 N/A LYS 13.A NZ LYS 294.A O no hydrogen 3.198 N/A ASP 14.A N ALA 257.A O no hydrogen 3.215 N/A ASN 16.A N ASP 14.A OD2 no hydrogen 2.977 N/A ALA 17.A N ASP 14.A OD2 no hydrogen 3.093 N/A THR 19.A OG1 ASP 239.A OD1 no hydrogen 3.118 N/A THR 19.A OG1 ASP 239.A OD2 no hydrogen 3.270 N/A ASN 20.A N ASP 239.A OD2 no hydrogen 2.983 N/A ASP 22.A N ASN 20.A OD1 no hydrogen 2.895 N/A TRP 23.A N ASN 20.A O no hydrogen 3.345 N/A GLY 24.A N TRP 311.A O no hydrogen 3.005 N/A PHE 25.A N GLU 277.A OE2 no hydrogen 3.165 N/A ARG 30.A N PRO 27.A O no hydrogen 3.297 N/A ARG 30.A NE PHE 25.A O no hydrogen 3.206 N/A ARG 30.A NH1 GLU 226.A OE1 no hydrogen 3.179 N/A ARG 30.A NH2 GLU 226.A OE1 no hydrogen 3.217 N/A ARG 30.A NH2 GLU 226.A OE2 no hydrogen 2.836 N/A MET 34.A N PRO 31.A O no hydrogen 2.610 N/A HIS 35.A N PRO 31.A O no hydrogen 2.802 N/A ILE 36.A N ILE 32.A O no hydrogen 3.165 N/A ILE 36.A N GLU 33.A O no hydrogen 3.274 N/A GLN 37.A N GLU 33.A O no hydrogen 3.271 N/A GLY 39.A N ILE 36.A O no hydrogen 2.988 N/A VAL 40.A N GLN 223.A O no hydrogen 2.777 N/A ILE 41.A N VAL 83.A O no hydrogen 2.714 N/A LEU 43.A N LEU 81.A O no hydrogen 3.332 N/A ASP 44.A N ILE 197.A O no hydrogen 3.020 N/A LYS 45.A N GLY 79.A O no hydrogen 2.954 N/A LYS 45.A NZ PRO 46.A O no hydrogen 2.859 N/A LYS 45.A NZ PRO 49.A O no hydrogen 2.885 N/A LYS 45.A NZ ASP 74.A O no hydrogen 3.400 N/A LYS 45.A NZ PRO 75.A O no hydrogen 3.150 N/A LYS 45.A NZ VAL 77.A O no hydrogen 2.747 N/A GLY 48.A N PRO 75.A O no hydrogen 2.655 N/A THR 50.A OG1 GLU 53.A OE2 no hydrogen 3.242 N/A SER 51.A OG LEU 73.A O no hydrogen 2.645 N/A GLU 53.A N THR 50.A OG1 no hydrogen 3.368 N/A VAL 54.A N THR 50.A O no hydrogen 3.242 N/A VAL 55.A N SER 51.A O no hydrogen 3.176 N/A ALA 56.A N HIS 52.A O no hydrogen 3.041 N/A TRP 57.A N GLU 53.A O no hydrogen 2.829 N/A ILE 58.A N VAL 54.A O no hydrogen 3.227 N/A LYS 59.A N VAL 55.A O no hydrogen 3.175 N/A LYS 60.A N ALA 56.A O no hydrogen 2.954 N/A ILE 61.A N TRP 57.A O no hydrogen 2.771 N/A LEU 62.A N ILE 58.A O no hydrogen 3.010 N/A ASN 63.A N LYS 60.A O no hydrogen 3.361 N/A ASN 63.A ND2 TYR 206.A OH no hydrogen 3.325 N/A LEU 64.A N LYS 59.A O no hydrogen 3.006 N/A GLU 65.A N GLU 86.A OE2 no hydrogen 3.294 N/A LYS 66.A N GLU 86.A OE1 no hydrogen 3.113 N/A GLY 68.A N ALA 84.A O no hydrogen 3.154 N/A HIS 69.A ND1 GLY 70.A O no hydrogen 2.861 N/A GLY 70.A N PRO 82.A O no hydrogen 2.900 N/A LEU 73.A N SER 51.A OG no hydrogen 2.821 N/A VAL 77.A N ASP 74.A O no hydrogen 2.809 N/A SER 78.A N LEU 182.A O no hydrogen 3.385 N/A GLY 79.A N LYS 45.A O no hydrogen 3.123 N/A VAL 80.A N ARG 184.A O no hydrogen 2.953 N/A LEU 81.A N LEU 43.A O no hydrogen 2.548 N/A VAL 83.A N ILE 41.A O no hydrogen 2.806 N/A ALA 84.A N GLY 68.A O no hydrogen 2.973 N/A LEU 85.A N GLY 39.A O no hydrogen 2.882 N/A GLU 86.A N LYS 66.A O no hydrogen 3.145 N/A LYS 87.A NZ GLN 37.A OE1 no hydrogen 2.949 N/A ALA 88.A N LEU 85.A O no hydrogen 2.843 N/A THR 89.A N GLU 86.A O no hydrogen 2.764 N/A THR 89.A OG1 ALA 84.A O no hydrogen 3.416 N/A THR 89.A OG1 GLU 86.A O no hydrogen 3.002 N/A ARG 90.A NH2 VAL 305.A O no hydrogen 3.015 N/A VAL 91.A N ALA 88.A O no hydrogen 2.958 N/A VAL 92.A N THR 89.A O no hydrogen 3.286 N/A GLN 93.A N ARG 90.A O no hydrogen 2.835 N/A GLN 93.A NE2 ARG 90.A O no hydrogen 3.086 N/A ALA 94.A N VAL 91.A O no hydrogen 2.824 N/A LEU 95.A N VAL 92.A O no hydrogen 2.722 N/A LEU 96.A N VAL 92.A O no hydrogen 3.036 N/A ALA 98.A N LEU 95.A O no hydrogen 2.987 N/A LYS 100.A N VAL 156.A O no hydrogen 2.835 N/A GLU 101.A N ARG 186.A O no hydrogen 2.867 N/A TYR 102.A N VAL 154.A O no hydrogen 2.929 N/A VAL 103.A N ARG 183.A O no hydrogen 2.767 N/A ALA 104.A N PHE 152.A O no hydrogen 2.829 N/A LEU 105.A N GLU 181.A O no hydrogen 2.738 N/A MET 106.A N VAL 150.A O no hydrogen 2.980 N/A HIS 107.A N HIS 178.A O no hydrogen 2.788 N/A HIS 107.A ND1 ASP 149.A OD2 no hydrogen 2.715 N/A LEU 108.A N ARG 148.A O no hydrogen 2.991 N/A HIS 109.A N GLY 176.A O no hydrogen 2.802 N/A HIS 109.A NE2 HIS 178.A ND1 no hydrogen 2.844 N/A ILE 117.A N PRO 113.A O no hydrogen 3.203 N/A ILE 118.A N GLU 114.A O no hydrogen 3.099 N/A GLN 119.A N ASP 115.A O no hydrogen 2.900 N/A VAL 120.A N LYS 116.A O no hydrogen 2.770 N/A MET 121.A N ILE 117.A O no hydrogen 2.804 N/A LYS 122.A N ILE 118.A O no hydrogen 3.119 N/A GLU 123.A N VAL 120.A O no hydrogen 3.064 N/A PHE 124.A N MET 121.A O no hydrogen 3.080 N/A GLY 126.A N VAL 137.A O no hydrogen 3.019 N/A ILE 128.A N ARG 135.A O no hydrogen 3.096 N/A GLN 130.A N ARG 133.A O no hydrogen 2.964 N/A ARG 133.A N GLN 130.A O no hydrogen 3.308 N/A THR 134.A OG1 GLU 127.A OE1 no hydrogen 2.833 N/A THR 134.A OG1 ILE 128.A O no hydrogen 3.310 N/A ARG 135.A N ILE 128.A O no hydrogen 3.099 N/A VAL 137.A N GLY 126.A O no hydrogen 2.840 N/A TYR 138.A N GLY 155.A O no hydrogen 2.513 N/A TYR 139.A N GLY 155.A O no hydrogen 3.373 N/A ILE 140.A N GLU 125.A OE1 no hydrogen 3.063 N/A GLU 141.A N ARG 153.A O no hydrogen 2.782 N/A LEU 143.A N LEU 151.A O no hydrogen 2.914 N/A GLU 144.A N LEU 151.A O no hydrogen 3.322 N/A GLU 146.A N ASP 149.A O no hydrogen 2.935 N/A ARG 148.A NE ASP 111.A OD1 no hydrogen 2.927 N/A ARG 148.A NH2 ASP 111.A OD1 no hydrogen 3.481 N/A ASP 149.A N GLU 146.A O no hydrogen 2.934 N/A VAL 150.A N MET 106.A O no hydrogen 2.876 N/A LEU 151.A N GLU 144.A O no hydrogen 2.849 N/A PHE 152.A N ALA 104.A O no hydrogen 3.088 N/A ARG 153.A N GLU 141.A O no hydrogen 2.649 N/A ARG 153.A NH1 GLU 101.A OE1 no hydrogen 2.753 N/A VAL 154.A N TYR 102.A O no hydrogen 2.990 N/A GLY 155.A N TYR 139.A O no hydrogen 2.863 N/A VAL 156.A N LYS 100.A O no hydrogen 2.801 N/A GLU 157.A N LYS 136.A O no hydrogen 2.918 N/A THR 160.A OG1 GLU 157.A O no hydrogen 2.714 N/A LEU 165.A N TYR 161.A O no hydrogen 3.009 N/A ILE 166.A N ILE 162.A O no hydrogen 2.770 N/A HIS 167.A N ARG 163.A O no hydrogen 3.184 N/A HIS 168.A N SER 164.A O no hydrogen 3.127 N/A ILE 169.A N LEU 165.A O no hydrogen 2.998 N/A GLY 170.A N ILE 166.A O no hydrogen 2.825 N/A LEU 171.A N HIS 167.A O no hydrogen 2.925 N/A ALA 172.A N HIS 168.A O no hydrogen 2.988 N/A ALA 172.A N ILE 169.A O no hydrogen 3.118 N/A LEU 173.A N ILE 169.A O no hydrogen 3.064 N/A GLY 176.A N GLY 170.A O no hydrogen 3.009 N/A HIS 178.A N HIS 107.A O no hydrogen 3.008 N/A HIS 178.A ND1 HIS 109.A NE2 no hydrogen 2.844 N/A SER 180.A N LEU 105.A O no hydrogen 2.875 N/A SER 180.A OG LEU 105.A O no hydrogen 2.984 N/A ARG 183.A N VAL 103.A O no hydrogen 2.990 N/A ARG 183.A NH1 ASP 44.A OD1 no hydrogen 2.991 N/A ARG 183.A NH1 SER 78.A OG no hydrogen 2.905 N/A ARG 183.A NH2 ASP 44.A OD1 no hydrogen 3.224 N/A ARG 183.A NH2 ASP 44.A OD2 no hydrogen 3.087 N/A ARG 183.A NH2 GLU 192.A OE2 no hydrogen 3.212 N/A ARG 184.A N SER 78.A O no hydrogen 3.035 N/A ARG 184.A NH1 GLY 71.A O no hydrogen 3.080 N/A ARG 184.A NH1 VAL 80.A O no hydrogen 2.676 N/A ARG 184.A NH2 GLY 71.A O no hydrogen 2.836 N/A THR 185.A N GLU 101.A O no hydrogen 2.855 N/A THR 185.A OG1 GLU 101.A O no hydrogen 2.998 N/A ARG 186.A NE GLY 188.A O no hydrogen 2.695 N/A ARG 186.A NH1 ASP 5.A OD1 no hydrogen 3.330 N/A ARG 186.A NH1 ASP 5.A OD2 no hydrogen 3.024 N/A ARG 186.A NH2 GLY 188.A O no hydrogen 3.139 N/A SER 187.A N PHE 190.A O no hydrogen 2.828 N/A GLY 188.A N GLY 99.A O no hydrogen 3.026 N/A PHE 190.A N SER 187.A O no hydrogen 2.965 N/A THR 195.A N ASP 193.A OD1 no hydrogen 2.905 N/A THR 195.A OG1 ASN 42.A OD1 no hydrogen 3.080 N/A THR 195.A OG1 ASP 193.A OD1 no hydrogen 2.581 N/A LEU 196.A N ASP 193.A O no hydrogen 2.940 N/A ILE 197.A N ASN 42.A O no hydrogen 2.987 N/A ASP 201.A N THR 198.A OG1 no hydrogen 3.144 N/A LEU 202.A N THR 198.A O no hydrogen 2.977 N/A VAL 203.A N LEU 199.A O no hydrogen 2.837 N/A ASP 204.A N HIS 200.A O no hydrogen 2.906 N/A TYR 205.A N ASP 201.A O no hydrogen 2.618 N/A TYR 206.A N LEU 202.A O no hydrogen 3.040 N/A TYR 207.A N VAL 203.A O no hydrogen 3.143 N/A PHE 208.A N ASP 204.A O no hydrogen 2.829 N/A TRP 209.A N TYR 205.A O no hydrogen 3.024 N/A LYS 210.A N TYR 206.A O no hydrogen 2.726 N/A GLU 211.A N TYR 207.A O no hydrogen 2.728 N/A ASP 212.A N PHE 208.A O no hydrogen 3.145 N/A GLY 213.A N TRP 209.A O no hydrogen 3.137 N/A ILE 214.A N PHE 208.A O no hydrogen 3.206 N/A ARG 219.A N GLU 215.A O no hydrogen 3.076 N/A ARG 219.A NH1 ARG 30.A O no hydrogen 3.218 N/A ARG 219.A NH2 ARG 30.A O no hydrogen 2.536 N/A LYS 220.A N GLU 216.A O no hydrogen 3.267 N/A LYS 220.A N TYR 217.A O no hydrogen 3.121 N/A ALA 221.A N TYR 217.A O no hydrogen 2.961 N/A ILE 222.A N PHE 218.A O no hydrogen 3.259 N/A GLN 223.A N VAL 40.A O no hydrogen 2.880 N/A GLN 223.A NE2 LYS 220.A O no hydrogen 2.810 N/A MET 225.A N PHE 38.A O no hydrogen 2.911 N/A LYS 227.A N PRO 224.A O no hydrogen 2.936 N/A ALA 228.A N MET 225.A O no hydrogen 2.854 N/A VAL 229.A N GLU 226.A O no hydrogen 3.028 N/A GLU 230.A N LYS 227.A O no hydrogen 3.140 N/A HIS 231.A N HIS 231.A ND1 no hydrogen 2.831 N/A HIS 231.A NE2 ALA 94.A O no hydrogen 2.979 N/A LEU 232.A N VAL 229.A O no hydrogen 2.857 N/A LYS 234.A N HIS 260.A ND1 no hydrogen 2.846 N/A LYS 234.A NZ VAL 229.A O no hydrogen 3.292 N/A LYS 234.A NZ GLU 230.A O no hydrogen 3.456 N/A LYS 234.A NZ LEU 232.A O no hydrogen 2.868 N/A VAL 235.A N ALA 270.A O no hydrogen 3.077 N/A TRP 236.A N LYS 258.A O no hydrogen 2.643 N/A TRP 236.A NE1 ASP 276.A OD1 no hydrogen 3.238 N/A ILE 237.A N MET 272.A O no hydrogen 2.808 N/A LYS 238.A N GLY 255.A O no hydrogen 2.823 N/A LYS 238.A NZ ASP 14.A OD1 no hydrogen 3.212 N/A LYS 238.A NZ PRO 254.A O no hydrogen 3.158 N/A ALA 241.A N LYS 238.A O no hydrogen 2.908 N/A VAL 242.A N ASP 239.A O no hydrogen 3.196 N/A VAL 245.A N ALA 241.A O no hydrogen 2.957 N/A THR 246.A N VAL 242.A O no hydrogen 3.143 N/A THR 246.A OG1 VAL 242.A O no hydrogen 3.374 N/A THR 246.A OG1 ALA 243.A O no hydrogen 2.841 N/A HIS 247.A N ALA 244.A O no hydrogen 3.005 N/A GLY 248.A N VAL 245.A O no hydrogen 3.134 N/A ALA 249.A N ALA 244.A O no hydrogen 3.052 N/A LEU 251.A N VAL 300.A O no hydrogen 3.189 N/A VAL 253.A N GLY 297.A O no hydrogen 2.772 N/A GLY 255.A N ALA 252.A O no hydrogen 3.148 N/A ILE 256.A N VAL 253.A O no hydrogen 2.860 N/A ALA 257.A N TRP 236.A O no hydrogen 2.866 N/A LEU 259.A N LEU 11.A O no hydrogen 2.873 N/A HIS 260.A N LYS 234.A O no hydrogen 2.805 N/A ALA 261.A N GLU 9.A O no hydrogen 2.779 N/A ILE 263.A N SER 288.A OG no hydrogen 3.037 N/A LYS 264.A N ASP 267.A OD2 no hydrogen 3.176 N/A LYS 264.A NZ ASP 267.A OD2 no hydrogen 3.293 N/A ARG 265.A NE GLU 290.A OE2 no hydrogen 3.146 N/A ARG 265.A NH2 GLU 290.A OE1 no hydrogen 3.036 N/A ARG 265.A NH2 GLU 290.A OE2 no hydrogen 3.300 N/A GLY 266.A N ALA 284.A O no hydrogen 3.107 N/A ASP 267.A N LYS 264.A O no hydrogen 2.915 N/A VAL 269.A N GLY 282.A O no hydrogen 2.982 N/A ALA 270.A N PRO 233.A O no hydrogen 2.832 N/A ILE 271.A N ALA 280.A O no hydrogen 2.902 N/A MET 272.A N VAL 235.A O no hydrogen 3.009 N/A THR 273.A N GLU 277.A O no hydrogen 2.888 N/A THR 273.A OG1 GLU 277.A O no hydrogen 3.435 N/A THR 273.A OG1 GLU 277.A OE1 no hydrogen 2.856 N/A LYS 275.A NZ THR 19.A OG1 no hydrogen 2.585 N/A LYS 275.A NZ ASN 20.A O no hydrogen 2.732 N/A LYS 275.A NZ TRP 23.A O no hydrogen 3.161 N/A LYS 275.A NZ TYR 312.A OH no hydrogen 2.997 N/A ASP 276.A N THR 273.A O no hydrogen 2.986 N/A GLU 277.A N THR 273.A OG1 no hydrogen 3.041 N/A LEU 278.A N GLU 226.A OE2 no hydrogen 2.788 N/A VAL 279.A N ILE 271.A O no hydrogen 2.854 N/A ALA 280.A N ILE 271.A O no hydrogen 3.412 N/A LEU 281.A N LYS 304.A O no hydrogen 2.681 N/A GLY 282.A N VAL 269.A O no hydrogen 3.158 N/A LYS 283.A N ASP 301.A O no hydrogen 3.059 N/A ALA 284.A N ASP 267.A O no hydrogen 2.982 N/A MET 285.A N ALA 299.A O no hydrogen 2.978 N/A THR 287.A OG1 GLU 290.A OE2 no hydrogen 3.436 N/A SER 288.A OG HIS 260.A O no hydrogen 2.586 N/A GLU 290.A N THR 287.A OG1 no hydrogen 3.303 N/A MET 291.A N THR 287.A O no hydrogen 3.308 N/A LEU 292.A N SER 288.A O no hydrogen 3.246 N/A GLU 293.A N GLN 289.A O no hydrogen 3.246 N/A LYS 294.A N GLU 290.A O no hydrogen 3.007 N/A LYS 294.A NZ LYS 296.A O no hydrogen 3.370 N/A ALA 299.A N LEU 251.A O no hydrogen 2.870 N/A VAL 300.A N LEU 251.A O no hydrogen 3.174 N/A ASP 301.A N LYS 283.A O no hydrogen 2.989 N/A VAL 302.A N ASP 250.A OD1 no hydrogen 3.183 N/A GLU 303.A N LEU 281.A O no hydrogen 3.047 N/A LYS 304.A N LEU 281.A O no hydrogen 2.942 N/A PHE 306.A N VAL 279.A O no hydrogen 3.020 N/A MET 307.A N VAL 279.A O no hydrogen 2.956 N/A ARG 309.A NE THR 246.A O no hydrogen 2.941 N/A TYR 312.A OH GLU 277.A OE1 no hydrogen 2.650 N/A