Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6fu3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 5.A N GLY 2.A O no hydrogen 3.004 N/A ASP 6.A N GLY 2.A O no hydrogen 3.088 N/A LEU 7.A N GLU 3.A O no hydrogen 2.921 N/A LEU 8.A N ASP 4.A O no hydrogen 2.968 N/A LYS 9.A N GLN 5.A O no hydrogen 2.966 N/A LYS 9.A NZ GLN 12.A OE1 no hydrogen 2.511 N/A ARG 10.A N ASP 6.A O no hydrogen 2.912 N/A ARG 10.A NH1 ASP 197.A OD1 no hydrogen 2.928 N/A ARG 10.A NH2 ASP 197.A OD1 no hydrogen 2.715 N/A ALA 11.A N LEU 7.A O no hydrogen 2.840 N/A GLN 12.A N LEU 8.A O no hydrogen 2.857 N/A GLN 12.A NE2 LEU 177.A O no hydrogen 2.814 N/A GLY 13.A N LYS 9.A O no hydrogen 3.123 N/A VAL 14.A N ALA 11.A O no hydrogen 2.974 N/A PHE 15.A N ALA 11.A O no hydrogen 2.946 N/A GLN 16.A NE2 GLN 12.A O no hydrogen 3.665 N/A LEU 18.A N ASP 174.A OD1 no hydrogen 2.778 N/A THR 20.A OG1 GLU 22.A OE1 no hydrogen 3.393 N/A GLU 22.A N GLU 22.A OE1 no hydrogen 2.737 N/A GLU 23.A N THR 20.A O no hydrogen 2.985 N/A GLU 23.A N THR 20.A OG1 no hydrogen 3.109 N/A MET 24.A N THR 20.A O no hydrogen 2.998 N/A GLN 25.A N VAL 21.A O no hydrogen 3.275 N/A GLN 25.A NE2 PHE 30.A O no hydrogen 3.088 N/A LYS 26.A N GLU 23.A O no hydrogen 3.117 N/A ILE 27.A N MET 24.A O no hydrogen 3.009 N/A ARG 28.A NH1 ASP 104.A OD2 no hydrogen 3.107 N/A PHE 30.A N GLN 25.A OE1 no hydrogen 3.011 N/A THR 31.A N GLN 34.A OE1 no hydrogen 3.014 N/A GLN 34.A N THR 31.A O no hydrogen 2.959 N/A GLN 34.A N THR 31.A OG1 no hydrogen 3.171 N/A GLN 34.A NE2 ALA 144.A O no hydrogen 3.122 N/A VAL 35.A N THR 31.A O no hydrogen 2.939 N/A LYS 36.A N GLU 32.A O no hydrogen 2.911 N/A LEU 37.A N GLU 33.A O no hydrogen 3.041 N/A GLY 38.A N GLN 34.A O no hydrogen 2.848 N/A HIS 39.A N VAL 35.A O no hydrogen 2.814 N/A GLN 40.A N LYS 36.A O no hydrogen 3.168 N/A GLN 40.A NE2 TYR 137.A OH no hydrogen 3.354 N/A LEU 41.A N LEU 37.A O no hydrogen 2.821 N/A TRP 42.A N GLY 38.A O no hydrogen 2.914 N/A TRP 42.A NE1 ASN 56.A OD1 no hydrogen 3.021 N/A TYR 43.A N GLN 40.A O no hydrogen 3.170 N/A TYR 43.A OH ALA 312.A O no hydrogen 2.669 N/A GLU 44.A N LEU 41.A O no hydrogen 2.977 N/A ARG 46.A N GLU 44.A OE2 no hydrogen 3.079 N/A ARG 46.A NE GLU 44.A OE2 no hydrogen 2.895 N/A ARG 46.A NH1 PRO 319.A O no hydrogen 2.997 N/A ARG 46.A NH2 GLU 44.A OE1 no hydrogen 2.879 N/A ARG 46.A NH2 PRO 319.A O no hydrogen 2.814 N/A LEU 47.A N GLU 44.A O no hydrogen 3.267 N/A SER 48.A N PRO 45.A O no hydrogen 2.961 N/A SER 48.A OG PRO 45.A O no hydrogen 2.659 N/A SER 48.A OG VAL 53.A O no hydrogen 3.184 N/A LYS 49.A N MET 119.A O no hydrogen 2.927 N/A ASN 51.A N SER 48.A O no hydrogen 3.055 N/A ASN 51.A ND2 SER 326.A O no hydrogen 2.786 N/A VAL 53.A N SER 48.A OG no hydrogen 3.051 N/A SER 54.A N SER 57.A OG no hydrogen 2.921 N/A ASN 56.A N TRP 42.A O no hydrogen 3.269 N/A ASN 56.A N SER 54.A OG no hydrogen 3.210 N/A ASN 56.A ND2 ASN 60.A OD1 no hydrogen 2.878 N/A SER 57.A N SER 54.A O no hydrogen 3.047 N/A SER 57.A OG SER 54.A O no hydrogen 3.310 N/A CYS 58.A N CYS 55.A O no hydrogen 3.287 N/A CYS 58.A SG GLN 73.A O no hydrogen 3.790 N/A HIS 59.A N CYS 55.A O no hydrogen 2.965 N/A ASN 60.A N VAL 66.A O no hydrogen 3.103 N/A LEU 61.A N ASN 56.A OD1 no hydrogen 2.829 N/A ALA 62.A N ASN 60.A OD1 no hydrogen 3.053 N/A SER 63.A N ASN 60.A O no hydrogen 2.936 N/A SER 63.A OG VAL 66.A O no hydrogen 2.918 N/A GLY 65.A N ASN 60.A O no hydrogen 2.929 N/A VAL 66.A N SER 63.A O no hydrogen 3.128 N/A ASN 68.A ND2 LYS 260.A O no hydrogen 2.924 N/A ASN 68.A ND2 TYR 262.A O no hydrogen 2.961 N/A MET 69.A N ASP 67.A OD1 no hydrogen 3.152 N/A THR 71.A OG1 GLY 80.A O no hydrogen 3.243 N/A SER 72.A OG ASP 67.A OD1 no hydrogen 3.491 N/A SER 72.A OG ASP 67.A OD2 no hydrogen 2.598 N/A SER 72.A OG SER 84.A OG no hydrogen 2.444 N/A GLY 74.A N GLN 78.A O no hydrogen 2.738 N/A HIS 75.A N GLU 118.A O no hydrogen 2.882 N/A GLY 77.A N GLY 74.A O no hydrogen 2.934 N/A GLN 78.A N HIS 75.A O no hydrogen 3.041 N/A GLN 78.A NE2 HIS 75.A O no hydrogen 2.939 N/A GLN 78.A NE2 PRO 116.A O no hydrogen 3.447 N/A GLY 80.A N SER 72.A O no hydrogen 3.089 N/A ARG 82.A NE ASP 234.A OD2 no hydrogen 2.712 N/A ARG 82.A NH1 ASP 99.A OD2 no hydrogen 2.839 N/A ARG 82.A NH2 ASP 99.A OD2 no hydrogen 3.485 N/A ARG 82.A NH2 ASP 234.A OD1 no hydrogen 2.940 N/A ASN 83.A N HIS 266.A O no hydrogen 2.915 N/A ASN 83.A ND2 PRO 70.A O no hydrogen 2.705 N/A SER 84.A OG SER 72.A OG no hydrogen 2.444 N/A THR 86.A OG1 ALA 64.A O no hydrogen 2.736 N/A ALA 87.A N GLY 65.A O no hydrogen 3.340 N/A LEU 88.A N THR 86.A OG1 no hydrogen 3.000 N/A ASN 89.A N LEU 167.A O no hydrogen 2.862 N/A ASN 89.A ND2 THR 169.A OG1 no hydrogen 2.951 N/A ALA 90.A N ALA 87.A O no hydrogen 3.163 N/A LEU 92.A N ASN 89.A O no hydrogen 3.077 N/A LEU 93.A N ALA 90.A O no hydrogen 2.983 N/A GLY 94.A N GLY 211.A O no hydrogen 2.946 N/A GLN 96.A N ALA 102.A O no hydrogen 2.733 N/A TRP 98.A NE1 ASN 83.A O no hydrogen 3.015 N/A GLY 100.A N PHE 97.A O no hydrogen 3.008 N/A ARG 101.A NH1 ASP 99.A OD1 no hydrogen 2.965 N/A ARG 101.A NH1 ASP 99.A OD2 no hydrogen 3.218 N/A ALA 103.A N GLU 107.A OE1 no hydrogen 2.837 N/A GLU 107.A N ASP 104.A OD1 no hydrogen 2.959 N/A GLN 108.A N ASP 104.A O no hydrogen 2.789 N/A ALA 109.A N VAL 105.A O no hydrogen 2.971 N/A GLY 110.A N GLU 107.A O no hydrogen 3.260 N/A GLY 111.A N GLN 108.A O no hydrogen 2.795 N/A VAL 114.A N GLY 111.A O no hydrogen 3.062 N/A ASN 115.A N PRO 112.A O no hydrogen 3.402 N/A VAL 117.A N ASN 115.A OD1 no hydrogen 3.117 N/A GLU 118.A N ASN 115.A O no hydrogen 2.904 N/A MET 119.A N PRO 112.A O no hydrogen 2.899 N/A ASN 121.A N LEU 113.A O no hydrogen 3.055 N/A ASN 121.A ND2 LEU 47.A O no hydrogen 2.768 N/A ASN 121.A ND2 LEU 113.A O no hydrogen 2.963 N/A ALA 126.A N SER 123.A OG no hydrogen 2.968 N/A ALA 127.A N SER 123.A O no hydrogen 3.166 N/A ALA 127.A N GLN 124.A O no hydrogen 2.956 N/A ALA 128.A N GLN 124.A O no hydrogen 3.417 N/A ALA 129.A N ALA 126.A O no hydrogen 3.263 N/A LYS 130.A NZ LYS 49.A O no hydrogen 3.515 N/A LYS 130.A NZ ASN 51.A OD1 no hydrogen 3.104 N/A ALA 132.A N ALA 128.A O no hydrogen 2.766 N/A LYS 133.A N LYS 130.A O no hydrogen 2.955 N/A LYS 133.A NZ GLU 325.A OE1 no hydrogen 2.769 N/A VAL 134.A N ILE 131.A O no hydrogen 3.170 N/A GLU 136.A N GLU 136.A OE1 no hydrogen 2.749 N/A TYR 137.A N VAL 134.A O no hydrogen 2.953 N/A TYR 137.A OH GLU 44.A OE1 no hydrogen 2.645 N/A GLN 138.A N VAL 134.A O no hydrogen 3.036 N/A GLN 138.A NE2 ALA 132.A O no hydrogen 2.871 N/A GLU 139.A N PRO 135.A O no hydrogen 2.976 N/A MET 140.A N GLU 136.A O no hydrogen 2.996 N/A PHE 141.A N TYR 137.A O no hydrogen 2.792 N/A LYS 142.A N GLN 138.A O no hydrogen 3.087 N/A LYS 143.A N GLU 139.A O no hydrogen 3.096 N/A ALA 144.A N MET 140.A O no hydrogen 2.789 N/A PHE 145.A N PHE 141.A O no hydrogen 2.956 N/A ASP 148.A N PHE 145.A O no hydrogen 2.928 N/A ASN 155.A N SER 152.A OG no hydrogen 3.041 N/A ASN 155.A ND2 ASP 148.A O no hydrogen 2.913 N/A ASN 155.A ND2 ALA 150.A O no hydrogen 2.912 N/A ILE 156.A N SER 152.A O no hydrogen 2.854 N/A THR 157.A N PHE 153.A O no hydrogen 2.968 N/A THR 157.A OG1 PHE 153.A O no hydrogen 3.013 N/A THR 157.A OG1 LYS 154.A O no hydrogen 3.024 N/A THR 158.A N LYS 154.A O no hydrogen 2.896 N/A THR 158.A OG1 LYS 154.A O no hydrogen 3.101 N/A ALA 159.A N ASN 155.A O no hydrogen 2.891 N/A LEU 160.A N ILE 156.A O no hydrogen 2.885 N/A GLY 161.A N THR 157.A O no hydrogen 2.988 N/A ALA 162.A N THR 158.A O no hydrogen 2.947 N/A PHE 163.A N ALA 159.A O no hydrogen 3.060 N/A GLU 164.A N LEU 160.A O no hydrogen 2.965 N/A ARG 165.A N GLY 161.A O no hydrogen 2.903 N/A ARG 165.A N ALA 162.A O no hydrogen 3.182 N/A ARG 165.A NE GLU 106.A OE2 no hydrogen 2.669 N/A ARG 165.A NH2 GLU 106.A OE1 no hydrogen 2.830 N/A ARG 165.A NH2 GLU 106.A OE2 no hydrogen 3.511 N/A THR 166.A N PHE 163.A O no hydrogen 2.940 N/A THR 166.A OG1 PHE 163.A O no hydrogen 2.704 N/A LEU 167.A N GLU 164.A O no hydrogen 2.937 N/A LEU 168.A N THR 166.A O no hydrogen 2.857 N/A THR 169.A N ASN 89.A OD1 no hydrogen 2.943 N/A THR 169.A OG1 THR 169.A O no hydrogen 2.557 N/A THR 171.A N ASP 174.A OD2 no hydrogen 2.960 N/A THR 171.A OG1 ALA 303.A O no hydrogen 2.599 N/A LYS 172.A NZ GLU 188.A OE2 no hydrogen 2.863 N/A TRP 173.A N THR 171.A OG1 no hydrogen 2.894 N/A GLU 175.A N THR 171.A O no hydrogen 3.338 N/A TYR 176.A N LYS 172.A O no hydrogen 2.958 N/A LEU 177.A N TRP 173.A O no hydrogen 2.949 N/A LYS 178.A N ASP 174.A O no hydrogen 2.994 N/A LYS 178.A NZ GLU 175.A OE2 no hydrogen 3.479 N/A GLY 179.A N TYR 176.A O no hydrogen 2.801 N/A ASN 180.A N GLU 175.A O no hydrogen 3.107 N/A ASN 180.A ND2.B GLU 175.A O no hydrogen 2.978 N/A ASN 182.A N ASN 180.A OD1.A no hydrogen 3.088 N/A ALA 183.A N ASN 180.A O no hydrogen 2.990 N/A LEU 184.A N VAL 181.A O no hydrogen 3.322 N/A SER 185.A N GLU 188.A OE1 no hydrogen 2.735 N/A GLN 187.A NE2 ASN 296.A OD1 no hydrogen 2.695 N/A GLU 188.A N SER 185.A OG no hydrogen 2.968 N/A ARG 189.A N SER 185.A O no hydrogen 2.887 N/A ARG 189.A NE VAL 181.A O no hydrogen 3.055 N/A ARG 189.A NE LEU 184.A O no hydrogen 3.276 N/A LYS 190.A N GLU 186.A O no hydrogen 2.878 N/A LYS 190.A NZ GLU 186.A OE2 no hydrogen 2.994 N/A GLY 191.A N GLN 187.A O no hydrogen 2.988 N/A VAL 192.A N GLU 188.A O no hydrogen 2.936 N/A ARG 193.A N ARG 189.A O no hydrogen 2.975 N/A ALA 194.A N LYS 190.A O no hydrogen 2.948 N/A PHE 195.A N GLY 191.A O no hydrogen 2.782 N/A MET 196.A N VAL 192.A O no hydrogen 2.946 N/A ASP 197.A N ARG 193.A O no hydrogen 2.803 N/A ASN 198.A N ALA 194.A O no hydrogen 2.845 N/A ASN 198.A ND2 ALA 194.A O no hydrogen 2.853 N/A GLY 199.A N MET 196.A O no hydrogen 2.953 N/A CYS 200.A N PHE 195.A O no hydrogen 3.139 N/A CYS 200.A SG PHE 195.A O no hydrogen 3.419 N/A ALA 202.A N GLY 199.A O no hydrogen 3.025 N/A CYS 203.A N CYS 200.A O no hydrogen 3.021 N/A HIS 204.A N CYS 200.A O no hydrogen 2.875 N/A HIS 204.A ND1 LEU 209.A O no hydrogen 2.895 N/A ASN 205.A ND2 ILE 201.A O no hydrogen 2.808 N/A GLY 206.A N VAL 14.A O no hydrogen 2.879 N/A ASN 208.A ND2 ASN 89.A O no hydrogen 3.164 N/A LEU 209.A N GLY 206.A O no hydrogen 3.296 N/A GLY 210.A N ASN 205.A O no hydrogen 2.985 N/A GLN 215.A N PHE 250.A O no hydrogen 2.888 N/A GLN 215.A NE2 THR 213.A OG1 no hydrogen 2.912 N/A PHE 217.A N PHE 248.A O no hydrogen 2.825 N/A GLY 218.A N GLN 284.A OE1 no hydrogen 2.714 N/A LEU 219.A N GLN 284.A OE1 no hydrogen 3.141 N/A VAL 220.A N ALA 283.A O no hydrogen 2.835 N/A GLN 221.A N ALA 283.A O no hydrogen 3.035 N/A TYR 224.A OH ASP 230.A OD2 no hydrogen 3.227 N/A TYR 224.A OH ASP 234.A O no hydrogen 2.762 N/A TYR 224.A OH HIS 266.A NE2 no hydrogen 3.347 N/A LYS 226.A N PRO 223.A O no hydrogen 3.051 N/A PHE 227.A N TYR 224.A O no hydrogen 2.828 N/A ILE 228.A N TYR 224.A O no hydrogen 3.096 N/A LYS 232.A N ASP 230.A OD1 no hydrogen 3.296 N/A ARG 233.A N ASP 230.A O no hydrogen 3.007 N/A ARG 233.A N ASP 230.A OD1 no hydrogen 3.075 N/A ASP 234.A N ASP 230.A OD2 no hydrogen 3.208 N/A GLY 236.A N ASP 234.A OD1 no hydrogen 2.880 N/A ARG 237.A N PHE 249.A O no hydrogen 2.627 N/A ARG 237.A NH1 ASP 99.A O no hydrogen 2.889 N/A ASP 239.A N GLY 236.A O no hydrogen 3.075 N/A VAL 240.A N ARG 237.A O no hydrogen 2.910 N/A THR 241.A N ARG 237.A O no hydrogen 3.015 N/A THR 241.A OG1 ARG 237.A O no hydrogen 3.516 N/A THR 241.A OG1 ASP 246.A OD2 no hydrogen 2.600 N/A LYS 242.A N ALA 238.A O no hydrogen 2.806 N/A LYS 242.A NZ ASP 239.A O no hydrogen 2.782 N/A LYS 243.A N THR 241.A OG1 no hydrogen 3.197 N/A GLU 245.A N GLU 245.A OE1 no hydrogen 2.833 N/A ASP 246.A N LYS 243.A O no hydrogen 2.980 N/A GLU 247.A N THR 244.A O no hydrogen 3.072 N/A PHE 248.A N LYS 235.A O no hydrogen 2.827 N/A PHE 249.A N ASP 246.A O no hydrogen 3.151 N/A PHE 250.A N GLN 215.A O no hydrogen 3.002 N/A ARG 251.A N TRP 98.A O no hydrogen 2.807 N/A ARG 251.A NE VAL 252.A O no hydrogen 3.288 N/A ARG 251.A NH1 SER 95.A O no hydrogen 2.857 N/A VAL 252.A N THR 213.A O no hydrogen 3.031 N/A LEU 255.A N ASN 208.A O no hydrogen 2.940 N/A ARG 256.A NE VAL 207.A O no hydrogen 2.865 N/A ARG 256.A NH1 ASP 174.A OD2 no hydrogen 2.786 N/A ARG 256.A NH2 ASP 174.A OD1 no hydrogen 2.745 N/A ARG 256.A NH2 VAL 207.A O no hydrogen 3.144 N/A ASN 257.A N LEU 304.A O no hydrogen 3.104 N/A ASN 257.A ND2 THR 169.A OG1 no hydrogen 3.018 N/A VAL 258.A N LEU 255.A O no hydrogen 3.070 N/A LYS 260.A N ASN 257.A O no hydrogen 2.836 N/A THR 261.A N VAL 258.A O no hydrogen 3.162 N/A THR 261.A OG1 ASN 257.A O no hydrogen 3.539 N/A THR 261.A OG1 VAL 258.A O no hydrogen 3.369 N/A TYR 264.A N VAL 270.A O no hydrogen 2.564 N/A TYR 264.A OH VAL 258.A O no hydrogen 2.735 N/A HIS 266.A NE2 ASP 230.A OD2 no hydrogen 2.622 N/A ASN 267.A ND2 GLU 229.A O no hydrogen 2.880 N/A GLY 268.A N PHE 265.A O no hydrogen 2.882 N/A SER 269.A N TYR 264.A O no hydrogen 3.088 N/A SER 269.A OG ASN 267.A OD1 no hydrogen 2.729 N/A GLU 272.A N GLU 272.A OE1 no hydrogen 2.781 N/A ALA 276.A N GLU 272.A O no hydrogen 3.003 N/A VAL 277.A N LEU 273.A O no hydrogen 2.968 N/A THR 278.A N ASP 274.A O no hydrogen 2.912 N/A THR 278.A OG1 ASP 274.A O no hydrogen 3.362 N/A ILE 279.A N LYS 275.A O no hydrogen 2.872 N/A MET 280.A N ALA 276.A O no hydrogen 2.928 N/A GLY 281.A N VAL 277.A O no hydrogen 2.948 N/A LYS 282.A N THR 278.A O no hydrogen 2.979 N/A LYS 282.A NZ ASP 288.A OD1 no hydrogen 2.816 N/A ALA 283.A N ILE 279.A O no hydrogen 2.709 N/A GLN 284.A N MET 280.A O no hydrogen 2.904 N/A GLN 284.A NE2 LYS 216.A O no hydrogen 2.810 N/A LEU 285.A N GLY 281.A O no hydrogen 3.126 N/A GLY 286.A N LYS 282.A O no hydrogen 2.933 N/A LYS 287.A N GLY 281.A O no hydrogen 2.946 N/A LYS 287.A NZ ASN 198.A O no hydrogen 3.568 N/A GLU 292.A N GLU 292.A OE1 no hydrogen 2.816 N/A VAL 294.A N PRO 290.A O no hydrogen 3.028 N/A ASP 295.A N LYS 291.A O no hydrogen 2.991 N/A ASN 296.A N GLU 292.A O no hydrogen 2.917 N/A ILE 297.A N ASP 293.A O no hydrogen 2.850 N/A VAL 298.A N VAL 294.A O no hydrogen 2.821 N/A VAL 299.A N ASP 295.A O no hydrogen 3.072 N/A PHE 300.A N ASN 296.A O no hydrogen 2.986 N/A LEU 301.A N ILE 297.A O no hydrogen 2.773 N/A ASN 302.A N VAL 298.A O no hydrogen 2.895 N/A ASN 302.A ND2 VAL 298.A O no hydrogen 2.828 N/A ALA 303.A N PHE 300.A O no hydrogen 2.984 N/A LEU 304.A N LEU 301.A O no hydrogen 2.835 N/A SER 305.A N ASN 302.A O no hydrogen 3.150 N/A SER 305.A OG ASN 302.A O no hydrogen 3.321 N/A GLY 306.A N ASN 257.A OD1 no hydrogen 2.736 N/A ALA 312.A N SER 309.A OG no hydrogen 3.037 N/A ARG 313.A N SER 309.A O no hydrogen 3.102 N/A ARG 313.A NE VAL 308.A O no hydrogen 2.963 N/A ARG 313.A NH2 VAL 308.A O no hydrogen 3.277 N/A THR 314.A N SER 311.A O no hydrogen 3.056 N/A THR 314.A OG1 GLU 310.A O no hydrogen 2.766 N/A THR 321.A OG1 GLU 136.A OE1 no hydrogen 2.610 N/A GLU 325.A N ALA 322.A O no hydrogen 2.848 N/A SER 326.A N PRO 323.A O no hydrogen 3.057 N/A SER 326.A OG ALA 322.A O no hydrogen 2.939 N/A ASP 329.A N LYS 49.A O no hydrogen 2.942 N/A