Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6ioj_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 1.A N ASP 24.A O no hydrogen 3.036 N/A LYS 2.A N ASP 89.A OD2 no hydrogen 3.002 N/A LYS 2.A NZ GLU 26.A OE1 no hydrogen 3.431 N/A VAL 3.A N GLU 26.A O no hydrogen 2.879 N/A GLY 4.A N VAL 90.A O no hydrogen 3.208 N/A ILE 5.A N ALA 29.A O no hydrogen 2.890 N/A ASN 6.A N ALA 92.A O no hydrogen 3.109 N/A ASN 6.A ND2 GLU 93.A OE1 no hydrogen 3.447 N/A GLY 7.A N ASN 31.A O no hydrogen 2.664 N/A PHE 8.A N ASP 32.A OD2 no hydrogen 2.546 N/A ARG 10.A NE GLU 313.A OE2 no hydrogen 3.212 N/A ARG 10.A NH1 ASP 46.A OD2 no hydrogen 2.664 N/A ARG 10.A NH2 ASP 46.A OD1 no hydrogen 3.150 N/A ARG 10.A NH2 ASP 46.A OD2 no hydrogen 3.175 N/A ARG 10.A NH2 GLU 313.A OE1 no hydrogen 2.830 N/A ARG 13.A N GLY 9.A O no hydrogen 2.895 N/A ARG 13.A NH1 PHE 8.A O no hydrogen 2.900 N/A ILE 14.A N ARG 10.A O no hydrogen 3.216 N/A VAL 15.A N ILE 11.A O no hydrogen 2.797 N/A PHE 16.A N GLY 12.A O no hydrogen 2.999 N/A ARG 17.A N ARG 13.A O no hydrogen 2.922 N/A ARG 17.A NH1 HIS 49.A O no hydrogen 3.407 N/A ARG 17.A NH1 GLY 50.A O no hydrogen 2.891 N/A ARG 17.A NH2 LEU 43.A O no hydrogen 2.811 N/A ARG 17.A NH2 GLY 50.A O no hydrogen 2.889 N/A ALA 18.A N ILE 14.A O no hydrogen 2.863 N/A ALA 19.A N VAL 15.A O no hydrogen 2.954 N/A GLN 20.A N ARG 17.A O no hydrogen 3.195 N/A GLN 20.A NE2 PHE 16.A O no hydrogen 2.964 N/A LYS 21.A N ALA 18.A O no hydrogen 3.165 N/A ARG 22.A N ALA 19.A O no hydrogen 3.164 N/A ARG 22.A NE ASP 24.A OD1 no hydrogen 3.185 N/A ARG 22.A NH1 ASP 322.A OD1 no hydrogen 2.741 N/A ARG 22.A NH2 ASP 24.A OD2 no hydrogen 3.075 N/A ASP 24.A N ASP 24.A OD1 no hydrogen 2.545 N/A GLU 26.A N ILE 1.A O no hydrogen 2.772 N/A VAL 28.A N VAL 3.A O no hydrogen 2.968 N/A ILE 30.A N ARG 71.A O no hydrogen 2.879 N/A ASN 31.A N ILE 5.A O no hydrogen 2.876 N/A ASN 31.A ND2 ASN 6.A OD1 no hydrogen 2.584 N/A ASN 31.A ND2 GLU 75.A O no hydrogen 3.072 N/A ASP 32.A N THR 73.A O no hydrogen 3.223 N/A LEU 33.A N ASP 32.A OD1 no hydrogen 2.450 N/A TYR 38.A N ASP 37.A OD2 no hydrogen 2.610 N/A MET 39.A N ASP 35.A O no hydrogen 2.953 N/A ALA 40.A N ALA 36.A O no hydrogen 2.844 N/A TYR 41.A N ASP 37.A O no hydrogen 3.070 N/A MET 42.A N TYR 38.A O no hydrogen 2.949 N/A LEU 43.A N MET 39.A O no hydrogen 3.059 N/A LEU 43.A N ALA 40.A O no hydrogen 3.113 N/A LYS 44.A N ALA 40.A O no hydrogen 2.865 N/A TYR 45.A N TYR 41.A O no hydrogen 3.128 N/A THR 48.A N ASP 46.A OD1 no hydrogen 3.001 N/A HIS 49.A N ASP 46.A OD1 no hydrogen 2.853 N/A HIS 49.A NE2 GLU 313.A OE1 no hydrogen 2.893 N/A GLY 50.A N ASP 46.A O no hydrogen 2.938 N/A PHE 52.A N LYS 44.A O no hydrogen 2.819 N/A THR 55.A N ASN 66.A OD1 no hydrogen 3.079 N/A THR 55.A OG1 ASN 66.A OD1 no hydrogen 3.385 N/A GLU 57.A N ILE 64.A O no hydrogen 3.150 N/A LYS 59.A N HIS 62.A O no hydrogen 2.958 N/A HIS 62.A N LYS 59.A O no hydrogen 3.017 N/A LEU 63.A N ILE 70.A O no hydrogen 3.354 N/A ILE 64.A N GLU 57.A O no hydrogen 2.782 N/A VAL 65.A N LYS 68.A O no hydrogen 2.794 N/A ASN 66.A N THR 55.A O no hydrogen 3.018 N/A LYS 68.A N VAL 65.A O no hydrogen 3.082 N/A ILE 70.A N LEU 63.A O no hydrogen 2.728 N/A ARG 71.A N VAL 28.A O no hydrogen 2.924 N/A ARG 71.A NH2 LYS 82.A O no hydrogen 2.411 N/A VAL 72.A N HIS 62.A ND1 no hydrogen 2.982 N/A THR 73.A N ILE 30.A O no hydrogen 2.989 N/A THR 73.A OG1 ILE 30.A O no hydrogen 3.200 N/A THR 73.A OG1 ASN 31.A OD1 no hydrogen 2.666 N/A GLU 75.A N ASN 31.A OD1 no hydrogen 3.007 N/A ASN 80.A N GLY 77.A O no hydrogen 2.959 N/A TRP 83.A NE1 HIS 107.A ND1 no hydrogen 2.991 N/A GLU 85.A N LYS 82.A O no hydrogen 3.443 N/A GLY 87.A N ASP 84.A O no hydrogen 2.948 N/A ASP 89.A N LYS 2.A O no hydrogen 2.708 N/A VAL 90.A N LYS 2.A O no hydrogen 3.390 N/A VAL 91.A N LYS 114.A O no hydrogen 2.952 N/A ALA 92.A N GLY 4.A O no hydrogen 2.881 N/A GLU 93.A N VAL 116.A O no hydrogen 2.746 N/A ALA 94.A N ASN 6.A O no hydrogen 2.943 N/A THR 95.A N GLU 93.A OE2 no hydrogen 3.149 N/A THR 95.A OG1 GLU 93.A OE2 no hydrogen 2.506 N/A LEU 97.A N THR 95.A OG1 no hydrogen 2.979 N/A THR 100.A N THR 103.A OG1 no hydrogen 2.686 N/A THR 100.A OG1 THR 103.A OG1 no hydrogen 2.888 N/A ASP 101.A N ASP 123.A OD2 no hydrogen 2.794 N/A THR 103.A N THR 100.A OG1 no hydrogen 2.829 N/A THR 103.A OG1 THR 100.A O no hydrogen 2.884 N/A THR 103.A OG1 THR 100.A OG1 no hydrogen 2.888 N/A ALA 104.A N THR 100.A O no hydrogen 3.486 N/A ARG 105.A N ASP 101.A O no hydrogen 2.819 N/A ARG 105.A NE ASP 101.A OD1 no hydrogen 3.421 N/A ARG 105.A NE ASP 101.A OD2 no hydrogen 3.019 N/A ARG 105.A NH1 ASP 141.A OD2 no hydrogen 2.666 N/A ARG 105.A NH2 ASP 101.A OD1 no hydrogen 3.195 N/A ARG 105.A NH2 ASP 141.A OD1 no hydrogen 3.065 N/A ARG 105.A NH2 ASP 141.A OD2 no hydrogen 2.788 N/A HIS 107.A N ALA 104.A O no hydrogen 2.913 N/A HIS 107.A NE2 GLU 93.A OE1 no hydrogen 3.246 N/A ILE 108.A N ARG 105.A O no hydrogen 2.840 N/A THR 109.A N ARG 105.A O no hydrogen 2.957 N/A THR 109.A OG1 LYS 106.A O no hydrogen 2.963 N/A ALA 110.A N LYS 106.A O no hydrogen 3.092 N/A ALA 110.A N HIS 107.A O no hydrogen 3.234 N/A GLY 111.A N ILE 108.A O no hydrogen 3.199 N/A ALA 112.A N HIS 107.A O no hydrogen 3.102 N/A LYS 113.A N ASP 89.A O no hydrogen 2.991 N/A LYS 114.A N ASP 89.A O no hydrogen 3.046 N/A LYS 114.A NZ TYR 137.A OH no hydrogen 3.471 N/A LYS 114.A NZ ILE 327.A O no hydrogen 2.703 N/A VAL 115.A N ASP 141.A O no hydrogen 3.093 N/A VAL 116.A N VAL 91.A O no hydrogen 2.821 N/A MET 117.A N VAL 143.A O no hydrogen 2.785 N/A THR 118.A N GLU 93.A O no hydrogen 2.989 N/A THR 118.A OG1 GLU 93.A O no hydrogen 3.250 N/A SER 121.A OG THR 125.A O no hydrogen 3.158 N/A LYS 122.A N LEU 99.A O no hydrogen 3.119 N/A THR 125.A N ASP 123.A OD1 no hydrogen 3.099 N/A THR 125.A OG1 ASP 123.A OD1 no hydrogen 2.736 N/A THR 125.A OG1 ASP 123.A OD2 no hydrogen 3.196 N/A PHE 128.A N SER 144.A O no hydrogen 2.827 N/A VAL 129.A N ASN 133.A OD1 no hydrogen 2.956 N/A LYS 130.A NZ ASP 322.A OD2 no hydrogen 3.236 N/A ALA 132.A N VAL 129.A O no hydrogen 2.876 N/A ASN 133.A N VAL 129.A O no hydrogen 3.045 N/A ASN 133.A ND2 MET 127.A O no hydrogen 3.212 N/A ASP 135.A N ASP 135.A OD1 no hydrogen 2.499 N/A LYS 136.A N ASN 133.A O no hydrogen 3.046 N/A LYS 136.A NZ ASP 135.A OD2 no hydrogen 3.305 N/A TYR 137.A N PHE 134.A O no hydrogen 3.169 N/A TYR 137.A OH GLN 140.A O no hydrogen 2.470 N/A ALA 138.A N GLN 140.A OE1 no hydrogen 2.809 N/A GLN 140.A N GLN 140.A OE1 no hydrogen 2.702 N/A VAL 143.A N VAL 115.A O no hydrogen 3.153 N/A SER 144.A N PRO 126.A O no hydrogen 2.935 N/A SER 144.A OG GLY 119.A O no hydrogen 2.588 N/A ASN 145.A N MET 117.A O no hydrogen 3.082 N/A ALA 146.A N SER 144.A OG no hydrogen 3.013 N/A SER 147.A N THR 150.A OG1 no hydrogen 2.708 N/A SER 147.A OG THR 150.A OG1 no hydrogen 2.947 N/A CYS 148.A SG HIS 175.A NE2 no hydrogen 3.548 N/A THR 149.A OG1 TYR 310.A OH no hydrogen 2.642 N/A THR 150.A N SER 147.A OG no hydrogen 3.275 N/A THR 150.A OG1 SER 147.A O no hydrogen 2.674 N/A THR 150.A OG1 SER 147.A OG no hydrogen 2.947 N/A ASN 151.A N SER 147.A O no hydrogen 3.087 N/A ASN 151.A ND2 ASN 145.A O no hydrogen 2.887 N/A ASN 151.A ND2 SER 147.A O no hydrogen 3.068 N/A CYS 152.A N CYS 148.A O no hydrogen 3.295 N/A CYS 152.A N THR 149.A O no hydrogen 3.147 N/A CYS 152.A SG SER 289.A OG no hydrogen 3.561 N/A CYS 152.A SG SER 308.A O no hydrogen 3.698 N/A CYS 152.A SG SER 308.A OG no hydrogen 3.627 N/A LEU 153.A N THR 149.A O no hydrogen 2.890 N/A ALA 154.A N THR 150.A O no hydrogen 2.845 N/A ALA 157.A N LEU 153.A O no hydrogen 2.752 N/A LYS 158.A N ALA 154.A O no hydrogen 2.835 N/A LYS 158.A NZ ASP 162.A OD2 no hydrogen 2.763 N/A VAL 159.A N PRO 155.A O no hydrogen 3.244 N/A ILE 160.A N LEU 156.A O no hydrogen 3.043 N/A ASN 161.A N ALA 157.A O no hydrogen 2.822 N/A ASN 161.A ND2 GLU 219.A OE2 no hydrogen 3.077 N/A ASP 162.A N LYS 158.A O no hydrogen 2.794 N/A ASN 163.A N VAL 159.A O no hydrogen 3.158 N/A ASN 163.A ND2 VAL 159.A O no hydrogen 2.716 N/A PHE 164.A N ILE 160.A O no hydrogen 2.866 N/A GLY 165.A N ASN 161.A O no hydrogen 2.824 N/A ILE 166.A N ASN 161.A OD1 no hydrogen 2.933 N/A ILE 167.A N ARG 244.A O no hydrogen 2.886 N/A GLY 169.A N LYS 223.A O no hydrogen 2.812 N/A LEU 170.A N THR 242.A O no hydrogen 2.775 N/A MET 171.A N THR 225.A O no hydrogen 3.045 N/A THR 172.A N ASP 240.A O no hydrogen 2.856 N/A THR 173.A N MET 227.A O no hydrogen 3.201 N/A THR 173.A OG1 VAL 238.A O no hydrogen 3.363 N/A THR 173.A OG1 TYR 310.A OH no hydrogen 2.938 N/A VAL 174.A N VAL 238.A O no hydrogen 2.853 N/A HIS 175.A N PHE 229.A O no hydrogen 2.800 N/A HIS 175.A ND1 ALA 176.A O no hydrogen 2.988 N/A ALA 176.A N SER 237.A OG no hydrogen 3.048 N/A THR 177.A N THR 233.A O no hydrogen 2.796 N/A THR 177.A OG1 VAL 231.A O no hydrogen 3.098 N/A THR 177.A OG1 THR 233.A O no hydrogen 3.325 N/A THR 178.A N GLN 181.A OE1 no hydrogen 3.250 N/A GLN 181.A N THR 178.A O no hydrogen 3.159 N/A GLY 186.A N GLY 195.A O no hydrogen 2.841 N/A SER 188.A OG ASP 191.A O no hydrogen 3.068 N/A ASP 191.A N SER 188.A O no hydrogen 3.025 N/A GLY 195.A N TRP 192.A O no hydrogen 3.209 N/A ARG 196.A N ARG 193.A O no hydrogen 3.033 N/A ARG 196.A NE ASP 185.A OD1 no hydrogen 3.328 N/A ARG 196.A NE ASP 185.A OD2 no hydrogen 3.116 N/A GLY 197.A N ASP 185.A OD1 no hydrogen 2.705 N/A ALA 198.A N LYS 182.A O no hydrogen 2.949 N/A ASN 201.A ND2 GLY 197.A O no hydrogen 2.785 N/A ILE 203.A N ARG 230.A O no hydrogen 2.775 N/A SER 205.A N ALA 228.A O no hydrogen 2.822 N/A SER 205.A OG SER 206.A O no hydrogen 3.352 N/A ALA 212.A N GLY 208.A O no hydrogen 2.804 N/A VAL 213.A N ALA 209.A O no hydrogen 3.122 N/A GLY 214.A N LYS 211.A O no hydrogen 2.926 N/A LYS 215.A N ALA 212.A O no hydrogen 2.939 N/A LEU 217.A N VAL 213.A O no hydrogen 2.717 N/A LEU 220.A N LEU 217.A O no hydrogen 2.860 N/A ASN 221.A N PRO 218.A O no hydrogen 3.187 N/A LYS 223.A N LEU 220.A O no hydrogen 3.117 N/A LYS 223.A NZ ILE 167.A O no hydrogen 3.563 N/A THR 225.A N GLY 169.A O no hydrogen 3.338 N/A MET 227.A N MET 171.A O no hydrogen 3.072 N/A ALA 228.A N SER 205.A O no hydrogen 2.892 N/A PHE 229.A N THR 173.A O no hydrogen 2.918 N/A ARG 230.A N ILE 203.A O no hydrogen 2.689 N/A ARG 230.A NH1.B THR 178.A OG1 no hydrogen 2.376 N/A ARG 230.A NH1.B GLN 181.A OE1 no hydrogen 3.009 N/A ARG 230.A NH2.A ASP 191.A OD2 no hydrogen 2.548 N/A VAL 231.A N HIS 175.A O no hydrogen 2.927 N/A THR 233.A N VAL 231.A O no hydrogen 2.768 N/A ASN 235.A ND2 ASN 283.A OD1 no hydrogen 2.985 N/A ASN 235.A ND2 ASP 311.A OD1 no hydrogen 2.810 N/A ASN 235.A ND2 ASP 311.A OD2 no hydrogen 3.120 N/A SER 237.A N TYR 310.A O no hydrogen 2.770 N/A SER 237.A OG ASN 312.A OD1 no hydrogen 2.953 N/A VAL 238.A N VAL 174.A O no hydrogen 2.969 N/A VAL 239.A N SER 308.A O no hydrogen 2.726 N/A ASP 240.A N THR 172.A O no hydrogen 2.642 N/A LEU 241.A N LEU 306.A O no hydrogen 2.727 N/A THR 242.A N LEU 170.A O no hydrogen 2.805 N/A VAL 243.A N VAL 304.A O no hydrogen 2.997 N/A ARG 244.A N GLU 168.A O no hydrogen 2.876 N/A ARG 244.A NH1 GLU 168.A OE2 no hydrogen 3.057 N/A LEU 245.A N ASN 302.A O no hydrogen 2.939 N/A GLU 246.A N GLY 165.A O no hydrogen 2.958 N/A LYS 247.A N PHE 164.A O no hydrogen 3.155 N/A ALA 249.A N ASP 301.A O no hydrogen 2.900 N/A THR 250.A N GLN 253.A OE1 no hydrogen 3.009 N/A TYR 251.A OH ALA 293.A O no hydrogen 2.524 N/A GLN 253.A N THR 250.A OG1 no hydrogen 3.149 N/A ILE 254.A N THR 250.A O no hydrogen 3.129 N/A LYS 255.A N TYR 251.A O no hydrogen 2.853 N/A LYS 255.A NZ GLU 252.A OE2 no hydrogen 2.940 N/A ALA 256.A N GLU 252.A O no hydrogen 2.988 N/A ALA 257.A N GLN 253.A O no hydrogen 2.960 N/A VAL 258.A N ILE 254.A O no hydrogen 2.966 N/A LYS 259.A N LYS 255.A O no hydrogen 2.798 N/A ALA 260.A N ALA 256.A O no hydrogen 2.910 N/A ALA 261.A N ALA 257.A O no hydrogen 3.216 N/A ALA 262.A N VAL 258.A O no hydrogen 2.866 N/A GLU 263.A N LYS 259.A O no hydrogen 2.936 N/A GLY 264.A N ALA 261.A O no hydrogen 3.119 N/A MET 266.A N ALA 261.A O no hydrogen 2.966 N/A LYS 267.A N GLY 264.A O no hydrogen 2.988 N/A VAL 269.A N MET 266.A O no hydrogen 3.027 N/A LEU 270.A N MET 266.A O no hydrogen 2.988 N/A GLY 271.A N SER 289.A O no hydrogen 2.482 N/A TYR 272.A OH GLU 274.A OE2 no hydrogen 2.625 N/A THR 273.A N PHE 291.A O no hydrogen 3.051 N/A ASP 275.A N THR 273.A OG1 no hydrogen 3.073 N/A VAL 277.A N ASP 275.A O no hydrogen 2.918 N/A VAL 278.A N ASP 281.A OD2 no hydrogen 2.788 N/A ASP 281.A N VAL 278.A O no hydrogen 2.926 N/A PHE 282.A N SER 279.A O no hydrogen 2.955 N/A ASN 283.A N THR 280.A O no hydrogen 3.096 N/A ASN 283.A ND2 THR 48.A O no hydrogen 2.862 N/A GLY 284.A N ASP 311.A OD2 no hydrogen 2.668 N/A GLU 285.A N PHE 282.A O no hydrogen 2.891 N/A CYS 287.A N GLU 285.A OE2 no hydrogen 2.969 N/A THR 288.A OG1 ASN 151.A O no hydrogen 3.524 N/A THR 288.A OG1 VAL 269.A O no hydrogen 3.422 N/A SER 289.A OG CYS 152.A O no hydrogen 2.672 N/A SER 289.A OG SER 308.A OG no hydrogen 2.744 N/A VAL 290.A N TRP 309.A O no hydrogen 2.990 N/A PHE 291.A N GLY 271.A O no hydrogen 2.811 N/A ASP 292.A N VAL 307.A O no hydrogen 2.844 N/A ALA 293.A N THR 273.A O no hydrogen 2.930 N/A LYS 294.A NZ ASP 276.A OD1 no hydrogen 3.219 N/A ALA 295.A N ASP 292.A OD1 no hydrogen 2.980 N/A ILE 297.A N LYS 305.A O no hydrogen 3.050 N/A LEU 299.A N PHE 303.A O no hydrogen 2.988 N/A ASN 300.A N PHE 303.A O no hydrogen 3.413 N/A ASN 302.A N ASN 300.A OD1 no hydrogen 2.974 N/A ASN 302.A ND2 LEU 245.A O no hydrogen 2.852 N/A VAL 304.A N VAL 243.A O no hydrogen 3.205 N/A LYS 305.A N ILE 297.A O no hydrogen 2.776 N/A LYS 305.A NZ ASP 240.A OD1 no hydrogen 2.808 N/A LYS 305.A NZ ASP 240.A OD2 no hydrogen 3.302 N/A LYS 305.A NZ THR 242.A OG1 no hydrogen 2.801 N/A LEU 306.A N LEU 241.A O no hydrogen 2.678 N/A SER 308.A N VAL 239.A O no hydrogen 2.987 N/A SER 308.A OG SER 289.A OG no hydrogen 2.744 N/A TRP 309.A N VAL 290.A O no hydrogen 2.837 N/A TRP 309.A NE1 ASP 292.A OD2 no hydrogen 2.747 N/A TYR 310.A N SER 237.A O no hydrogen 2.873 N/A TYR 310.A OH THR 149.A OG1 no hydrogen 2.642 N/A TYR 310.A OH THR 173.A OG1 no hydrogen 2.938 N/A GLU 313.A N ASP 311.A OD1 no hydrogen 2.996 N/A THR 314.A N ASP 311.A OD1 no hydrogen 2.835 N/A THR 314.A OG1 ASP 311.A OD2 no hydrogen 2.927 N/A GLY 315.A N ASP 311.A O no hydrogen 3.165 N/A TYR 316.A OH ALA 146.A O no hydrogen 2.479 N/A SER 317.A N GLU 313.A O no hydrogen 3.060 N/A SER 317.A OG GLU 313.A O no hydrogen 2.847 N/A ASN 318.A N THR 314.A O no hydrogen 3.049 N/A ASN 318.A ND2 THR 314.A O no hydrogen 2.886 N/A LYS 319.A N GLY 315.A O no hydrogen 3.096 N/A LYS 319.A NZ GLY 268.A O no hydrogen 2.813 N/A LYS 319.A NZ VAL 286.A O no hydrogen 2.953 N/A VAL 320.A N TYR 316.A O no hydrogen 2.916 N/A LEU 321.A N SER 317.A O no hydrogen 3.274 N/A ASP 322.A N ASN 318.A O no hydrogen 3.058 N/A LEU 323.A N LYS 319.A O no hydrogen 2.820 N/A ILE 324.A N VAL 320.A O no hydrogen 2.961 N/A ALA 325.A N LEU 321.A O no hydrogen 2.881 N/A HIS 326.A N ASP 322.A O no hydrogen 2.836 N/A ILE 327.A N LEU 323.A O no hydrogen 2.976 N/A SER 328.A N ALA 325.A O no hydrogen 3.212 N/A SER 328.A OG ILE 324.A O no hydrogen 3.110 N/A LYS 329.A N HIS 326.A O no hydrogen 3.344 N/A