Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3n17_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 4.A NZ SER 3.A O no hydrogen 3.346 N/A LYS 4.A NZ PRO 295.A O no hydrogen 2.811 N/A LYS 4.A NZ PHE 297.A O no hydrogen 2.777 N/A LEU 5.A N ARG 298.A O no hydrogen 2.791 N/A LEU 6.A N ASP 30.A OD2 no hydrogen 2.831 N/A VAL 7.A N LEU 300.A O no hydrogen 2.917 N/A GLY 8.A N VAL 31.A O no hydrogen 2.909 N/A TYR 9.A N SER 302.A O no hydrogen 3.080 N/A TYR 9.A OH ASP 111.A OD2 no hydrogen 2.637 N/A TYR 9.A OH ASP 113.A OD2.C no hydrogen 3.422 N/A TRP 10.A N ASN 33.A O no hydrogen 2.789 N/A TRP 10.A NE1 ILE 20.A O no hydrogen 2.679 N/A ASN 12.A N SER 35.A O no hydrogen 2.789 N/A ASN 12.A ND2 SER 49.A O no hydrogen 2.913 N/A GLY 16.A N ASP 14.A OD1 no hydrogen 2.853 N/A THR 17.A N ASN 15.A OD1 no hydrogen 3.190 N/A THR 17.A OG1 HIS 11.A ND1 no hydrogen 3.275 N/A THR 17.A OG1 ASN 15.A OD1 no hydrogen 2.776 N/A GLY 18.A N ASP 14.A OD1 no hydrogen 2.983 N/A LEU 22.A N TYR 52.A OH no hydrogen 2.919 N/A ASP 24.A N LYS 21.A O no hydrogen 2.843 N/A VAL 25.A N LEU 22.A O no hydrogen 3.142 N/A LYS 28.A N SER 26.A OG no hydrogen 3.241 N/A LYS 28.A NZ ASN 317.A OD1 no hydrogen 3.167 N/A TRP 29.A N SER 26.A O no hydrogen 3.315 N/A ASP 30.A N LEU 6.A O no hydrogen 2.845 N/A VAL 31.A N LEU 6.A O no hydrogen 3.353 N/A ILE 32.A N LYS 71.A O no hydrogen 2.847 N/A ASN 33.A N GLY 8.A O no hydrogen 2.831 N/A VAL 34.A N VAL 73.A O no hydrogen 2.739 N/A SER 35.A N TRP 10.A O no hydrogen 2.918 N/A SER 35.A OG TRP 10.A O no hydrogen 3.421 N/A SER 35.A OG ASN 33.A O no hydrogen 2.922 N/A GLY 37.A N SER 75.A O no hydrogen 2.769 N/A GLU 38.A N GLU 47.A O no hydrogen 3.238 N/A THR 39.A OG1 VAL 82.A O no hydrogen 2.532 N/A ARG 43.A N GLY 40.A O no hydrogen 3.063 N/A ARG 43.A NH1 GLY 40.A O no hydrogen 3.368 N/A SER 44.A N ASP 42.A OD1 no hydrogen 2.899 N/A SER 44.A OG ASP 42.A O no hydrogen 2.911 N/A THR 45.A N ASP 42.A OD1 no hydrogen 2.894 N/A THR 45.A OG1 ASP 42.A OD2 no hydrogen 2.618 N/A VAL 46.A N SER 97.A OG no hydrogen 2.888 N/A GLU 47.A N GLU 38.A O no hydrogen 2.746 N/A VAL 51.A N ASN 12.A OD1 no hydrogen 2.800 N/A TYR 52.A OH ASP 61.A OD2 no hydrogen 2.686 N/A THR 54.A N ASP 57.A OD2 no hydrogen 3.487 N/A ASP 57.A N THR 54.A OG1 no hydrogen 2.939 N/A PHE 58.A N THR 54.A O no hydrogen 2.973 N/A LYS 59.A N ASP 55.A O no hydrogen 2.972 N/A SER 60.A N ALA 56.A O no hydrogen 2.872 N/A ASP 61.A N ASP 57.A O no hydrogen 2.888 N/A ILE 62.A N PHE 58.A O no hydrogen 2.952 N/A SER 63.A N LYS 59.A O no hydrogen 2.891 N/A SER 63.A OG LYS 59.A O no hydrogen 3.196 N/A TYR 64.A N SER 60.A O no hydrogen 2.881 N/A LEU 65.A N ASP 61.A O no hydrogen 3.083 N/A LYS 66.A N ILE 62.A O no hydrogen 2.918 N/A LYS 66.A NZ GLY 106.A O no hydrogen 2.816 N/A SER 67.A N SER 63.A O no hydrogen 2.929 N/A SER 67.A OG TYR 64.A O no hydrogen 2.585 N/A LYS 68.A N TYR 64.A O no hydrogen 3.252 N/A LYS 68.A N LEU 65.A O no hydrogen 2.939 N/A GLY 69.A N LYS 66.A O no hydrogen 3.032 N/A LYS 70.A N LEU 65.A O no hydrogen 3.097 N/A LYS 70.A NZ PRO 27.A O no hydrogen 2.715 N/A LYS 71.A N ASP 30.A O no hydrogen 3.084 N/A VAL 72.A N ASP 108.A OD2 no hydrogen 2.840 N/A VAL 73.A N ILE 32.A O no hydrogen 2.811 N/A LEU 74.A N GLY 109.A O no hydrogen 3.058 N/A SER 75.A N VAL 34.A O no hydrogen 2.861 N/A SER 75.A OG ASP 111.A OD2 no hydrogen 2.748 N/A SER 75.A OG ASP 113.A OD2.C no hydrogen 3.420 N/A ILE 76.A N ASP 111.A O no hydrogen 2.833 N/A GLY 77.A N GLY 37.A O no hydrogen 3.055 N/A GLY 78.A N ASP 113.A O no hydrogen 2.800 N/A LEU 84.A N ARG 43.A O no hydrogen 2.785 N/A LEU 85.A N GLN 134.A OE1 no hydrogen 2.711 N/A ALA 90.A N ASP 87.A OD1 no hydrogen 3.027 N/A LYS 91.A N ASP 87.A O no hydrogen 3.030 N/A LYS 91.A NZ SER 140.A OG no hydrogen 2.903 N/A ASP 92.A N ASN 88.A O no hydrogen 2.877 N/A ARG 93.A N ALA 89.A O no hydrogen 3.153 N/A ARG 93.A NE SER 44.A OG no hydrogen 2.948 N/A PHE 94.A N ALA 90.A O no hydrogen 3.062 N/A ILE 95.A N LYS 91.A O no hydrogen 2.943 N/A ASN 96.A N ASP 92.A O no hydrogen 2.941 N/A SER 97.A N ARG 93.A O no hydrogen 2.943 N/A SER 97.A OG ARG 93.A O no hydrogen 2.959 N/A SER 97.A OG PHE 94.A O no hydrogen 3.015 N/A ILE 98.A N PHE 94.A O no hydrogen 3.064 N/A GLN 99.A N ILE 95.A O no hydrogen 2.972 N/A SER 100.A N ASN 96.A O no hydrogen 2.940 N/A SER 100.A OG ASN 96.A O no hydrogen 2.834 N/A LEU 101.A N SER 97.A O no hydrogen 3.124 N/A ILE 102.A N ILE 98.A O no hydrogen 2.892 N/A ASP 103.A N GLN 99.A O no hydrogen 2.901 N/A LYS 104.A N SER 100.A O no hydrogen 2.873 N/A LYS 104.A NZ ASP 55.A OD2 no hydrogen 3.423 N/A TYR 105.A N LEU 101.A O no hydrogen 3.072 N/A GLY 106.A N ILE 102.A O no hydrogen 2.793 N/A ASP 108.A N VAL 72.A O no hydrogen 2.717 N/A ILE 110.A N LEU 154.A O no hydrogen 2.915 N/A ASP 111.A N LEU 74.A O no hydrogen 2.874 N/A ILE 112.A N SER 156.A O no hydrogen 2.853 N/A ASP 113.A N ILE 76.A O no hydrogen 2.898 N/A GLN 115.A NE2.A ASP 113.A OD1.A no hydrogen 3.154 N/A GLN 115.A NE2.A ASP 113.A OD1.C no hydrogen 2.924 N/A GLN 115.A NE2.B ASP 113.A OD1.A no hydrogen 2.567 N/A GLN 115.A NE2.B ASP 113.A OD1.C no hydrogen 2.737 N/A GLN 115.A NE2.B ALA 158.A O no hydrogen 2.974 N/A LEU 120.A N SER 173.A O no hydrogen 2.810 N/A ASN 121.A N THR 132.A OG1 no hydrogen 2.868 N/A ASP 124.A N ASN 121.A O no hydrogen 3.034 N/A LYS 128.A N ASN 126.A OD1 no hydrogen 2.852 N/A ASN 129.A N ASN 126.A O no hydrogen 2.966 N/A THR 131.A N ASP 124.A OD1 no hydrogen 3.142 N/A THR 131.A N ASP 124.A OD2 no hydrogen 3.217 N/A THR 132.A N ASP 124.A OD2 no hydrogen 2.907 N/A THR 132.A OG1 ASP 124.A OD2 no hydrogen 2.643 N/A GLN 134.A NE2 VAL 83.A O no hydrogen 2.772 N/A VAL 136.A N THR 132.A O no hydrogen 2.942 N/A ASN 137.A N PRO 133.A O no hydrogen 2.750 N/A ASN 137.A ND2 LEU 85.A O no hydrogen 2.807 N/A LEU 138.A N GLN 134.A O no hydrogen 2.935 N/A ILE 139.A N ILE 135.A O no hydrogen 3.002 N/A SER 140.A N VAL 136.A O no hydrogen 3.030 N/A ALA 141.A N ASN 137.A O no hydrogen 2.858 N/A ILE 142.A N LEU 138.A O no hydrogen 2.869 N/A ARG 143.A N ILE 139.A O no hydrogen 3.016 N/A ARG 143.A NH1 GLY 184.A O no hydrogen 2.877 N/A ARG 143.A NH1 ASP 187.A OD1 no hydrogen 2.777 N/A ARG 143.A NH2 ASP 187.A OD2 no hydrogen 3.055 N/A THR 144.A N SER 140.A O no hydrogen 2.947 N/A THR 144.A OG1 SER 140.A O no hydrogen 2.877 N/A ILE 145.A N ALA 141.A O no hydrogen 2.856 N/A SER 146.A N ILE 142.A O no hydrogen 2.991 N/A ASP 147.A N ARG 143.A O no hydrogen 2.935 N/A HIS 148.A N ILE 145.A O no hydrogen 2.942 N/A TYR 149.A N SER 146.A O no hydrogen 3.166 N/A TYR 149.A OH ASP 103.A OD1 no hydrogen 2.813 N/A PHE 153.A N GLY 150.A O no hydrogen 3.250 N/A LEU 154.A N ASP 108.A O no hydrogen 2.916 N/A LEU 155.A N THR 190.A OG1 no hydrogen 2.954 N/A SER 156.A N ILE 110.A O no hydrogen 3.023 N/A SER 156.A OG ASP 111.A OD1 no hydrogen 2.717 N/A ALA 158.A N ILE 112.A O no hydrogen 2.907 N/A TYR 163.A N GLU 160.A O no hydrogen 3.092 N/A VAL 164.A N THR 161.A O no hydrogen 2.956 N/A GLN 165.A N GLN 165.A OE1 no hydrogen 2.796 N/A GLN 165.A NE2 MET 221.A O no hydrogen 2.957 N/A GLY 166.A N THR 161.A O no hydrogen 2.867 N/A GLY 167.A N VAL 164.A O no hydrogen 2.848 N/A TYR 168.A N GLN 165.A O no hydrogen 2.958 N/A SER 169.A N GLY 166.A O no hydrogen 2.880 N/A ALA 170.A N GLY 166.A O no hydrogen 3.190 N/A GLY 172.A N TRP 175.A O no hydrogen 2.981 N/A SER 173.A N LEU 120.A O no hydrogen 2.998 N/A TRP 175.A N GLY 172.A O no hydrogen 2.936 N/A GLY 176.A N ALA 162.A O no hydrogen 3.006 N/A ALA 177.A N ILE 174.A O no hydrogen 3.000 N/A TYR 178.A N TYR 163.A O no hydrogen 2.924 N/A TYR 178.A OH LEU 114.A O no hydrogen 2.762 N/A LEU 179.A N GLY 176.A O no hydrogen 2.900 N/A ILE 182.A N TYR 178.A O no hydrogen 2.810 N/A TYR 183.A N LEU 179.A O no hydrogen 2.922 N/A GLY 184.A N PRO 180.A O no hydrogen 2.837 N/A VAL 185.A N ILE 181.A O no hydrogen 3.080 N/A VAL 185.A N ILE 182.A O no hydrogen 3.236 N/A LYS 186.A N TYR 183.A O no hydrogen 3.446 N/A LYS 186.A NZ TYR 183.A O no hydrogen 2.860 N/A ASP 187.A N ASP 187.A OD1 no hydrogen 2.661 N/A LYS 188.A N VAL 185.A O no hydrogen 2.800 N/A LYS 188.A NZ ASP 147.A OD1 no hydrogen 2.895 N/A LYS 188.A NZ ASP 147.A OD2 no hydrogen 3.512 N/A LEU 189.A N LYS 186.A O no hydrogen 3.390 N/A THR 190.A N LEU 155.A O no hydrogen 2.835 N/A THR 190.A OG1 LEU 155.A O no hydrogen 3.366 N/A TYR 191.A N LEU 155.A O no hydrogen 3.456 N/A ILE 192.A N GLN 246.A O no hydrogen 2.806 N/A HIS 193.A N MET 157.A O no hydrogen 2.971 N/A HIS 193.A ND1 HIS 193.A O no hydrogen 2.898 N/A GLN 195.A N PRO 159.A O no hydrogen 3.081 N/A GLN 195.A NE2 ALA 158.A O no hydrogen 2.943 N/A HIS 196.A N GLY 250.A O no hydrogen 2.944 N/A HIS 196.A ND1 GLU 218.A OE1 no hydrogen 2.842 N/A ASN 198.A N GLY 261.A O no hydrogen 2.898 N/A ALA 199.A N GLN 212.A OE1 no hydrogen 2.892 N/A GLY 202.A N TYR 210.A O no hydrogen 2.856 N/A GLY 204.A N ASN 208.A O no hydrogen 2.901 N/A GLY 207.A N GLY 204.A O no hydrogen 2.767 N/A ASN 208.A N ASP 206.A OD1 no hydrogen 3.073 N/A TYR 210.A N GLY 202.A O no hydrogen 2.851 N/A TYR 210.A OH ASP 206.A OD2 no hydrogen 2.539 N/A GLN 212.A N GLY 200.A O no hydrogen 2.930 N/A GLN 212.A NE2 SER 260.A O no hydrogen 3.062 N/A THR 214.A OG1 ASN 211.A O no hydrogen 2.772 N/A TYR 217.A N THR 214.A OG1 no hydrogen 3.307 N/A GLU 218.A N THR 214.A O no hydrogen 3.115 N/A VAL 219.A N ALA 215.A O no hydrogen 3.099 N/A ALA 220.A N ASP 216.A O no hydrogen 2.857 N/A MET 221.A N TYR 217.A O no hydrogen 2.921 N/A ALA 222.A N GLU 218.A O no hydrogen 3.052 N/A ASP 223.A N VAL 219.A O no hydrogen 2.880 N/A LEU 225.A N ALA 222.A O no hydrogen 3.041 N/A LEU 226.A N ALA 222.A O no hydrogen 3.037 N/A HIS 227.A N ASP 223.A O no hydrogen 2.815 N/A HIS 227.A ND1 GLY 228.A O no hydrogen 2.951 N/A GLY 228.A N MET 224.A O no hydrogen 2.859 N/A PHE 229.A N PHE 239.A O no hydrogen 3.019 N/A VAL 231.A N ASN 237.A O no hydrogen 2.794 N/A GLY 232.A N GLY 167.A O no hydrogen 2.735 N/A ASN 234.A N VAL 231.A O no hydrogen 2.999 N/A ASN 236.A N ASN 234.A OD1 no hydrogen 2.834 N/A ASN 237.A N ASN 234.A O no hydrogen 3.044 N/A PHE 239.A N PHE 229.A O no hydrogen 2.764 N/A LEU 242.A N LEU 225.A O no hydrogen 3.017 N/A ARG 243.A N GLN 246.A OE1 no hydrogen 2.995 N/A ARG 243.A NE ASP 245.A OD1 no hydrogen 2.916 N/A GLN 246.A N ARG 243.A O no hydrogen 2.889 N/A GLN 246.A NE2 LYS 186.A O no hydrogen 2.955 N/A GLN 246.A NE2 LEU 189.A O no hydrogen 2.936 N/A VAL 247.A N SER 244.A O no hydrogen 3.008 N/A MET 248.A N ILE 192.A O no hydrogen 2.967 N/A ILE 249.A N GLY 299.A O no hydrogen 3.199 N/A GLY 250.A N VAL 194.A O no hydrogen 2.921 N/A LEU 251.A N MET 301.A O no hydrogen 2.858 N/A ALA 253.A N TRP 303.A O no hydrogen 2.864 N/A ALA 257.A N ALA 254.A O no hydrogen 2.969 N/A ALA 258.A N PRO 255.A O no hydrogen 3.406 N/A SER 260.A N ASN 198.A OD1 no hydrogen 3.052 N/A GLY 261.A N ALA 258.A O no hydrogen 2.899 N/A TYR 263.A OH GLU 314.A OE1 no hydrogen 2.552 N/A TYR 263.A OH GLU 314.A OE2 no hydrogen 3.336 N/A GLU 268.A N SER 265.A OG no hydrogen 3.215 N/A MET 269.A N SER 265.A O no hydrogen 2.819 N/A LYS 270.A N PRO 266.A O no hydrogen 2.846 N/A LYS 270.A NZ ASN 318.A OD1 no hydrogen 2.819 N/A LYS 271.A NZ GLU 268.A OE2 no hydrogen 2.786 N/A ALA 272.A N GLU 268.A O no hydrogen 3.324 N/A LEU 273.A N MET 269.A O no hydrogen 2.803 N/A ASN 274.A N LYS 270.A O no hydrogen 2.876 N/A TYR 275.A N LYS 271.A O no hydrogen 3.087 N/A TYR 275.A OH GLN 291.A OE1 no hydrogen 2.621 N/A ILE 276.A N ALA 272.A O no hydrogen 2.860 N/A ILE 277.A N LEU 273.A O no hydrogen 2.865 N/A LYS 278.A N ASN 274.A O no hydrogen 3.011 N/A GLY 279.A N TYR 275.A O no hydrogen 2.776 N/A VAL 280.A N ASN 274.A O no hydrogen 3.314 N/A LYS 285.A N ASP 216.A OD2 no hydrogen 2.818 N/A TYR 286.A N ASP 216.A OD1 no hydrogen 3.056 N/A TYR 286.A OH ASP 223.A OD2 no hydrogen 2.553 N/A LEU 288.A N TYR 275.A OH no hydrogen 2.980 N/A SER 289.A N ASP 223.A OD2 no hydrogen 2.941 N/A SER 289.A OG ASP 223.A OD1 no hydrogen 2.591 N/A SER 289.A OG ASP 223.A OD2 no hydrogen 3.270 N/A SER 289.A OG TYR 294.A OH no hydrogen 2.644 N/A ASN 290.A ND2 SER 292.A OG no hydrogen 3.141 N/A GLY 293.A N ASN 290.A O no hydrogen 2.992 N/A TYR 294.A N ILE 276.A O no hydrogen 2.739 N/A TYR 294.A OH SER 289.A OG no hydrogen 2.644 N/A PHE 297.A N TYR 294.A O no hydrogen 3.015 N/A ARG 298.A N VAL 247.A O no hydrogen 2.908 N/A ARG 298.A NE GLY 2.A O no hydrogen 2.869 N/A ARG 298.A NH1 ASP 245.A O no hydrogen 2.851 N/A ARG 298.A NH2 GLY 2.A O no hydrogen 3.115 N/A LEU 300.A N LEU 5.A O no hydrogen 2.959 N/A MET 301.A N ILE 249.A O no hydrogen 2.862 N/A SER 302.A N VAL 7.A O no hydrogen 2.825 N/A SER 302.A OG LEU 251.A O no hydrogen 2.988 N/A TRP 303.A N LEU 251.A O no hydrogen 3.128 N/A SER 304.A OG HIS 11.A NE2 no hydrogen 2.715 N/A ILE 305.A N TYR 9.A O no hydrogen 2.726 N/A TRP 307.A N SER 304.A OG no hydrogen 3.070 N/A ASP 308.A N SER 304.A O no hydrogen 2.908 N/A ALA 309.A N ILE 305.A O no hydrogen 3.072 N/A LYS 310.A N ASN 306.A O no hydrogen 3.337 N/A LYS 310.A N TRP 307.A O no hydrogen 3.072 N/A ASN 311.A N ASP 308.A O no hydrogen 2.980 N/A ASN 311.A ND2 ALA 253.A O no hydrogen 3.347 N/A PHE 313.A N ASP 308.A O no hydrogen 2.930 N/A GLU 314.A N ASN 311.A O no hydrogen 3.028 N/A SER 316.A N ASP 308.A OD1 no hydrogen 3.055 N/A SER 316.A OG ASP 308.A OD1 no hydrogen 3.540 N/A SER 316.A OG ASP 308.A OD2 no hydrogen 2.670 N/A SER 316.A OG PHE 313.A O no hydrogen 3.436 N/A ASN 317.A N PHE 313.A O no hydrogen 2.922 N/A ASN 318.A N GLU 314.A O no hydrogen 2.977 N/A ASN 318.A ND2 GLU 314.A O no hydrogen 2.881 N/A TYR 319.A N PHE 315.A O no hydrogen 2.976 N/A ARG 320.A N SER 316.A O no hydrogen 2.967 N/A ARG 320.A NE ASP 324.A OD1 no hydrogen 3.069 N/A ARG 320.A NH1 LYS 4.A O no hydrogen 2.962 N/A ARG 320.A NH2 LYS 28.A O no hydrogen 2.904 N/A ARG 320.A NH2 ASP 30.A OD2 no hydrogen 2.740 N/A THR 321.A N ASN 317.A O no hydrogen 3.190 N/A THR 321.A OG1 ASN 317.A O no hydrogen 3.062 N/A TYR 322.A N ASN 318.A O no hydrogen 2.995 N/A PHE 323.A N TYR 319.A O no hydrogen 2.886 N/A ASP 324.A N ARG 320.A O no hydrogen 2.813 N/A GLY 325.A N THR 321.A O no hydrogen 2.993 N/A GLY 325.A N TYR 322.A O no hydrogen 3.213 N/A LEU 326.A N PHE 323.A O no hydrogen 3.346 N/A