Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3jrk_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 4.A NZ ILE 151.A O no hydrogen 3.305 N/A LYS 4.A NZ ASP 194.A OD2 no hydrogen 2.779 N/A ARG 5.A N THR 1.A O no hydrogen 2.749 N/A ARG 5.A NH2 GLU 8.A OE1 no hydrogen 3.153 N/A LYS 6.A N GLU 2.A O no hydrogen 2.979 N/A SER 7.A N ASN 3.A O no hydrogen 3.128 N/A SER 7.A OG ASN 3.A O no hydrogen 3.465 N/A LYS 9.A N LYS 6.A O no hydrogen 3.162 N/A SER 11.A N GLU 8.A O no hydrogen 3.412 N/A VAL 12.A N VAL 15.A O no hydrogen 2.971 N/A VAL 15.A N VAL 12.A O no hydrogen 3.073 N/A ILE 16.A N ASN 263.A O no hydrogen 2.946 N/A SER 17.A N SER 58.A OG no hydrogen 2.926 N/A SER 17.A OG SER 58.A OG no hydrogen 3.423 N/A ALA 18.A N VAL 265.A O no hydrogen 3.233 N/A LEU 19.A N SER 59.A O no hydrogen 3.017 N/A ALA 20.A N CYS 267.A O no hydrogen 2.992 N/A PHE 21.A N LEU 61.A O no hydrogen 2.847 N/A GLN 23.A N GLN 23.A OE1 no hydrogen 2.726 N/A ARG 24.A NE ASP 22.A O no hydrogen 3.128 N/A ARG 24.A NH1 GLU 65.A OE2 no hydrogen 2.878 N/A ARG 24.A NH1 GLU 85.A O no hydrogen 3.036 N/A ARG 24.A NH2 GLU 85.A O no hydrogen 3.483 N/A LYS 28.A N ARG 24.A O no hydrogen 3.021 N/A LYS 28.A NZ TYR 66.A OH no hydrogen 2.680 N/A ARG 29.A N GLY 25.A O no hydrogen 3.073 N/A GLN 33.A NE2 LYS 35.A O no hydrogen 3.177 N/A GLN 33.A NE2 GLN 41.A OE1 no hydrogen 3.104 N/A THR 38.A N GLN 41.A OE1 no hydrogen 3.043 N/A GLN 41.A N THR 38.A OG1 no hydrogen 2.922 N/A GLN 41.A NE2 GLN 33.A OE1 no hydrogen 3.005 N/A ILE 42.A N THR 38.A O no hydrogen 3.021 N/A GLU 43.A N VAL 39.A O no hydrogen 2.894 N/A GLU 44.A N GLU 40.A O no hydrogen 2.923 N/A LEU 45.A N GLN 41.A O no hydrogen 3.067 N/A LYS 46.A N ILE 42.A O no hydrogen 3.198 N/A LYS 46.A NZ PHE 21.A O no hydrogen 2.784 N/A LYS 46.A NZ GLN 23.A O no hydrogen 2.734 N/A LYS 46.A NZ ASP 63.A OD1 no hydrogen 2.720 N/A SER 47.A N GLU 43.A O no hydrogen 2.991 N/A SER 47.A OG GLU 43.A O no hydrogen 3.223 N/A LEU 48.A N GLU 44.A O no hydrogen 2.918 N/A VAL 49.A N LEU 45.A O no hydrogen 3.176 N/A SER 50.A N LYS 46.A O no hydrogen 3.025 N/A SER 50.A OG ALA 70.A O no hydrogen 2.731 N/A GLU 51.A N SER 47.A O no hydrogen 2.845 N/A GLU 52.A N LEU 48.A O no hydrogen 2.877 N/A LEU 53.A N VAL 49.A O no hydrogen 2.947 N/A THR 54.A N SER 50.A O no hydrogen 3.193 N/A THR 54.A OG1 SER 50.A O no hydrogen 2.543 N/A PHE 56.A N LEU 53.A O no hydrogen 2.895 N/A ALA 57.A N THR 54.A O no hydrogen 3.176 N/A SER 58.A N SER 17.A O no hydrogen 2.878 N/A SER 58.A OG LEU 10.A O no hydrogen 2.736 N/A SER 58.A OG SER 17.A OG no hydrogen 3.423 N/A SER 59.A OG LEU 10.A O no hydrogen 3.083 N/A ILE 60.A N GLY 79.A O no hydrogen 2.903 N/A LEU 61.A N LEU 19.A O no hydrogen 2.886 N/A LEU 62.A N LEU 81.A O no hydrogen 3.017 N/A TYR 66.A N ASP 63.A OD2 no hydrogen 2.808 N/A GLY 67.A N ASP 63.A O no hydrogen 2.845 N/A SER 71.A N GLY 67.A O no hydrogen 2.841 N/A SER 71.A OG LEU 68.A O no hydrogen 2.629 N/A ARG 72.A N.A LEU 68.A O no hydrogen 3.283 N/A ARG 72.A N.A PRO 69.A O no hydrogen 3.183 N/A ARG 72.A N.B LEU 68.A O no hydrogen 3.278 N/A ARG 72.A N.B PRO 69.A O no hydrogen 3.198 N/A VAL 73.A N ALA 70.A O no hydrogen 3.299 N/A ARG 74.A NE ALA 78.A O no hydrogen 2.868 N/A ARG 74.A NH1 SER 71.A O no hydrogen 2.799 N/A SER 75.A N THR 54.A OG1 no hydrogen 2.903 N/A GLU 76.A N GLU 76.A OE1 no hydrogen 2.735 N/A ALA 78.A N SER 75.A O no hydrogen 3.091 N/A GLY 79.A N SER 58.A O no hydrogen 3.029 N/A LEU 80.A N GLU 115.A OE1 no hydrogen 2.841 N/A LEU 81.A N ILE 60.A O no hydrogen 2.887 N/A LEU 82.A N ALA 116.A O no hydrogen 3.219 N/A ALA 83.A N LEU 62.A O no hydrogen 3.026 N/A TYR 84.A N LYS 118.A O no hydrogen 2.866 N/A TYR 84.A OH GLU 145.A OE1 no hydrogen 3.348 N/A TYR 84.A OH GLU 145.A OE2 no hydrogen 2.887 N/A GLU 85.A N GLU 85.A OE1 no hydrogen 2.951 N/A LYS 86.A N ASP 99.A O no hydrogen 2.889 N/A LYS 86.A NZ ASP 99.A OD2 no hydrogen 2.964 N/A LYS 86.A NZ ASP 102.A OD1 no hydrogen 3.215 N/A LYS 86.A NZ ASP 102.A OD2 no hydrogen 3.133 N/A THR 92.A N ASP 90.A OD1 no hydrogen 3.118 N/A THR 92.A OG1 ASP 90.A OD1 no hydrogen 2.816 N/A THR 92.A OG1 ASP 90.A OD2 no hydrogen 3.459 N/A THR 93.A N ASP 90.A O no hydrogen 3.409 N/A THR 93.A OG1 SER 95.A OG no hydrogen 2.973 N/A SER 95.A N THR 93.A OG1 no hydrogen 3.193 N/A SER 95.A OG THR 93.A OG1 no hydrogen 2.973 N/A CYS 100.A N TYR 138.A OH no hydrogen 2.887 N/A CYS 100.A SG TYR 138.A OH no hydrogen 3.292 N/A LEU 101.A N TYR 84.A O no hydrogen 2.857 N/A TRP 104.A N LEU 101.A O no hydrogen 3.138 N/A ALA 106.A N GLU 145.A OE1 no hydrogen 2.809 N/A LYS 107.A NZ GLU 149.A OE1 no hydrogen 2.785 N/A LYS 107.A NZ GLU 149.A OE2 no hydrogen 2.977 N/A ARG 108.A N SER 105.A OG no hydrogen 3.218 N/A ARG 108.A NH1 VAL 103.A O no hydrogen 2.949 N/A ILE 109.A N SER 105.A O no hydrogen 3.070 N/A LYS 110.A N ALA 106.A O no hydrogen 3.088 N/A LYS 110.A NZ GLU 149.A O no hydrogen 2.790 N/A GLU 111.A N LYS 107.A O no hydrogen 3.013 N/A ALA 112.A N ARG 108.A O no hydrogen 2.914 N/A ALA 112.A N ILE 109.A O no hydrogen 3.202 N/A GLY 113.A N LYS 110.A O no hydrogen 3.004 N/A ALA 114.A N ILE 109.A O no hydrogen 3.319 N/A GLU 115.A N LEU 80.A O no hydrogen 2.770 N/A VAL 117.A N PRO 152.A O no hydrogen 2.923 N/A LYS 118.A N LEU 82.A O no hydrogen 2.880 N/A LYS 118.A NZ ASP 22.A OD2 no hydrogen 2.678 N/A LYS 118.A NZ GLU 85.A OE2 no hydrogen 2.988 N/A LYS 118.A NZ GLU 156.A OE1 no hydrogen 2.739 N/A PHE 119.A N TYR 154.A O no hydrogen 2.860 N/A LEU 120.A N GLU 85.A OE1 no hydrogen 2.987 N/A LEU 121.A N GLU 156.A O no hydrogen 2.784 N/A TYR 123.A N LEU 158.A O no hydrogen 3.027 N/A ASP 126.A N ASP 124.A OD1 no hydrogen 2.876 N/A GLY 127.A N ASP 124.A O no hydrogen 2.915 N/A ASP 128.A N GLU 162.A OE1 no hydrogen 2.910 N/A VAL 131.A N ASP 128.A OD2 no hydrogen 3.035 N/A ASN 132.A N ASP 128.A O no hydrogen 2.895 N/A ASN 132.A ND2 ASP 124.A O no hydrogen 2.924 N/A GLU 133.A N GLN 129.A O no hydrogen 2.899 N/A GLN 134.A N ASP 130.A O no hydrogen 2.981 N/A LYS 135.A N VAL 131.A O no hydrogen 2.991 N/A LYS 135.A NZ SER 95.A O no hydrogen 2.815 N/A LYS 135.A NZ TYR 122.A O no hydrogen 2.796 N/A LYS 135.A NZ TYR 160.A OH no hydrogen 3.328 N/A LYS 136.A N ASN 132.A O no hydrogen 2.896 N/A ALA 137.A N GLU 133.A O no hydrogen 3.024 N/A TYR 138.A N GLN 134.A O no hydrogen 3.064 N/A ILE 139.A N LYS 135.A O no hydrogen 3.096 N/A GLU 140.A N LYS 136.A O no hydrogen 2.998 N/A ARG 141.A N ALA 137.A O no hydrogen 3.213 N/A ILE 142.A N TYR 138.A O no hydrogen 3.305 N/A GLY 143.A N ILE 139.A O no hydrogen 2.887 N/A SER 144.A N GLU 140.A O no hydrogen 2.947 N/A SER 144.A OG GLU 140.A O no hydrogen 3.059 N/A GLU 145.A N ARG 141.A O no hydrogen 2.954 N/A CYS 146.A N ILE 142.A O no hydrogen 2.930 N/A CYS 146.A SG ILE 142.A O no hydrogen 3.402 N/A ARG 147.A N GLY 143.A O no hydrogen 3.131 N/A ALA 148.A N SER 144.A O no hydrogen 3.081 N/A GLU 149.A N GLU 145.A O no hydrogen 2.992 N/A ASP 150.A N ARG 147.A O no hydrogen 3.194 N/A ILE 151.A N CYS 146.A O no hydrogen 2.968 N/A PHE 153.A N ASP 194.A OD2 no hydrogen 2.812 N/A TYR 154.A N VAL 117.A O no hydrogen 2.759 N/A LEU 155.A N VAL 195.A O no hydrogen 2.998 N/A GLU 156.A N PHE 119.A O no hydrogen 2.726 N/A ILE 157.A N LYS 197.A O no hydrogen 3.043 N/A LEU 158.A N LEU 121.A O no hydrogen 3.081 N/A THR 159.A N GLU 199.A OE2 no hydrogen 2.877 N/A THR 159.A OG1 GLU 199.A OE2 no hydrogen 2.790 N/A TYR 160.A OH THR 94.A O no hydrogen 2.716 N/A GLU 162.A N ASP 124.A OD2 no hydrogen 3.102 N/A LYS 163.A N ASP 161.A OD1 no hydrogen 2.739 N/A ILE 164.A N ASP 161.A O no hydrogen 3.033 N/A ASN 167.A ND2.B THR 159.A O no hydrogen 2.827 N/A ALA 168.A N ASP 166.A OD2 no hydrogen 3.048 N/A SER 169.A N ASP 166.A O no hydrogen 3.170 N/A SER 169.A OG ASP 166.A O no hydrogen 2.733 N/A GLU 171.A N GLU 171.A OE1 no hydrogen 2.720 N/A PHE 172.A N SER 169.A OG no hydrogen 3.295 N/A ALA 173.A N SER 169.A O no hydrogen 3.099 N/A LYS 174.A N PRO 170.A O no hydrogen 3.187 N/A VAL 175.A N PHE 172.A O no hydrogen 2.933 N/A LYS 176.A NZ VAL 200.A O no hydrogen 3.112 N/A HIS 178.A NE2 ASP 126.A OD1 no hydrogen 3.372 N/A LYS 179.A N VAL 175.A O no hydrogen 3.031 N/A LYS 179.A NZ ASP 124.A OD1 no hydrogen 2.808 N/A LYS 179.A NZ ASP 126.A OD2 no hydrogen 2.853 N/A LYS 179.A NZ ASP 161.A OD2 no hydrogen 2.994 N/A VAL 180.A N LYS 176.A O no hydrogen 2.819 N/A ASN 181.A N ALA 177.A O no hydrogen 2.853 N/A ASN 181.A ND2 ALA 224.A O no hydrogen 3.621 N/A GLU 182.A N HIS 178.A O no hydrogen 3.047 N/A ALA 183.A N LYS 179.A O no hydrogen 3.223 N/A LYS 184.A NZ GLU 182.A OE2 no hydrogen 2.723 N/A VAL 185.A N GLU 182.A O no hydrogen 3.145 N/A PHE 186.A N ALA 183.A O no hydrogen 3.127 N/A SER 187.A OG THR 232.A OG1 no hydrogen 2.734 N/A LYS 188.A N VAL 185.A O no hydrogen 3.343 N/A ARG 190.A NE GLU 140.A OE2 no hydrogen 2.780 N/A ARG 190.A NH2 GLU 140.A OE1 no hydrogen 3.319 N/A ARG 190.A NH2 GLU 140.A OE2 no hydrogen 3.319 N/A PHE 191.A N LYS 188.A O no hydrogen 3.154 N/A GLY 192.A N GLU 189.A O no hydrogen 3.044 N/A ASP 194.A N PHE 153.A O no hydrogen 3.055 N/A VAL 195.A N PHE 153.A O no hydrogen 3.169 N/A LEU 196.A N PRO 235.A O no hydrogen 3.045 N/A LYS 197.A N LEU 155.A O no hydrogen 2.897 N/A LYS 197.A NZ GLU 156.A OE1 no hydrogen 2.957 N/A VAL 198.A N ILE 237.A O no hydrogen 2.922 N/A PHE 205.A N ASN 203.A O no hydrogen 3.010 N/A GLU 207.A N PHE 216.A O no hydrogen 2.961 N/A PHE 209.A N VAL 206.A O no hydrogen 2.983 N/A ALA 210.A N VAL 206.A O no hydrogen 2.898 N/A LEU 215.A N PHE 205.A O no hydrogen 2.852 N/A PHE 216.A N PHE 205.A O no hydrogen 3.224 N/A THR 217.A N GLU 220.A OE1 no hydrogen 2.963 N/A GLU 220.A N THR 217.A OG1 no hydrogen 3.027 N/A ALA 221.A N THR 217.A O no hydrogen 3.127 N/A ALA 222.A N LYS 218.A O no hydrogen 2.825 N/A GLN 223.A N GLU 219.A O no hydrogen 2.977 N/A GLN 223.A NE2 ASP 227.A OD1 no hydrogen 2.730 N/A ALA 224.A N GLU 220.A O no hydrogen 3.101 N/A PHE 225.A N ALA 221.A O no hydrogen 3.276 N/A ARG 226.A N ALA 222.A O no hydrogen 3.121 N/A ARG 226.A NE GLN 223.A OE1 no hydrogen 3.293 N/A ARG 226.A NH1 GLU 219.A OE1 no hydrogen 2.569 N/A ARG 226.A NH1 GLN 223.A OE1 no hydrogen 3.237 N/A ARG 226.A NH2 SER 258.A O no hydrogen 2.962 N/A ASP 227.A N GLN 223.A O no hydrogen 2.828 N/A GLN 228.A N ALA 224.A O no hydrogen 3.040 N/A GLN 228.A NE2 GLU 199.A O no hydrogen 2.931 N/A GLU 229.A N PHE 225.A O no hydrogen 2.961 N/A ALA 230.A N ARG 226.A O no hydrogen 3.048 N/A SER 231.A N GLN 228.A O no hydrogen 2.853 N/A SER 231.A OG ASP 227.A O no hydrogen 2.766 N/A THR 232.A OG1 SER 187.A OG no hydrogen 2.734 N/A LEU 234.A N THR 232.A OG1 no hydrogen 2.999 N/A TYR 236.A N ASN 263.A OD1 no hydrogen 3.063 N/A TYR 236.A OH GLU 229.A OE2 no hydrogen 2.796 N/A ILE 237.A N LEU 196.A O no hydrogen 2.864 N/A TYR 238.A N GLY 264.A O no hydrogen 3.118 N/A TYR 238.A OH GLN 228.A OE1 no hydrogen 2.877 N/A LEU 239.A N VAL 198.A O no hydrogen 2.998 N/A VAL 243.A N SER 240.A O no hydrogen 3.314 N/A LEU 247.A N SER 244.A OG no hydrogen 2.943 N/A PHE 248.A N SER 244.A O no hydrogen 2.902 N/A GLN 249.A N ALA 245.A O no hydrogen 3.004 N/A ASP 250.A N LYS 246.A O no hydrogen 2.946 N/A THR 251.A N LEU 247.A O no hydrogen 2.876 N/A THR 251.A OG1 LEU 247.A O no hydrogen 2.718 N/A LEU 252.A N PHE 248.A O no hydrogen 3.125 N/A VAL 253.A N GLN 249.A O no hydrogen 3.179 N/A PHE 254.A N ASP 250.A O no hydrogen 2.980 N/A ALA 255.A N THR 251.A O no hydrogen 2.664 N/A ALA 256.A N LEU 252.A O no hydrogen 2.982 N/A GLU 257.A N.A VAL 253.A O no hydrogen 2.901 N/A GLU 257.A N.B VAL 253.A O no hydrogen 2.910 N/A SER 258.A N PHE 254.A O no hydrogen 2.897 N/A SER 258.A OG PHE 254.A O no hydrogen 2.790 N/A GLY 259.A N ALA 255.A O no hydrogen 3.180 N/A GLY 259.A N ALA 256.A O no hydrogen 3.215 N/A ALA 260.A N ALA 255.A O no hydrogen 2.972 N/A LYS 261.A N GLU 229.A OE2 no hydrogen 2.940 N/A ASN 263.A N TYR 236.A O no hydrogen 2.839 N/A ASN 263.A ND2 SER 311.A O no hydrogen 2.733 N/A VAL 265.A N ILE 16.A O no hydrogen 2.925 N/A LEU 266.A N TYR 238.A O no hydrogen 2.913 N/A CYS 267.A N ALA 18.A O no hydrogen 3.069 N/A CYS 267.A SG THR 271.A OG1 no hydrogen 3.568 N/A GLY 268.A N SER 240.A OG no hydrogen 3.155 N/A THR 271.A N GLY 268.A O no hydrogen 2.928 N/A TRP 272.A N GLY 268.A O no hydrogen 3.312 N/A TRP 272.A NE1 ALA 20.A O no hydrogen 2.857 N/A ALA 273.A N ARG 269.A O no hydrogen 2.780 N/A SER 275.A N TRP 272.A O no hydrogen 2.908 N/A SER 275.A OG TRP 272.A O no hydrogen 2.810 N/A VAL 276.A N ALA 273.A O no hydrogen 3.140 N/A LYS 277.A NZ GLU 281.A OE1 no hydrogen 3.144 N/A LYS 277.A NZ GLU 281.A OE2 no hydrogen 3.249 N/A TYR 279.A N SER 275.A O no hydrogen 2.759 N/A TYR 279.A OH GLU 44.A OE2 no hydrogen 2.552 N/A ILE 280.A N VAL 276.A O no hydrogen 2.818 N/A GLU 281.A N LYS 277.A O no hydrogen 2.840 N/A GLU 282.A N VAL 278.A O no hydrogen 2.798 N/A GLY 283.A N TYR 279.A O no hydrogen 2.874 N/A GLN 285.A NE2 GLU 289.A OE1 no hydrogen 2.707 N/A ALA 287.A N GLY 283.A O no hydrogen 3.020 N/A ARG 288.A N PRO 284.A O no hydrogen 2.832 N/A ARG 288.A NE GLU 52.A OE1 no hydrogen 3.229 N/A ARG 288.A NH1 GLN 285.A OE1 no hydrogen 3.131 N/A GLU 289.A N GLN 285.A O no hydrogen 2.933 N/A TRP 290.A N ALA 286.A O no hydrogen 3.008 N/A LEU 291.A N ALA 287.A O no hydrogen 2.889 N/A ARG 292.A N ARG 288.A O no hydrogen 2.998 N/A ARG 292.A NE GLU 52.A OE2 no hydrogen 2.990 N/A ARG 292.A NH1 GLU 52.A OE1 no hydrogen 3.295 N/A THR 293.A N TRP 290.A O no hydrogen 3.318 N/A THR 293.A OG1 GLU 289.A O no hydrogen 2.966 N/A THR 293.A OG1 TRP 290.A O no hydrogen 3.557 N/A GLU 294.A N THR 293.A OG1 no hydrogen 2.812 N/A GLY 295.A N TRP 290.A O no hydrogen 2.911 N/A PHE 296.A N LEU 291.A O no hydrogen 2.826 N/A LYS 297.A N THR 293.A O no hydrogen 3.117 N/A ASN 298.A N GLU 294.A O no hydrogen 3.049 N/A ASN 298.A ND2 THR 271.A O no hydrogen 3.210 N/A ILE 299.A N GLY 295.A O no hydrogen 3.039 N/A ASP 300.A N PHE 296.A O no hydrogen 2.792 N/A GLU 301.A N LYS 297.A O no hydrogen 2.952 N/A LEU 302.A N ASN 298.A O no hydrogen 2.999 N/A ASN 303.A N ILE 299.A O no hydrogen 2.890 N/A ASN 303.A ND2 PHE 56.A O no hydrogen 2.941 N/A LYS 304.A N ASP 300.A O no hydrogen 3.094 N/A LYS 304.A NZ ASP 300.A OD2 no hydrogen 3.230 N/A VAL 305.A N GLU 301.A O no hydrogen 3.260 N/A LEU 306.A N LEU 302.A O no hydrogen 2.933 N/A ASP 307.A N ASN 303.A O no hydrogen 3.005 N/A LYS 308.A N VAL 305.A O no hydrogen 3.200 N/A THR 309.A N LEU 306.A O no hydrogen 3.211 N/A THR 309.A OG1 VAL 305.A O no hydrogen 2.768 N/A ALA 310.A N LEU 306.A O no hydrogen 2.997 N/A SER 311.A N PHE 262.A O no hydrogen 2.867 N/A TRP 313.A N GLY 14.A O no hydrogen 2.808 N/A TRP 313.A NE1 SER 11.A OG no hydrogen 2.789 N/A LYS 316.A N TRP 313.A O no hydrogen 2.982 N/A LYS 316.A NZ LYS 261.A O no hydrogen 2.976 N/A LYS 316.A NZ ASN 263.A OD1 no hydrogen 2.872 N/A