Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ory_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 2.A N GLN 41.A OE1 no hydrogen 2.873 N/A GLY 5.A N ASP 3.A OD1 no hydrogen 3.012 N/A VAL 6.A N ASP 182.A OD1 no hydrogen 2.893 N/A LYS 9.A N ASP 7.A OD1 no hydrogen 3.021 N/A ILE 11.A N LEU 8.A O no hydrogen 2.887 N/A GLU 15.A N GLU 15.A OE1 no hydrogen 2.788 N/A ALA 16.A N PRO 13.A O no hydrogen 2.998 N/A LYS 17.A N GLY 14.A O no hydrogen 3.348 N/A LYS 17.A NZ ILE 12.A O no hydrogen 3.523 N/A THR 18.A N LEU 216.A O no hydrogen 2.846 N/A ILE 20.A N PRO 214.A O no hydrogen 2.833 N/A ILE 25.A N ASP 22.A O no hydrogen 3.253 N/A LEU 26.A N LEU 23.A O no hydrogen 3.019 N/A HIS 27.A N ARG 24.A O no hydrogen 2.891 N/A GLY 28.A N GLY 79.A O no hydrogen 2.748 N/A LYS 29.A N LEU 26.A O no hydrogen 2.972 N/A ILE 31.A N LYS 81.A O no hydrogen 3.044 N/A VAL 32.A N ALA 175.A O no hydrogen 3.002 N/A ILE 33.A N VAL 83.A O no hydrogen 2.687 N/A ASP 34.A N ALA 177.A O no hydrogen 2.999 N/A GLY 35.A N VAL 85.A O no hydrogen 2.760 N/A TYR 36.A OH LYS 89.A O no hydrogen 2.620 N/A ASN 37.A N ASP 34.A OD2 no hydrogen 3.043 N/A ALA 38.A N ASP 34.A O no hydrogen 3.185 N/A LEU 39.A N GLY 35.A O no hydrogen 3.002 N/A TYR 40.A N TYR 36.A O no hydrogen 2.934 N/A GLN 41.A N ASN 37.A O no hydrogen 2.940 N/A GLN 41.A NE2 VAL 2.A O no hydrogen 2.940 N/A GLN 41.A NE2 ASN 37.A O no hydrogen 3.547 N/A PHE 42.A N ALA 38.A O no hydrogen 2.998 N/A LEU 43.A N LEU 39.A O no hydrogen 2.941 N/A ALA 44.A N TYR 40.A O no hydrogen 3.100 N/A ALA 45.A N GLN 41.A O no hydrogen 2.811 N/A ILE 46.A N PHE 42.A O no hydrogen 2.998 N/A ARG 47.A NE LEU 43.A O no hydrogen 2.950 N/A ARG 47.A NH1 GLY 51.A O no hydrogen 2.896 N/A ARG 47.A NH1 MET 130.A O no hydrogen 3.169 N/A ARG 47.A NH2 LEU 43.A O no hydrogen 2.933 N/A ARG 47.A NH2 MET 130.A O no hydrogen 2.768 N/A GLN 48.A N THR 52.A O no hydrogen 2.696 N/A GLY 51.A N GLN 48.A O no hydrogen 2.987 N/A THR 52.A N ASP 50.A OD1 no hydrogen 3.111 N/A THR 52.A OG1 ASP 50.A OD1 no hydrogen 2.898 N/A LEU 54.A N SER 63.A OG no hydrogen 2.949 N/A ASP 56.A N ARG 60.A O no hydrogen 2.853 N/A ASN 57.A N ASP 320.A OD2 no hydrogen 2.841 N/A ASN 58.A N ASP 56.A OD1 no hydrogen 2.815 N/A GLY 59.A N ASP 56.A O no hydrogen 3.120 N/A ARG 60.A N ASP 56.A OD1 no hydrogen 2.919 N/A ARG 60.A NE ASP 56.A OD2 no hydrogen 2.817 N/A ARG 60.A NH2 ASP 56.A OD2 no hydrogen 2.990 N/A THR 62.A N LEU 54.A O no hydrogen 2.766 N/A SER 63.A OG ILE 46.A O no hydrogen 2.718 N/A HIS 64.A N HIS 64.A ND1 no hydrogen 2.847 N/A SER 66.A N THR 62.A O no hydrogen 3.031 N/A GLY 67.A N SER 63.A O no hydrogen 3.010 N/A LEU 68.A N HIS 64.A O no hydrogen 2.994 N/A PHE 69.A N LEU 65.A O no hydrogen 2.923 N/A TYR 70.A N SER 66.A O no hydrogen 2.963 N/A ARG 71.A N GLY 67.A O no hydrogen 2.859 N/A ARG 71.A NH1 LEU 195.A O no hydrogen 3.241 N/A ARG 71.A NH1 SER 198.A O no hydrogen 3.245 N/A ARG 71.A NH1 SER 198.A OG no hydrogen 3.050 N/A ARG 71.A NH2 SER 198.A O no hydrogen 3.015 N/A THR 72.A N LEU 68.A O no hydrogen 3.247 N/A THR 72.A OG1 LEU 68.A O no hydrogen 2.586 N/A THR 72.A OG1 TYR 84.A OH no hydrogen 2.782 N/A ILE 73.A N PHE 69.A O no hydrogen 3.106 N/A ASN 74.A N TYR 70.A O no hydrogen 3.093 N/A ILE 75.A N ARG 71.A O no hydrogen 2.946 N/A VAL 76.A N THR 72.A O no hydrogen 2.983 N/A GLU 77.A N ILE 73.A O no hydrogen 2.827 N/A ALA 78.A N ASN 74.A O no hydrogen 2.989 N/A ALA 78.A N ILE 75.A O no hydrogen 3.197 N/A GLY 79.A N VAL 76.A O no hydrogen 2.836 N/A ILE 80.A N ILE 75.A O no hydrogen 3.154 N/A LYS 81.A N LYS 29.A O no hydrogen 2.809 N/A VAL 83.A N ILE 31.A O no hydrogen 2.985 N/A TYR 84.A N PRO 152.A O no hydrogen 3.117 N/A TYR 84.A OH THR 72.A OG1 no hydrogen 2.782 N/A VAL 85.A N ILE 33.A O no hydrogen 2.943 N/A PHE 86.A N VAL 154.A O no hydrogen 2.868 N/A GLY 88.A N ALA 158.A O no hydrogen 2.789 N/A LYS 89.A N ASP 87.A OD2 no hydrogen 2.952 N/A GLU 92.A N GLU 92.A OE1 no hydrogen 2.697 N/A LEU 93.A N PRO 90.A O no hydrogen 2.892 N/A LYS 94.A N PRO 91.A O no hydrogen 3.259 N/A LYS 94.A NZ ASP 87.A OD1 no hydrogen 2.836 N/A LYS 94.A NZ ASP 243.A OD2 no hydrogen 2.919 N/A ARG 96.A N ASP 243.A OD1 no hydrogen 2.896 N/A ARG 96.A NE GLY 5.A O no hydrogen 2.917 N/A ARG 96.A NH1 GLY 5.A O no hydrogen 3.144 N/A ARG 96.A NH2 LEU 240.A O no hydrogen 3.072 N/A ARG 96.A NH2 PRO 246.A O no hydrogen 2.708 N/A ILE 98.A N LYS 94.A O no hydrogen 3.062 N/A GLU 99.A N ALA 95.A O no hydrogen 3.017 N/A ARG 100.A N ARG 96.A O no hydrogen 2.793 N/A ARG 100.A NE ASP 3.A OD2 no hydrogen 3.328 N/A ARG 100.A NH1 GLU 99.A OE1 no hydrogen 3.242 N/A ARG 100.A NH1 GLU 99.A OE2 no hydrogen 3.340 N/A ARG 100.A NH2 ASP 3.A OD2 no hydrogen 3.216 N/A ARG 101.A N GLU 97.A O no hydrogen 2.951 N/A ARG 101.A NE SER 131.A O no hydrogen 3.213 N/A ARG 101.A NH2 SER 131.A O no hydrogen 3.203 N/A LYS 102.A N ILE 98.A O no hydrogen 3.008 N/A ALA 103.A N GLU 99.A O no hydrogen 2.978 N/A VAL 104.A N ARG 100.A O no hydrogen 2.975 N/A LYS 105.A N ARG 101.A O no hydrogen 3.002 N/A GLU 106.A N LYS 102.A O no hydrogen 3.016 N/A GLU 107.A N ALA 103.A O no hydrogen 3.057 N/A ALA 108.A N VAL 104.A O no hydrogen 2.817 N/A ALA 109.A N LYS 105.A O no hydrogen 2.928 N/A LYS 110.A N GLU 106.A O no hydrogen 3.232 N/A LYS 111.A N GLU 107.A O no hydrogen 3.065 N/A TYR 112.A N ALA 108.A O no hydrogen 2.798 N/A GLU 113.A N ALA 109.A O no hydrogen 3.127 N/A GLU 114.A N LYS 110.A O no hydrogen 3.092 N/A ALA 115.A N LYS 111.A O no hydrogen 3.004 N/A VAL 116.A N TYR 112.A O no hydrogen 2.959 N/A GLN 117.A N GLU 113.A O no hydrogen 2.990 N/A SER 118.A N GLU 114.A O no hydrogen 2.878 N/A SER 118.A OG GLU 114.A O no hydrogen 3.491 N/A SER 118.A OG ALA 115.A O no hydrogen 3.346 N/A GLY 119.A N ALA 115.A O no hydrogen 2.908 N/A GLY 119.A N VAL 116.A O no hydrogen 3.305 N/A ASP 120.A N ALA 115.A O no hydrogen 2.904 N/A LEU 123.A N ASP 120.A OD1 no hydrogen 3.126 N/A ALA 124.A N ASP 120.A O no hydrogen 3.001 N/A ARG 125.A N LEU 121.A O no hydrogen 3.134 N/A ARG 126.A N GLU 122.A O no hydrogen 3.369 N/A TYR 127.A N LEU 123.A O no hydrogen 2.879 N/A ALA 128.A N ALA 124.A O no hydrogen 2.890 N/A GLU 136.A N GLU 92.A OE2 no hydrogen 2.846 N/A MET 138.A N THR 135.A OG1 no hydrogen 3.204 N/A VAL 139.A N THR 135.A O no hydrogen 3.084 N/A ARG 140.A N GLU 136.A O no hydrogen 2.864 N/A ASP 141.A N GLU 137.A O no hydrogen 2.935 N/A ALA 142.A N MET 138.A O no hydrogen 2.932 N/A LYS 143.A N VAL 139.A O no hydrogen 2.937 N/A LYS 143.A NZ GLN 155.A OE1 no hydrogen 3.238 N/A SER 144.A N ARG 140.A O no hydrogen 2.977 N/A SER 144.A OG ARG 140.A O no hydrogen 3.257 N/A LEU 145.A N ASP 141.A O no hydrogen 2.843 N/A LEU 146.A N ALA 142.A O no hydrogen 3.034 N/A ASP 147.A N LYS 143.A O no hydrogen 2.997 N/A ALA 148.A N SER 144.A O no hydrogen 3.041 N/A MET 149.A N LEU 145.A O no hydrogen 2.932 N/A GLY 150.A N ASP 147.A O no hydrogen 3.112 N/A ILE 151.A N LEU 146.A O no hydrogen 2.976 N/A TRP 153.A NE1 ASP 147.A OD1 no hydrogen 2.863 N/A VAL 154.A N TYR 84.A O no hydrogen 2.830 N/A GLN 155.A NE2 ASP 87.A O no hydrogen 2.957 N/A GLN 155.A NE2 ALA 156.A O no hydrogen 2.835 N/A ALA 156.A N PHE 86.A O no hydrogen 2.838 N/A GLU 159.A N GLU 159.A OE1 no hydrogen 2.795 N/A GLY 160.A N ASP 87.A OD1 no hydrogen 2.978 N/A GLN 163.A N GLU 159.A O no hydrogen 3.134 N/A GLN 163.A NE2 THR 296.A O no hydrogen 3.022 N/A ALA 164.A N GLY 160.A O no hydrogen 2.893 N/A ALA 165.A N GLU 161.A O no hydrogen 3.056 N/A TYR 166.A N ALA 162.A O no hydrogen 2.966 N/A TYR 166.A OH ASP 297.A OD1 no hydrogen 2.550 N/A ILE 167.A N GLN 163.A O no hydrogen 2.922 N/A VAL 168.A N ALA 164.A O no hydrogen 3.195 N/A LYS 169.A N ALA 165.A O no hydrogen 2.905 N/A LYS 169.A NZ PHE 186.A O no hydrogen 3.515 N/A LYS 170.A N TYR 166.A O no hydrogen 2.922 N/A GLY 171.A N VAL 168.A O no hydrogen 2.991 N/A ASP 172.A N ILE 167.A O no hydrogen 2.942 N/A TYR 174.A N ILE 30.A O no hydrogen 2.724 N/A SER 176.A N LYS 190.A O no hydrogen 2.940 N/A SER 176.A OG SER 183.A OG no hydrogen 2.744 N/A SER 176.A OG SER 188.A OG no hydrogen 2.916 N/A SER 176.A OG LYS 190.A O no hydrogen 3.167 N/A ALA 177.A N VAL 32.A O no hydrogen 2.841 N/A SER 178.A N VAL 192.A O no hydrogen 3.310 N/A SER 178.A OG GLU 161.A OE2 no hydrogen 2.699 N/A SER 178.A OG ASP 180.A OD1 no hydrogen 3.021 N/A ASP 180.A N SER 178.A OG no hydrogen 3.203 N/A TYR 181.A N VAL 6.A O no hydrogen 2.999 N/A SER 183.A OG SER 176.A OG no hydrogen 2.744 N/A LEU 184.A N TYR 181.A O no hydrogen 3.007 N/A LEU 185.A N TYR 181.A O no hydrogen 3.436 N/A PHE 186.A N ASP 182.A O no hydrogen 3.036 N/A GLY 187.A N LEU 184.A O no hydrogen 2.889 N/A SER 188.A N SER 183.A O no hydrogen 2.793 N/A SER 188.A OG SER 176.A OG no hydrogen 2.916 N/A SER 188.A OG LYS 190.A O no hydrogen 2.891 N/A LYS 190.A NZ GLU 218.A OE2 no hydrogen 3.568 N/A LEU 191.A N ILE 217.A O no hydrogen 2.849 N/A VAL 192.A N SER 176.A O no hydrogen 2.732 N/A ARG 193.A N GLU 215.A O no hydrogen 2.821 N/A ARG 193.A NE GLN 179.A O no hydrogen 3.067 N/A ARG 193.A NH1 GLU 215.A OE2 no hydrogen 2.796 N/A ARG 193.A NH2 GLN 179.A O no hydrogen 3.207 N/A ASN 194.A N GLN 179.A OE1 no hydrogen 2.745 N/A ILE 197.A N ASN 194.A O no hydrogen 3.052 N/A GLY 199.A N VAL 212.A O no hydrogen 2.885 N/A ARG 200.A NH1 GLU 211.A OE1 no hydrogen 3.137 N/A ARG 201.A N VAL 210.A O no hydrogen 3.061 N/A LEU 203.A N GLU 208.A O no hydrogen 3.117 N/A GLU 208.A N ARG 205.A O no hydrogen 3.450 N/A VAL 210.A N ARG 201.A O no hydrogen 2.998 N/A VAL 212.A N GLY 199.A O no hydrogen 3.006 N/A LYS 213.A NZ GLU 21.A OE1 no hydrogen 3.044 N/A GLU 215.A N ARG 193.A O no hydrogen 3.015 N/A LEU 216.A N THR 18.A O no hydrogen 2.844 N/A ILE 217.A N LEU 191.A O no hydrogen 2.746 N/A LEU 219.A N PRO 189.A O no hydrogen 2.919 N/A LYS 221.A NZ GLU 218.A OE1 no hydrogen 3.386 N/A LEU 222.A N GLU 218.A O no hydrogen 2.909 N/A LEU 223.A N LEU 219.A O no hydrogen 2.891 N/A VAL 224.A N ASP 220.A O no hydrogen 3.036 N/A GLN 225.A N LYS 221.A O no hydrogen 2.995 N/A LEU 226.A N LEU 222.A O no hydrogen 2.975 N/A GLY 227.A N VAL 224.A O no hydrogen 2.939 N/A ILE 228.A N LEU 223.A O no hydrogen 2.944 N/A ASN 232.A N THR 229.A OG1 no hydrogen 3.011 N/A LEU 233.A N THR 229.A O no hydrogen 3.007 N/A ILE 234.A N LEU 230.A O no hydrogen 2.889 N/A ASP 235.A N GLU 231.A O no hydrogen 2.880 N/A ILE 236.A N ASN 232.A O no hydrogen 2.949 N/A GLY 237.A N LEU 233.A O no hydrogen 3.163 N/A ILE 238.A N ILE 234.A O no hydrogen 2.976 N/A LEU 239.A N ASP 235.A O no hydrogen 2.990 N/A LEU 240.A N ILE 236.A O no hydrogen 3.102 N/A GLY 241.A N GLY 237.A O no hydrogen 2.763 N/A THR 242.A N ASN 245.A OD1 no hydrogen 3.019 N/A THR 242.A OG1 ASN 245.A OD1 no hydrogen 2.704 N/A TYR 244.A N THR 242.A OG1 no hydrogen 3.094 N/A TYR 244.A OH GLU 159.A OE2 no hydrogen 2.554 N/A ASN 245.A N THR 242.A O no hydrogen 2.989 N/A ASN 245.A ND2 ILE 238.A O no hydrogen 2.850 N/A GLY 248.A N ASN 245.A O no hydrogen 2.998 N/A PHE 249.A N LEU 239.A O no hydrogen 3.020 N/A GLU 250.A N LYS 276.A O no hydrogen 2.884 N/A ILE 252.A N PHE 249.A O no hydrogen 3.256 N/A ALA 257.A N GLY 253.A O no hydrogen 2.877 N/A LEU 258.A N PRO 254.A O no hydrogen 3.051 N/A GLN 259.A N LYS 255.A O no hydrogen 3.043 N/A LEU 260.A N LYS 256.A O no hydrogen 2.839 N/A VAL 261.A N ALA 257.A O no hydrogen 3.064 N/A LYS 262.A N LEU 258.A O no hydrogen 3.202 N/A LYS 262.A NZ LEU 226.A O no hydrogen 2.817 N/A ALA 263.A N GLN 259.A O no hydrogen 3.000 N/A TYR 264.A N LEU 260.A O no hydrogen 3.042 N/A GLY 266.A N VAL 261.A O no hydrogen 3.039 N/A ILE 270.A N ILE 267.A O no hydrogen 3.051 N/A LYS 272.A NZ GLU 268.A O no hydrogen 3.384 N/A ILE 274.A N PRO 271.A O no hydrogen 3.049 N/A LEU 275.A N LYS 272.A O no hydrogen 3.156 N/A SER 277.A OG ILE 279.A O no hydrogen 2.909 N/A VAL 281.A N GLU 280.A OE1 no hydrogen 2.783 N/A ALA 285.A N ASP 282.A OD1 no hydrogen 3.230 N/A ILE 286.A N ASP 282.A O no hydrogen 3.130 N/A LYS 287.A N VAL 283.A O no hydrogen 3.047 N/A LYS 287.A NZ GLU 231.A OE1 no hydrogen 2.836 N/A LYS 288.A N ILE 284.A O no hydrogen 2.931 N/A TYR 289.A N ALA 285.A O no hydrogen 2.926 N/A TYR 289.A OH GLU 159.A OE1 no hydrogen 2.628 N/A PHE 290.A N ILE 286.A O no hydrogen 2.967 N/A LEU 291.A N LYS 287.A O no hydrogen 2.977 N/A GLN 292.A N LYS 288.A O no hydrogen 3.108 N/A GLN 294.A N TYR 289.A OH no hydrogen 3.029 N/A THR 296.A N GLN 163.A OE1 no hydrogen 2.830 N/A ASN 298.A N THR 296.A OG1 no hydrogen 2.808 N/A TYR 299.A N ASP 297.A O no hydrogen 3.029 N/A TYR 299.A OH ASP 172.A OD2 no hydrogen 2.610 N/A TRP 303.A NE1 PRO 82.A O no hydrogen 2.879 N/A HIS 304.A N GLY 150.A O no hydrogen 2.978 N/A ASP 307.A N ALA 148.A O no hydrogen 2.711 N/A ALA 310.A N ASP 307.A OD1 no hydrogen 3.259 N/A VAL 311.A N ASP 307.A O no hydrogen 3.068 N/A LYS 312.A N PRO 308.A O no hydrogen 2.872 N/A LYS 312.A NZ ASP 317.A OD2 no hydrogen 2.788 N/A ARG 313.A N ASP 309.A O no hydrogen 2.805 N/A ARG 313.A NH1 ASP 309.A OD2 no hydrogen 2.960 N/A ILE 314.A N ALA 310.A O no hydrogen 3.113 N/A LEU 315.A N VAL 311.A O no hydrogen 2.929 N/A VAL 316.A N LYS 312.A O no hydrogen 2.764 N/A ASP 317.A N LYS 312.A O no hydrogen 3.224 N/A GLU 318.A N ARG 313.A O no hydrogen 2.937 N/A HIS 319.A ND1 ASP 56.A OD2 no hydrogen 3.111 N/A ASP 320.A N VAL 316.A O no hydrogen 2.888 N/A PHE 321.A N LEU 315.A O no hydrogen 2.968 N/A ARG 325.A N SER 322.A OG no hydrogen 3.068 N/A VAL 326.A N SER 322.A O no hydrogen 2.910 N/A SER 327.A N ILE 323.A O no hydrogen 2.868 N/A SER 327.A OG ILE 323.A O no hydrogen 2.698 N/A THR 328.A N ASP 324.A O no hydrogen 2.943 N/A THR 328.A OG1 ASP 324.A O no hydrogen 2.963 N/A ALA 329.A N ARG 325.A O no hydrogen 3.069 N/A LEU 330.A N VAL 326.A O no hydrogen 2.878 N/A GLU 331.A N SER 327.A O no hydrogen 2.929 N/A ARG 332.A N THR 328.A O no hydrogen 3.212 N/A TYR 333.A N ALA 329.A O no hydrogen 2.742 N/A TYR 333.A OH MET 149.A O no hydrogen 2.520 N/A VAL 334.A N LEU 330.A O no hydrogen 2.845 N/A LYS 335.A N GLU 331.A O no hydrogen 3.501 N/A ALA 336.A N ARG 332.A O no hydrogen 3.020 N/A PHE 337.A N TYR 333.A O no hydrogen 2.804 N/A LYS 338.A N VAL 334.A O no hydrogen 3.064 N/A GLU 339.A N LYS 335.A O no hydrogen 3.065 N/A ASN 340.A N ALA 336.A O no hydrogen 2.798 N/A ASN 340.A ND2 VAL 76.A O no hydrogen 2.781 N/A ASN 340.A ND2 GLU 77.A O no hydrogen 3.492 N/A ILE 341.A N PHE 337.A O no hydrogen 2.939 N/A ARG 342.A N PHE 337.A O no hydrogen 3.152 N/A