Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8orr_AAA.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 3.A N LEU 280.A O no hydrogen 3.024 N/A SER 3.A OG LEU 280.A O no hydrogen 3.260 N/A ASN 10.A ND2 GLN 316.A O no hydrogen 3.318 N/A GLN 11.A N VAL 314.A O no hydrogen 2.768 N/A SER 15.A N THR 348.A O no hydrogen 3.022 N/A SER 17.A N ALA 346.A O no hydrogen 2.755 N/A TRP 18.A N ALA 346.A O no hydrogen 3.505 N/A TRP 18.A NE1 ALA 56.A O no hydrogen 2.942 N/A SER 19.A OG.B LEU 344.A O no hydrogen 3.226 N/A THR 20.A N LEU 344.A O no hydrogen 3.057 N/A THR 20.A OG1 GLY 59.A O no hydrogen 3.211 N/A ASP 24.A N ASP 46.A OD2 no hydrogen 2.933 N/A ILE 26.A N LYS 340.A O no hydrogen 2.951 N/A GLY 27.A N LYS 340.A O no hydrogen 3.142 N/A PHE 29.A N ILE 26.A O no hydrogen 3.145 N/A TYR 30.A OH ASN 32.A OD1 no hydrogen 2.833 N/A ASN 32.A ND2 LEU 117.A O no hydrogen 2.942 N/A ASN 32.A ND2 GLY 161.A O no hydrogen 2.963 N/A LEU 33.A N SER 31.A OG no hydrogen 2.991 N/A HIS 34.A N GLY 79.A O no hydrogen 2.911 N/A HIS 34.A ND1 ASN 32.A O no hydrogen 2.941 N/A ALA 36.A N TYR 43.A O no hydrogen 2.888 N/A ALA 38.A N VAL 41.A O no hydrogen 3.028 N/A VAL 41.A N ALA 38.A O no hydrogen 3.051 N/A VAL 42.A N LEU 54.A O no hydrogen 2.829 N/A TYR 43.A N ALA 36.A O no hydrogen 2.833 N/A ALA 44.A N LYS 52.A O.A no hydrogen 3.076 N/A ALA 44.A N LYS 52.A O.B no hydrogen 3.001 N/A ASP 46.A N THR 50.A O no hydrogen 3.071 N/A ARG 47.A N GLY 25.A O no hydrogen 3.042 N/A ARG 47.A NH2 GLU 92.A OE1 no hydrogen 3.453 N/A LYS 48.A NZ ASP 24.A OD2 no hydrogen 2.990 N/A GLY 49.A N ASP 46.A OD1 no hydrogen 2.973 N/A THR 50.A N ASP 46.A OD1 no hydrogen 2.785 N/A VAL 51.A N VAL 65.A O no hydrogen 2.947 N/A LYS 52.A N.A ALA 44.A O no hydrogen 2.877 N/A LYS 52.A N.B ALA 44.A O no hydrogen 2.882 N/A LYS 52.A NZ.A SER 21.A O no hydrogen 3.073 N/A LYS 52.A NZ.B GLU 61.A OE2 no hydrogen 3.291 N/A LYS 52.A NZ.B SER 64.A OG no hydrogen 2.950 N/A ALA 53.A N TRP 63.A O no hydrogen 3.025 N/A LEU 54.A N VAL 42.A O no hydrogen 2.786 N/A ASN 55.A N LYS 60.A O no hydrogen 2.878 N/A ALA 56.A N GLY 40.A O no hydrogen 2.964 N/A ASP 57.A N ASN 55.A OD1 no hydrogen 2.800 N/A GLY 59.A N ASN 55.A O no hydrogen 2.930 N/A LYS 60.A N ASP 58.A OD1 no hydrogen 3.005 N/A VAL 62.A N ALA 53.A O no hydrogen 2.829 N/A TRP 63.A N ALA 53.A O no hydrogen 3.455 N/A TRP 63.A NE1 THR 101.A O no hydrogen 2.838 N/A VAL 65.A N VAL 51.A O no hydrogen 2.938 N/A LEU 67.A N GLY 49.A O no hydrogen 2.812 N/A ALA 68.A N ASN 66.A OD1 no hydrogen 3.099 N/A GLU 69.A N ASN 66.A O no hydrogen 3.229 N/A ALA 74.A N LYS 48.A O no hydrogen 2.924 N/A LEU 76.A N ARG 47.A O no hydrogen 2.965 N/A SER 77.A N GLY 90.A O no hydrogen 2.851 N/A SER 77.A OG GLU 92.A OE2 no hydrogen 3.243 N/A GLY 78.A N GLY 90.A O no hydrogen 3.221 N/A GLY 78.A N ALA 116.A O no hydrogen 3.074 N/A VAL 80.A N HIS 34.A O no hydrogen 2.924 N/A THR 81.A N TYR 88.A O no hydrogen 3.023 N/A THR 81.A OG1 PRO 120.A O no hydrogen 2.784 N/A SER 83.A N HIS 86.A O no hydrogen 3.027 N/A HIS 86.A N SER 83.A O no hydrogen 3.018 N/A HIS 86.A ND1 TYR 88.A OH no hydrogen 2.915 N/A VAL 87.A N LEU 99.A O no hydrogen 2.755 N/A TYR 88.A N THR 81.A O no hydrogen 2.709 N/A TYR 88.A OH GLU 141.A OE1 no hydrogen 2.687 N/A ILE 89.A N TYR 97.A O no hydrogen 3.140 N/A GLY 90.A N GLY 78.A O no hydrogen 2.755 N/A SER 91.A N GLN 95.A O no hydrogen 2.872 N/A GLU 92.A N LEU 75.A O no hydrogen 2.923 N/A LYS 93.A N SER 91.A OG no hydrogen 3.142 N/A LYS 93.A NZ PRO 73.A O no hydrogen 2.798 N/A ALA 94.A N SER 91.A O no hydrogen 3.130 N/A GLN 95.A N SER 91.A OG no hydrogen 3.252 N/A LEU 96.A N THR 110.A O no hydrogen 2.823 N/A TYR 97.A N ILE 89.A O no hydrogen 2.879 N/A ALA 98.A N TRP 108.A O no hydrogen 2.925 N/A LEU 99.A N VAL 87.A O no hydrogen 2.868 N/A ASN 100.A N THR 105.A O no hydrogen 2.802 N/A ASN 100.A ND2 THR 105.A OG1 no hydrogen 3.024 N/A THR 101.A N GLY 85.A O no hydrogen 2.978 N/A THR 101.A OG1 GLY 85.A O no hydrogen 3.268 N/A ASP 103.A N ASN 100.A O no hydrogen 3.407 N/A GLY 104.A N ASN 100.A O no hydrogen 2.895 N/A THR 105.A N ASP 103.A OD1 no hydrogen 3.008 N/A THR 105.A OG1 ASP 103.A OD1 no hydrogen 2.710 N/A ALA 107.A N ALA 98.A O no hydrogen 2.858 N/A TRP 108.A N ALA 98.A O no hydrogen 3.362 N/A TRP 108.A NE1 GLU 141.A O no hydrogen 2.888 N/A GLN 109.A NE2 GLN 95.A OE1 no hydrogen 2.857 N/A THR 110.A N LEU 96.A O no hydrogen 2.981 N/A THR 110.A OG1 GLY 144.A O no hydrogen 2.726 N/A ARG 111.A NH1 VAL 112.A O no hydrogen 2.894 N/A ARG 111.A NH1 ALA 113.A O no hydrogen 3.161 N/A VAL 112.A N ALA 94.A O no hydrogen 2.919 N/A ALA 113.A N GLN 137.A OE1 no hydrogen 2.840 N/A ALA 116.A N SER 91.A O no hydrogen 3.054 N/A ARG 119.A N GLU 162.A OE2 no hydrogen 2.907 N/A ARG 119.A NE GLU 162.A OE2 no hydrogen 3.004 N/A ARG 119.A NH2 GLU 162.A OE1 no hydrogen 3.056 N/A ARG 119.A NH2 ASP 327.A OD2 no hydrogen 2.792 N/A VAL 121.A N LEU 128.A O no hydrogen 3.102 N/A SER 123.A N MET 126.A O no hydrogen 3.010 N/A SER 123.A OG ASP 124.A OD2 no hydrogen 2.479 N/A MET 126.A N SER 123.A O no hydrogen 3.002 N/A VAL 127.A N LEU 139.A O no hydrogen 2.799 N/A LEU 128.A N VAL 121.A O no hydrogen 2.783 N/A VAL 129.A N GLN 137.A O no hydrogen 3.020 N/A HIS 130.A ND1 SER 163.A O no hydrogen 2.742 N/A HIS 130.A NE2 ASP 153.A OD1 no hydrogen 2.839 N/A THR 131.A N GLN 135.A O no hydrogen 2.952 N/A THR 131.A OG1 ASN 133.A OD1 no hydrogen 2.609 N/A THR 131.A OG1 GLN 135.A O no hydrogen 3.258 N/A SER 132.A N GLU 115.A O no hydrogen 2.989 N/A ASN 133.A N ASN 133.A OD1 no hydrogen 2.720 N/A ASN 133.A ND2 GLN 135.A OE1 no hydrogen 2.959 N/A GLY 134.A N THR 131.A O no hydrogen 3.028 N/A GLN 135.A NE2 ASN 151.A OD1 no hydrogen 2.867 N/A LEU 136.A N VAL 150.A O no hydrogen 2.907 N/A GLN 137.A N VAL 129.A O no hydrogen 2.935 N/A GLN 137.A NE2 THR 149.A OG1 no hydrogen 3.289 N/A ALA 138.A N TRP 148.A O no hydrogen 3.080 N/A LEU 139.A N VAL 127.A O no hydrogen 2.886 N/A ASN 140.A N ALA 145.A O no hydrogen 3.020 N/A ASN 140.A ND2 ASP 143.A OD1 no hydrogen 3.185 N/A GLU 141.A N GLY 125.A O no hydrogen 3.099 N/A GLY 144.A N ASN 140.A O no hydrogen 2.853 N/A ALA 145.A N ASP 143.A OD1 no hydrogen 3.005 N/A LYS 147.A N ALA 138.A O no hydrogen 2.831 N/A TRP 148.A NE1 MET 186.A O no hydrogen 2.939 N/A VAL 150.A N LEU 136.A O no hydrogen 2.882 N/A LEU 152.A N GLY 134.A O no hydrogen 3.018 N/A ASP 153.A N GLY 134.A O no hydrogen 3.226 N/A MET 154.A N ASP 177.A OD1 no hydrogen 3.114 N/A ALA 156.A N SER 132.A O no hydrogen 2.979 N/A SER 158.A OG ARG 160.A O no hydrogen 3.450 N/A SER 158.A OG ARG 200.A O no hydrogen 3.254 N/A SER 158.A OG ASN 202.A O no hydrogen 3.112 N/A ARG 160.A N SER 158.A OG no hydrogen 3.104 N/A SER 163.A N SER 118.A OG no hydrogen 2.971 N/A SER 163.A OG HIS 130.A ND1 no hydrogen 3.215 N/A SER 163.A OG THR 206.A OG1 no hydrogen 2.868 N/A ALA 164.A N THR 207.A OG1 no hydrogen 2.892 N/A ALA 166.A N ILE 173.A O.A no hydrogen 2.914 N/A ALA 166.A N ILE 173.A O.B no hydrogen 2.839 N/A ALA 168.A N ALA 171.A O no hydrogen 3.072 N/A ALA 171.A N ALA 168.A O no hydrogen 3.123 N/A ALA 172.A N VAL 184.A O no hydrogen 2.869 N/A ILE 173.A N.A ALA 166.A O no hydrogen 2.758 N/A ILE 173.A N.B ALA 166.A O no hydrogen 2.741 N/A VAL 174.A N SER 182.A O no hydrogen 2.920 N/A ASP 177.A N ASP 153.A OD2 no hydrogen 2.957 N/A VAL 181.A N GLN 195.A O no hydrogen 2.900 N/A SER 182.A N VAL 174.A O no hydrogen 2.844 N/A ALA 183.A N TRP 193.A O no hydrogen 2.930 N/A VAL 184.A N ALA 172.A O no hydrogen 2.926 N/A LEU 185.A N GLN 190.A O no hydrogen 2.864 N/A MET 186.A N GLY 170.A O no hydrogen 2.884 N/A GLN 188.A N GLN 190.A OE1 no hydrogen 3.120 N/A GLY 189.A N LEU 185.A O no hydrogen 2.887 N/A GLN 190.A N GLN 190.A OE1 no hydrogen 2.862 N/A ILE 192.A N ALA 183.A O no hydrogen 2.816 N/A TRP 193.A N ALA 183.A O no hydrogen 3.466 N/A TRP 193.A NE1 LEU 229.A O no hydrogen 2.952 N/A GLN 194.A NE2 SER 182.A OG no hydrogen 2.862 N/A GLN 195.A N VAL 181.A O no hydrogen 2.890 N/A GLN 195.A NE2 GLY 232.A O no hydrogen 3.392 N/A ARG 196.A NH2 ASN 178.A O no hydrogen 3.151 N/A ARG 196.A NH2 SER 198.A O no hydrogen 2.998 N/A ILE 197.A N GLY 179.A O no hydrogen 2.889 N/A SER 198.A OG THR 199.A O no hydrogen 3.560 N/A VAL 204.A N ASN 202.A OD1 no hydrogen 3.319 N/A ASP 205.A N ASN 244.A O no hydrogen 2.860 N/A THR 206.A N GLU 162.A O no hydrogen 2.884 N/A THR 206.A OG1 GLU 162.A O no hydrogen 3.445 N/A THR 206.A OG1 SER 163.A OG no hydrogen 2.868 N/A THR 207.A N ASP 205.A OD1 no hydrogen 3.063 N/A THR 207.A OG1 ASP 205.A OD1 no hydrogen 2.558 N/A ILE 209.A N TYR 216.A O no hydrogen 2.946 N/A VAL 211.A N VAL 214.A O no hydrogen 2.982 N/A VAL 214.A N VAL 211.A O no hydrogen 3.159 N/A VAL 215.A N LEU 227.A O no hydrogen 2.826 N/A TYR 216.A N ILE 209.A O no hydrogen 2.866 N/A ALA 217.A N THR 225.A O no hydrogen 3.001 N/A ALA 219.A N ASN 223.A O no hydrogen 3.144 N/A GLY 222.A N ALA 219.A O no hydrogen 3.293 N/A ASN 223.A N ASN 221.A OD1 no hydrogen 3.153 N/A LEU 224.A N ARG 238.A O no hydrogen 3.071 N/A THR 225.A N ALA 217.A O no hydrogen 2.932 N/A ALA 226.A N TRP 236.A O no hydrogen 2.908 N/A LEU 227.A N VAL 215.A O no hydrogen 2.785 N/A ASP 228.A N GLN 233.A O no hydrogen 2.723 N/A LEU 229.A N GLY 213.A O no hydrogen 3.215 N/A SER 231.A N ASP 228.A O no hydrogen 3.333 N/A SER 231.A N ASP 228.A OD2 no hydrogen 2.940 N/A SER 231.A OG ASP 228.A OD2 no hydrogen 2.576 N/A GLY 232.A N ASP 228.A O no hydrogen 2.552 N/A GLN 233.A N SER 231.A OG no hydrogen 3.196 N/A MET 235.A N ALA 226.A O no hydrogen 2.870 N/A LYS 237.A NZ ILE 197.A O no hydrogen 3.123 N/A LYS 237.A NZ THR 225.A OG1 no hydrogen 3.207 N/A ARG 238.A N LEU 224.A O no hydrogen 2.851 N/A ARG 238.A NH1 GLY 270.A O no hydrogen 2.913 N/A ARG 238.A NH1 THR 272.A OG1 no hydrogen 2.861 N/A ASN 244.A N VAL 256.A O no hydrogen 3.023 N/A ASP 245.A N.A VAL 256.A O no hydrogen 3.225 N/A ASP 245.A N.B VAL 256.A O no hydrogen 3.210 N/A PHE 246.A N ASP 245.A OD1.A no hydrogen 2.942 N/A ILE 247.A N TYR 254.A O no hydrogen 2.927 N/A ASP 249.A N ARG 252.A O no hydrogen 2.893 N/A ARG 252.A N ASP 249.A O no hydrogen 3.023 N/A ARG 252.A NH1 ASN 251.A O no hydrogen 2.991 N/A ILE 253.A N LEU 265.A O no hydrogen 2.884 N/A TYR 254.A N ILE 247.A O no hydrogen 3.064 N/A LEU 255.A N.A LEU 263.A O no hydrogen 2.939 N/A LEU 255.A N.B LEU 263.A O no hydrogen 2.934 N/A VAL 256.A N ASP 245.A O.A no hydrogen 2.842 N/A VAL 256.A N ASP 245.A O.B no hydrogen 2.984 N/A ASP 257.A N ARG 261.A O no hydrogen 2.983 N/A GLN 258.A N SER 242.A O no hydrogen 2.740 N/A ASN 259.A N ASP 257.A OD1 no hydrogen 2.923 N/A ASP 260.A N ASP 257.A O no hydrogen 3.008 N/A ARG 261.A N ASP 257.A OD1 no hydrogen 3.012 N/A ARG 261.A NE ASP 257.A OD2 no hydrogen 3.139 N/A LEU 262.A N.A GLN 276.A O no hydrogen 2.927 N/A LEU 262.A N.B GLN 276.A O no hydrogen 2.927 N/A LEU 263.A N LEU 255.A O.A no hydrogen 3.065 N/A LEU 263.A N LEU 255.A O.B no hydrogen 2.879 N/A ALA 264.A N TRP 274.A O no hydrogen 3.091 N/A LEU 265.A N ILE 253.A O no hydrogen 2.865 N/A THR 266.A N.A VAL 271.A O no hydrogen 2.888 N/A THR 266.A N.B VAL 271.A O no hydrogen 2.920 N/A THR 266.A OG1.A ASP 268.A O no hydrogen 2.816 N/A THR 267.A N ASN 251.A O no hydrogen 3.080 N/A ASP 268.A N THR 266.A OG1.B no hydrogen 3.375 N/A GLY 270.A N THR 266.A O.B no hydrogen 2.996 N/A LEU 273.A N ALA 264.A O no hydrogen 2.787 N/A TRP 274.A N ALA 264.A O no hydrogen 3.510 N/A TRP 274.A NE1 PRO 308.A O no hydrogen 2.941 N/A GLN 276.A N LEU 262.A O.A no hydrogen 2.864 N/A GLN 276.A N LEU 262.A O.B no hydrogen 2.905 N/A GLN 276.A NE2 GLY 311.A O no hydrogen 2.948 N/A ASP 278.A N GLN 276.A OE1 no hydrogen 3.015 N/A HIS 281.A N ASN 259.A O no hydrogen 3.000 N/A ARG 282.A N LEU 279.A O no hydrogen 3.048 N/A ARG 282.A NE ASP 298.A OD2 no hydrogen 2.927 N/A ARG 282.A NH1 SER 3.A O no hydrogen 2.993 N/A ARG 282.A NH2 ASP 298.A OD2 no hydrogen 2.984 N/A LEU 283.A N ASP 260.A OD2 no hydrogen 2.928 N/A LEU 284.A N ASP 260.A OD1 no hydrogen 2.999 N/A THR 285.A N GLY 297.A O no hydrogen 2.944 N/A THR 285.A OG1 ALA 286.A O no hydrogen 2.908 N/A VAL 288.A N VAL 295.A O no hydrogen 3.081 N/A TYR 290.A N ASN 293.A O no hydrogen 2.778 N/A TYR 290.A OH GLY 333.A O no hydrogen 2.748 N/A ASN 293.A N TYR 290.A O no hydrogen 2.975 N/A LEU 294.A N VAL 306.A O no hydrogen 2.898 N/A VAL 295.A N VAL 288.A O no hydrogen 2.901 N/A VAL 296.A N HIS 304.A O no hydrogen 3.160 N/A GLY 297.A N THR 285.A OG1 no hydrogen 2.967 N/A ASP 298.A N TYR 302.A O no hydrogen 2.937 N/A SER 299.A N ARG 282.A O no hydrogen 3.239 N/A SER 299.A OG ARG 282.A O no hydrogen 3.003 N/A SER 299.A OG GLU 300.A OE1 no hydrogen 2.267 N/A GLU 300.A N ASP 298.A OD1 no hydrogen 2.974 N/A GLY 301.A N ASP 298.A O no hydrogen 3.113 N/A TYR 302.A N ASP 298.A OD1 no hydrogen 3.038 N/A MET 303.A N GLN 317.A O no hydrogen 2.875 N/A HIS 304.A N VAL 296.A O no hydrogen 2.901 N/A HIS 304.A NE2 ASP 298.A OD2 no hydrogen 2.851 N/A TRP 305.A N ALA 315.A O no hydrogen 2.911 N/A VAL 306.A N LEU 294.A O no hydrogen 2.706 N/A ASN 307.A N HIS 312.A O no hydrogen 2.853 N/A GLU 309.A N ASN 307.A OD1 no hydrogen 3.004 N/A ASP 310.A N ASN 307.A O no hydrogen 3.295 N/A GLY 311.A N ASN 307.A O no hydrogen 2.894 N/A HIS 312.A N ASP 310.A OD1 no hydrogen 3.054 N/A VAL 314.A N TRP 305.A O no hydrogen 2.860 N/A ALA 315.A N TRP 305.A O no hydrogen 3.490 N/A GLN 316.A N ASN 10.A OD1 no hydrogen 2.977 N/A GLN 317.A N MET 303.A O no hydrogen 3.083 N/A GLN 317.A NE2 PRO 14.A O no hydrogen 3.024 N/A VAL 319.A N GLY 301.A O no hydrogen 2.892 N/A ASP 320.A N GLY 301.A O no hydrogen 3.284 N/A SER 322.A N ASP 320.A OD1 no hydrogen 2.964 N/A SER 322.A OG ASP 320.A OD1 no hydrogen 2.841 N/A GLY 323.A N ASP 320.A O no hydrogen 3.031 N/A PHE 324.A N ASP 298.A O no hydrogen 2.972 N/A THR 326.A OG1 LEU 33.A O no hydrogen 3.293 N/A VAL 329.A N LEU 336.A O no hydrogen 2.901 N/A ALA 331.A N ARG 334.A O no hydrogen 2.857 N/A ARG 334.A N ALA 331.A O no hydrogen 3.024 N/A ARG 334.A NH1 ASP 332.A OD2 no hydrogen 2.723 N/A ARG 334.A NH2 ASP 57.A OD1 no hydrogen 3.163 N/A LEU 335.A N ILE 347.A O no hydrogen 2.819 N/A LEU 336.A N VAL 329.A O no hydrogen 2.756 N/A ILE 337.A N TYR 345.A O no hydrogen 3.087 N/A GLN 338.A NE2 ALA 45.A O no hydrogen 3.171 N/A GLN 338.A NE2 GLY 342.A O no hydrogen 3.011 N/A ALA 339.A N THR 343.A O no hydrogen 2.866 N/A LYS 340.A N GLY 323.A O no hydrogen 2.945 N/A ASP 341.A N SER 322.A OG no hydrogen 3.072 N/A GLY 342.A N ALA 339.A O no hydrogen 2.878 N/A THR 343.A N ASP 341.A OD1 no hydrogen 3.430 N/A THR 343.A OG1 ASP 341.A OD1 no hydrogen 3.210 N/A LEU 344.A N THR 20.A O no hydrogen 2.877 N/A TYR 345.A N ILE 337.A O no hydrogen 2.916 N/A TYR 345.A OH ASP 320.A OD2 no hydrogen 2.703 N/A ALA 346.A N TRP 18.A O no hydrogen 2.958 N/A ILE 347.A N LEU 335.A O no hydrogen 2.860 N/A THR 348.A N SER 15.A O no hydrogen 2.963 N/A