Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3clu_D.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N ASP 34.A OD1 no hydrogen 2.672 N/A SER 1.A OG SER 89.A OG.B no hydrogen 3.299 N/A LYS 2.A NZ GLU 59.A OE1 no hydrogen 2.778 N/A LYS 2.A NZ GLU 59.A OE2 no hydrogen 3.450 N/A LYS 2.A NZ HIS 86.A ND1 no hydrogen 2.827 N/A ILE 3.A N LYS 35.A O no hydrogen 2.963 N/A LEU 4.A N VAL 90.A O no hydrogen 2.854 N/A VAL 5.A N VAL 37.A O no hydrogen 2.714 N/A ILE 6.A N LEU 92.A O no hydrogen 3.028 N/A ALA 7.A N ALA 39.A O no hydrogen 2.898 N/A GLU 8.A N SER 18.A OG no hydrogen 2.927 N/A HIS 9.A NE2 ILE 41.A O no hydrogen 2.657 N/A ARG 10.A N ASP 13.A O no hydrogen 2.822 N/A ARG 10.A NH2 ASP 98.A OD1 no hydrogen 2.848 N/A ARG 11.A N ASP 69.A OD2 no hydrogen 2.964 N/A ASP 13.A N ARG 10.A O no hydrogen 3.013 N/A ARG 15.A N GLU 8.A O no hydrogen 2.696 N/A ARG 15.A NH2 GLU 8.A OE2 no hydrogen 2.722 N/A SER 18.A N ARG 15.A O no hydrogen 2.896 N/A SER 18.A OG GLU 8.A O no hydrogen 3.106 N/A SER 18.A OG ARG 15.A O no hydrogen 2.808 N/A LEU 19.A N PRO 16.A O no hydrogen 3.021 N/A GLU 20.A N PRO 16.A O no hydrogen 3.445 N/A LEU 21.A N VAL 17.A O no hydrogen 2.968 N/A ILE 22.A N SER 18.A O no hydrogen 3.248 N/A GLY 23.A N LEU 19.A O no hydrogen 3.003 N/A ALA 24.A N GLU 20.A O no hydrogen 2.938 N/A ALA 25.A N LEU 21.A O no hydrogen 2.863 N/A ASN 26.A N ILE 22.A O no hydrogen 3.049 N/A ASN 26.A ND2 ILE 22.A O no hydrogen 2.881 N/A ASN 26.A ND2 GLY 56.A O no hydrogen 2.812 N/A GLY 27.A N GLY 23.A O no hydrogen 2.979 N/A LEU 28.A N ALA 25.A O no hydrogen 3.029 N/A LYS 29.A N ALA 25.A O no hydrogen 3.123 N/A LYS 29.A NZ GLY 32.A O no hydrogen 3.494 N/A LYS 29.A NZ ASP 34.A O no hydrogen 3.125 N/A LYS 30.A N ASP 34.A OD2 no hydrogen 2.884 N/A LYS 30.A NZ ASP 126.A OD1 no hydrogen 2.815 N/A SER 31.A N ASP 34.A OD2 no hydrogen 3.047 N/A ASP 34.A N SER 31.A O no hydrogen 2.941 N/A LYS 35.A N SER 1.A O no hydrogen 2.997 N/A VAL 36.A N ASP 58.A OD2 no hydrogen 2.602 N/A VAL 37.A N ILE 3.A O no hydrogen 2.856 N/A VAL 38.A N GLU 59.A O no hydrogen 2.768 N/A ALA 39.A N VAL 5.A O no hydrogen 2.921 N/A VAL 40.A N VAL 61.A O no hydrogen 2.977 N/A GLY 42.A N VAL 63.A O no hydrogen 2.911 N/A SER 43.A N SER 67.A O no hydrogen 2.789 N/A ALA 45.A N GLY 42.A O no hydrogen 3.240 N/A ALA 47.A N GLN 44.A O no hydrogen 3.458 N/A PHE 48.A N ALA 45.A O no hydrogen 3.002 N/A VAL 49.A N ASP 46.A O no hydrogen 3.222 N/A LEU 52.A N PHE 48.A O no hydrogen 2.960 N/A LEU 52.A N VAL 49.A O no hydrogen 3.012 N/A SER 53.A N PRO 50.A O no hydrogen 3.178 N/A SER 53.A OG VAL 49.A O no hydrogen 2.576 N/A ASN 55.A N GLY 165.A O no hydrogen 2.923 N/A ASN 55.A ND2 GLU 164.A O no hydrogen 2.907 N/A VAL 57.A N VAL 54.A O no hydrogen 3.271 N/A ASP 58.A N VAL 36.A O no hydrogen 2.906 N/A GLU 59.A N VAL 36.A O no hydrogen 3.157 N/A LEU 60.A N VAL 170.A O no hydrogen 2.843 N/A VAL 61.A N VAL 38.A O no hydrogen 2.681 N/A VAL 62.A N SER 172.A O no hydrogen 2.805 N/A VAL 63.A N VAL 40.A O no hydrogen 2.881 N/A LYS 64.A N VAL 174.A O no hydrogen 3.014 N/A SER 67.A OG ASP 69.A O no hydrogen 2.817 N/A VAL 74.A N ASP 71.A OD1 no hydrogen 2.744 N/A PHE 75.A N ASP 71.A O no hydrogen 2.902 N/A GLU 76.A N PRO 72.A O no hydrogen 3.021 N/A ALA 77.A N ASP 73.A O no hydrogen 3.041 N/A SER 78.A N VAL 74.A O no hydrogen 2.868 N/A SER 78.A OG VAL 74.A O no hydrogen 2.842 N/A VAL 79.A N PHE 75.A O no hydrogen 2.809 N/A SER 80.A N GLU 76.A O no hydrogen 2.978 N/A ALA 81.A N ALA 77.A O no hydrogen 3.026 N/A LEU 82.A N SER 78.A O no hydrogen 2.881 N/A ILE 83.A N VAL 79.A O no hydrogen 2.925 N/A ALA 84.A N SER 80.A O no hydrogen 2.939 N/A ALA 85.A N ALA 81.A O no hydrogen 2.849 N/A HIS 86.A N LEU 82.A O no hydrogen 2.909 N/A ASN 87.A N.A ILE 83.A O no hydrogen 2.901 N/A ASN 87.A N.B ILE 83.A O no hydrogen 2.816 N/A SER 89.A N.A LYS 2.A O no hydrogen 2.966 N/A SER 89.A N.B LYS 2.A O no hydrogen 2.948 N/A SER 89.A OG.A LYS 2.A O no hydrogen 3.155 N/A SER 89.A OG.B SER 1.A OG no hydrogen 3.299 N/A VAL 91.A N VAL 151.A O no hydrogen 2.791 N/A LEU 92.A N LEU 4.A O no hydrogen 2.737 N/A LEU 93.A N LEU 153.A O no hydrogen 2.881 N/A HIS 95.A N ILE 155.A O no hydrogen 2.766 N/A HIS 95.A ND1 THR 154.A OG1 no hydrogen 2.803 N/A SER 96.A OG GLU 8.A OE1 no hydrogen 2.609 N/A SER 96.A OG GLU 8.A OE2 no hydrogen 3.274 N/A SER 96.A OG SER 99.A OG no hydrogen 3.396 N/A SER 99.A N SER 96.A OG no hydrogen 3.171 N/A SER 99.A OG PRO 94.A O no hydrogen 2.574 N/A SER 99.A OG SER 96.A OG no hydrogen 3.396 N/A LEU 100.A N SER 96.A O no hydrogen 2.934 N/A GLY 101.A N VAL 97.A O no hydrogen 3.360 N/A GLY 101.A N ASP 98.A O no hydrogen 2.928 N/A TYR 102.A N SER 99.A O no hydrogen 3.026 N/A ALA 103.A N SER 99.A O no hydrogen 2.819 N/A SER 105.A N TYR 102.A O no hydrogen 2.971 N/A SER 105.A OG GLU 76.A OE1 no hydrogen 2.698 N/A SER 105.A OG GLU 76.A OE2 no hydrogen 3.199 N/A LEU 106.A N TYR 102.A O no hydrogen 2.913 N/A ALA 107.A N ALA 103.A O no hydrogen 3.172 N/A SER 108.A N SER 104.A O no hydrogen 3.160 N/A SER 108.A N SER 105.A O no hydrogen 3.029 N/A SER 108.A OG SER 104.A O no hydrogen 2.688 N/A LYS 109.A NZ GLU 76.A OE1 no hydrogen 3.414 N/A LYS 109.A NZ GLU 76.A OE2 no hydrogen 2.624 N/A THR 110.A OG1 LEU 106.A O no hydrogen 3.096 N/A GLY 113.A N THR 150.A O no hydrogen 2.896 N/A ALA 115.A N VAL 152.A O no hydrogen 3.199 N/A ASP 117.A N THR 154.A OG1 no hydrogen 2.873 N/A VAL 118.A N THR 154.A O no hydrogen 2.983 N/A TYR 119.A N THR 131.A O no hydrogen 2.991 N/A TYR 119.A OH ASN 140.A OD1 no hydrogen 2.776 N/A ILE 120.A N THR 131.A O no hydrogen 3.359 N/A GLU 122.A N VAL 129.A O no hydrogen 3.085 N/A GLN 124.A N GLU 127.A O no hydrogen 2.845 N/A GLN 124.A NE2 GLU 122.A OE1 no hydrogen 2.797 N/A GLU 127.A N GLN 124.A O no hydrogen 2.967 N/A VAL 129.A N GLU 122.A O no hydrogen 2.901 N/A ALA 130.A N VAL 143.A O no hydrogen 2.958 N/A THR 131.A N ILE 120.A O no hydrogen 2.895 N/A ARG 132.A N VAL 141.A O no hydrogen 2.962 N/A ARG 132.A NE THR 116.A O no hydrogen 2.810 N/A ARG 132.A NH2 THR 116.A O no hydrogen 3.302 N/A ARG 132.A NH2 THR 116.A OG1 no hydrogen 3.169 N/A GLY 134.A N VAL 139.A O no hydrogen 2.933 N/A GLN 137.A NE2.A TYR 119.A OH no hydrogen 3.262 N/A LYS 138.A N TYR 135.A O no hydrogen 3.218 N/A VAL 139.A N GLY 134.A O no hydrogen 3.166 N/A VAL 141.A N ARG 132.A O no hydrogen 2.782 N/A VAL 143.A N ALA 130.A O no hydrogen 2.755 N/A LYS 148.A N PHE 145.A O no hydrogen 3.083 N/A THR 150.A OG1 PRO 88.A O no hydrogen 2.938 N/A VAL 151.A N SER 89.A O.A no hydrogen 2.926 N/A VAL 151.A N SER 89.A O.B no hydrogen 3.009 N/A VAL 152.A N GLY 113.A O no hydrogen 2.704 N/A LEU 153.A N VAL 91.A O no hydrogen 2.836 N/A THR 154.A N ALA 115.A O no hydrogen 2.972 N/A THR 154.A OG1 HIS 95.A ND1 no hydrogen 2.803 N/A ILE 155.A N LEU 93.A O no hydrogen 2.710 N/A ARG 156.A N VAL 118.A O no hydrogen 3.008 N/A ARG 156.A NE ASP 117.A OD1 no hydrogen 2.885 N/A ARG 156.A NH1 ASP 117.A OD2 no hydrogen 2.838 N/A ARG 156.A NH1 GLN 137.A OE1.A no hydrogen 2.746 N/A SER 158.A N GLU 20.A OE1 no hydrogen 2.697 N/A GLY 167.A N SER 53.A O no hydrogen 3.176 N/A VAL 170.A N ASP 58.A O no hydrogen 3.142 N/A SER 172.A N LEU 60.A O no hydrogen 2.885 N/A ASN 173.A ND2 ASP 46.A OD1 no hydrogen 2.868 N/A VAL 174.A N VAL 62.A O no hydrogen 2.969 N/A ALA 176.A N LYS 64.A O no hydrogen 3.056 N/A SER 181.A OG ASP 71.A OD1 no hydrogen 3.080 N/A SER 181.A OG ASP 71.A OD2 no hydrogen 2.585 N/A SER 181.A OG SER 183.A O no hydrogen 2.951 N/A ARG 182.A N ASP 73.A OD2 no hydrogen 2.880 N/A ARG 182.A NE ASP 73.A OD2 no hydrogen 2.943 N/A ARG 182.A NH2 ASP 73.A OD1 no hydrogen 2.868 N/A ARG 182.A NH2 ASP 73.A OD2 no hydrogen 3.501 N/A SER 183.A N SER 181.A OG no hydrogen 3.061 N/A GLN 184.A NE2 ASN 185.A O no hydrogen 3.222 N/A ASN 185.A ND2 PHE 70.A O no hydrogen 2.843 N/A TYR 188.A OH ASP 69.A OD2 no hydrogen 2.464 N/A THR 200.A N ASP 198.A OD1 no hydrogen 3.199 N/A THR 200.A OG1 ASP 198.A OD1 no hydrogen 2.773 N/A THR 201.A N ASP 198.A O no hydrogen 2.974 N/A THR 201.A OG1 ASP 198.A O no hydrogen 2.598 N/A ILE 205.A N LEU 262.A O no hydrogen 2.931 N/A MET 206.A N THR 231.A O no hydrogen 3.128 N/A SER 207.A N VAL 264.A O no hydrogen 2.818 N/A SER 207.A OG TYR 263.A OH no hydrogen 2.820 N/A ILE 208.A N CYS 233.A O no hydrogen 2.865 N/A GLY 209.A N MET 266.A O no hydrogen 3.012 N/A GLY 211.A N GLY 267.A O no hydrogen 3.048 N/A ILE 212.A N GLY 209.A O no hydrogen 2.973 N/A GLY 213.A N ARG 210.A O no hydrogen 3.048 N/A GLU 214.A N ILE 212.A O no hydrogen 2.981 N/A ASN 217.A N GLU 214.A O no hydrogen 2.995 N/A ASN 217.A ND2 ILE 212.A O no hydrogen 2.754 N/A VAL 218.A N GLU 215.A O no hydrogen 2.980 N/A GLN 220.A NE2 GLU 311.A OE1 no hydrogen 2.586 N/A PHE 221.A N VAL 218.A O no hydrogen 2.987 N/A ARG 222.A N VAL 218.A O no hydrogen 3.058 N/A ARG 222.A NH1 GLU 219.A OE1 no hydrogen 3.087 N/A GLU 223.A N GLU 219.A O no hydrogen 2.918 N/A LEU 224.A N GLN 220.A O no hydrogen 2.930 N/A ALA 225.A N PHE 221.A O no hydrogen 2.850 N/A ASP 226.A N ARG 222.A O no hydrogen 2.896 N/A GLU 227.A N GLU 223.A O no hydrogen 2.772 N/A ALA 228.A N LEU 224.A O no hydrogen 2.792 N/A GLY 229.A N ASP 226.A O no hydrogen 3.193 N/A ALA 230.A N ALA 225.A O no hydrogen 2.721 N/A THR 231.A N PHE 204.A O no hydrogen 2.950 N/A CYS 233.A N MET 206.A O no hydrogen 2.895 N/A CYS 234.A N ARG 248.A O no hydrogen 2.970 N/A CYS 234.A SG SER 235.A O no hydrogen 3.390 N/A SER 235.A N ILE 208.A O no hydrogen 3.012 N/A LYS 236.A NZ ASP 240.A OD1 no hydrogen 2.695 N/A LYS 236.A NZ ASP 240.A OD2 no hydrogen 3.248 N/A ILE 238.A N SER 235.A O no hydrogen 3.178 N/A ALA 239.A N SER 235.A O no hydrogen 3.433 N/A ASP 240.A N LYS 236.A O no hydrogen 2.727 N/A ALA 241.A N PRO 237.A O no hydrogen 3.021 N/A GLY 242.A N ALA 239.A O no hydrogen 2.947 N/A TRP 243.A N ILE 238.A O no hydrogen 3.083 N/A SER 247.A OG GLY 194.A O no hydrogen 2.696 N/A ARG 248.A N PRO 245.A O no hydrogen 2.957 N/A ARG 248.A NH1 LEU 232.A O no hydrogen 2.856 N/A ARG 248.A NH2 ASP 196.A OD1 no hydrogen 2.893 N/A ARG 248.A NH2 ASP 196.A OD2 no hydrogen 3.545 N/A GLN 249.A N LYS 246.A O no hydrogen 2.941 N/A VAL 250.A N CYS 234.A O no hydrogen 2.969 N/A GLY 251.A N LYS 255.A O no hydrogen 3.048 N/A GLN 252.A N GLN 273.A O no hydrogen 2.859 N/A GLY 254.A N GLY 251.A O no hydrogen 2.883 N/A LYS 255.A N GLN 249.A O no hydrogen 2.887 N/A LYS 255.A NZ LYS 246.A O no hydrogen 3.094 N/A VAL 257.A N GLY 277.A O no hydrogen 2.975 N/A GLY 258.A N VAL 256.A O no hydrogen 2.885 N/A SER 259.A N THR 200.A O no hydrogen 3.271 N/A SER 259.A OG THR 200.A O no hydrogen 2.962 N/A CYS 260.A N VAL 257.A O no hydrogen 3.031 N/A CYS 260.A SG ASP 203.A O no hydrogen 3.778 N/A CYS 260.A SG LEU 262.A O no hydrogen 3.117 N/A LYS 261.A N ASP 203.A O no hydrogen 2.777 N/A LEU 262.A N ASP 203.A O no hydrogen 3.216 N/A TYR 263.A N THR 283.A O no hydrogen 2.998 N/A TYR 263.A OH HIS 274.A NE2 no hydrogen 2.748 N/A VAL 264.A N ILE 205.A O no hydrogen 2.831 N/A ALA 265.A N ILE 285.A O no hydrogen 2.712 N/A MET 266.A N SER 207.A O no hydrogen 2.925 N/A GLY 267.A N VAL 287.A O no hydrogen 2.949 N/A GLN 273.A N GLN 273.A OE1 no hydrogen 2.813 N/A HIS 274.A N SER 271.A OG no hydrogen 3.058 N/A HIS 274.A NE2 TYR 263.A OH no hydrogen 2.748 N/A MET 275.A N SER 271.A O no hydrogen 2.939 N/A ALA 276.A N ILE 272.A O no hydrogen 2.978 N/A GLY 277.A N HIS 274.A O no hydrogen 2.985 N/A MET 278.A N MET 275.A O no hydrogen 3.026 N/A LYS 279.A N MET 275.A O no hydrogen 2.729 N/A HIS 280.A NE2 VAL 257.A O no hydrogen 2.696 N/A VAL 281.A N MET 278.A O no hydrogen 3.098 N/A THR 283.A N LYS 261.A O no hydrogen 3.183 N/A ILE 285.A N TYR 263.A O no hydrogen 2.920 N/A ALA 286.A N TYR 301.A O no hydrogen 2.863 N/A VAL 287.A N ALA 265.A O no hydrogen 2.747 N/A ASN 288.A N ILE 303.A O no hydrogen 3.079 N/A ASN 288.A ND2 ILE 268.A O no hydrogen 3.046 N/A ASP 290.A N ASN 288.A OD1 no hydrogen 2.826 N/A GLY 292.A N ASP 290.A OD1 no hydrogen 2.919 N/A ALA 293.A N ASP 290.A O no hydrogen 2.952 N/A ILE 295.A N SER 269.A O no hydrogen 2.742 N/A PHE 296.A N ALA 293.A O no hydrogen 3.139 N/A THR 297.A N SER 294.A O no hydrogen 2.895 N/A THR 297.A OG1 SER 294.A O no hydrogen 2.578 N/A ILE 298.A N ILE 295.A O no hydrogen 3.129 N/A ALA 299.A N ILE 295.A O no hydrogen 2.994 N/A LYS 300.A N ILE 284.A O no hydrogen 2.939 N/A TYR 301.A N ILE 284.A O no hydrogen 3.186 N/A ILE 303.A N ALA 286.A O no hydrogen 2.789 N/A ASP 309.A N ASP 306.A OD1 no hydrogen 2.860 N/A ILE 310.A N ASP 306.A O no hydrogen 3.084 N/A GLU 311.A N ILE 307.A O no hydrogen 2.800 N/A GLU 312.A N PHE 308.A O no hydrogen 2.936 N/A GLU 313.A N ASP 309.A O no hydrogen 3.123 N/A LEU 314.A N ILE 310.A O no hydrogen 2.828 N/A LYS 315.A N GLU 311.A O no hydrogen 2.963 N/A ALA 316.A N GLU 312.A O no hydrogen 2.915 N/A GLN 317.A N GLU 313.A O no hydrogen 2.860 N/A GLN 317.A NE2 GLU 313.A OE2 no hydrogen 2.896 N/A LEU 318.A N LEU 314.A O no hydrogen 2.801 N/A ALA 319.A N LYS 315.A O no hydrogen 3.171 N/A