Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3b0p_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 4.A N ASP 2.A OD1 no hydrogen 3.089 N/A ARG 4.A NE ASP 2.A OD1 no hydrogen 2.909 N/A ARG 4.A NE ASP 2.A OD2 no hydrogen 3.218 N/A ARG 4.A NH1 ASP 2.A OD2 no hydrogen 2.564 N/A SER 6.A N VAL 211.A O no hydrogen 3.029 N/A VAL 7.A N ARG 30.A O no hydrogen 2.912 N/A ALA 8.A N LEU 213.A O no hydrogen 2.911 N/A MET 10.A N THR 14.A OG1 no hydrogen 2.976 N/A ASP 12.A N GLU 34.A OE2 no hydrogen 2.755 N/A ARG 13.A N MET 10.A O no hydrogen 2.834 N/A THR 14.A N MET 10.A O no hydrogen 2.859 N/A THR 14.A OG1 MET 10.A O no hydrogen 3.268 N/A THR 14.A OG1 TYR 32.A O no hydrogen 3.366 N/A ARG 16.A NH1 GLU 254.A OE2 no hydrogen 2.957 N/A ARG 16.A NH2 GLU 254.A OE1 no hydrogen 2.648 N/A ARG 16.A NH2 GLU 254.A OE2 no hydrogen 3.491 N/A HIS 17.A N ASP 15.A OD1 no hydrogen 2.982 N/A HIS 17.A ND1 TYR 250.A OH no hydrogen 2.754 N/A PHE 18.A N ASP 15.A OD1 no hydrogen 3.223 N/A ARG 19.A N ASP 15.A O no hydrogen 3.005 N/A ARG 19.A NE GLU 56.A OE2 no hydrogen 2.755 N/A ARG 19.A NH1 THR 14.A O no hydrogen 2.917 N/A ARG 19.A NH2 GLU 56.A OE2 no hydrogen 2.915 N/A PHE 20.A N ARG 16.A O no hydrogen 2.932 N/A LEU 21.A N HIS 17.A O no hydrogen 3.159 N/A VAL 22.A N PHE 18.A O no hydrogen 2.968 N/A ARG 23.A N ARG 19.A O no hydrogen 2.924 N/A ARG 23.A NE GLU 55.A O no hydrogen 2.996 N/A ARG 23.A NH1 VAL 29.A O no hydrogen 3.052 N/A ARG 23.A NH1 GLU 56.A O no hydrogen 2.860 N/A ARG 23.A NH2 SER 26.A O no hydrogen 2.778 N/A ARG 23.A NH2 VAL 29.A O no hydrogen 2.893 N/A GLN 24.A N PHE 20.A O no hydrogen 3.310 N/A GLN 24.A N LEU 21.A O no hydrogen 3.025 N/A GLN 24.A NE2 PHE 20.A O no hydrogen 3.141 N/A VAL 25.A N VAL 22.A O no hydrogen 2.824 N/A SER 26.A N VAL 22.A O no hydrogen 2.979 N/A SER 26.A OG ASP 228.A OD1 no hydrogen 2.779 N/A LEU 27.A N ASP 228.A OD2 no hydrogen 2.704 N/A GLY 28.A N ASP 228.A OD1 no hydrogen 3.000 N/A VAL 29.A N SER 26.A OG no hydrogen 3.183 N/A ARG 30.A N LEU 5.A O no hydrogen 2.890 N/A ARG 30.A NE GLU 85.A OE2 no hydrogen 2.657 N/A ARG 30.A NH1 GLU 85.A OE2 no hydrogen 3.012 N/A LEU 31.A N PRO 58.A O no hydrogen 3.098 N/A TYR 32.A OH GLU 85.A OE1 no hydrogen 2.851 N/A THR 33.A N ALA 60.A O no hydrogen 3.008 N/A THR 33.A OG1 GLU 34.A O no hydrogen 2.951 N/A THR 36.A N GLN 62.A O no hydrogen 2.944 N/A THR 36.A OG1 GLU 34.A O no hydrogen 2.845 N/A ASP 38.A N ALA 64.A O no hydrogen 2.829 N/A VAL 41.A N VAL 37.A O no hydrogen 3.245 N/A LEU 42.A N ASP 38.A O no hydrogen 2.950 N/A ARG 43.A N GLN 39.A O no hydrogen 2.858 N/A GLY 44.A N ALA 40.A O no hydrogen 2.764 N/A ARG 46.A NE VAL 41.A O no hydrogen 2.926 N/A ARG 46.A NH2 LEU 42.A O no hydrogen 3.061 N/A ARG 48.A N ASN 45.A OD1 no hydrogen 3.139 N/A LEU 49.A N ASN 45.A O no hydrogen 2.933 N/A LEU 50.A N ARG 46.A O no hydrogen 2.833 N/A ALA 51.A N GLU 47.A O no hydrogen 2.935 N/A ARG 53.A N GLU 56.A OE1 no hydrogen 2.845 N/A ARG 53.A NH2 GLU 254.A OE2 no hydrogen 2.782 N/A GLU 55.A N GLU 55.A OE1 no hydrogen 2.834 N/A GLU 56.A N ARG 53.A O no hydrogen 2.852 N/A HIS 57.A N PRO 54.A O no hydrogen 3.198 N/A HIS 57.A ND1 ASP 84.A OD2 no hydrogen 2.713 N/A ILE 59.A N ASP 84.A OD2 no hydrogen 2.866 N/A ALA 60.A N LEU 31.A O no hydrogen 2.858 N/A LEU 61.A N GLU 85.A O no hydrogen 2.983 N/A GLN 62.A N THR 33.A OG1 no hydrogen 2.931 N/A GLN 62.A NE2 ASN 87.A OD1 no hydrogen 2.944 N/A LEU 63.A N ASN 87.A O no hydrogen 2.798 N/A ALA 64.A N THR 36.A O no hydrogen 3.087 N/A SER 70.A N ASP 67.A OD2 no hydrogen 3.015 N/A SER 70.A OG ASP 67.A OD2 no hydrogen 2.936 N/A LEU 71.A N ASP 67.A O no hydrogen 2.949 N/A ALA 72.A N PRO 68.A O no hydrogen 2.841 N/A GLU 73.A N LYS 69.A O no hydrogen 2.988 N/A ALA 74.A N SER 70.A O no hydrogen 2.962 N/A ALA 75.A N LEU 71.A O no hydrogen 2.857 N/A ARG 76.A N ALA 72.A O no hydrogen 2.943 N/A ARG 76.A NE GLU 73.A OE1 no hydrogen 2.895 N/A ARG 76.A NH2 GLU 73.A OE1 no hydrogen 3.030 N/A ILE 77.A N GLU 73.A O no hydrogen 3.013 N/A GLY 78.A N ALA 74.A O no hydrogen 2.956 N/A GLU 79.A N ALA 75.A O no hydrogen 2.811 N/A ALA 80.A N ARG 76.A O no hydrogen 2.987 N/A PHE 81.A N ILE 77.A O no hydrogen 3.176 N/A PHE 81.A N GLY 78.A O no hydrogen 3.058 N/A GLY 82.A N GLU 79.A O no hydrogen 3.020 N/A TYR 83.A N GLY 78.A O no hydrogen 3.383 N/A TYR 83.A OH LEU 50.A O no hydrogen 2.607 N/A ASP 84.A N ILE 59.A O no hydrogen 2.886 N/A ILE 86.A N PRO 127.A O no hydrogen 2.957 N/A ASN 87.A N LEU 61.A O no hydrogen 2.776 N/A ASN 87.A ND2 THR 129.A OG1 no hydrogen 2.909 N/A LEU 88.A N THR 129.A O no hydrogen 2.786 N/A ASN 89.A N LEU 63.A O no hydrogen 2.928 N/A ASN 89.A ND2 GLN 62.A OE1 no hydrogen 3.411 N/A LEU 90.A N LYS 131.A O no hydrogen 2.708 N/A GLY 91.A N ASN 89.A OD1 no hydrogen 2.975 N/A CYS 92.A N ASN 89.A OD1 no hydrogen 2.947 N/A CYS 92.A SG SER 94.A OG no hydrogen 3.287 N/A ALA 97.A N SER 94.A OG no hydrogen 3.182 N/A GLN 98.A N SER 94.A O no hydrogen 3.113 N/A GLU 99.A N GLU 95.A O no hydrogen 3.324 N/A GLY 100.A N LYS 96.A O no hydrogen 3.033 N/A GLY 101.A N GLN 98.A O no hydrogen 3.089 N/A TYR 102.A N ALA 97.A O no hydrogen 2.883 N/A ALA 104.A N CYS 92.A O no hydrogen 2.792 N/A CYS 105.A SG ALA 97.A O no hydrogen 3.645 N/A CYS 105.A SG TYR 102.A O no hydrogen 3.478 N/A LEU 106.A N GLY 103.A O no hydrogen 3.186 N/A LEU 107.A N ALA 104.A O no hydrogen 3.215 N/A LEU 108.A N CYS 105.A O no hydrogen 3.244 N/A ASP 109.A N LEU 106.A O no hydrogen 2.697 N/A ARG 112.A N ASP 109.A OD1 no hydrogen 3.255 N/A ARG 112.A NH2 SER 66.A O no hydrogen 2.968 N/A VAL 113.A N ASP 109.A O no hydrogen 3.081 N/A ARG 114.A N LEU 110.A O no hydrogen 2.859 N/A GLU 115.A N ALA 111.A O no hydrogen 3.072 N/A ILE 116.A N ARG 112.A O no hydrogen 2.834 N/A LEU 117.A N VAL 113.A O no hydrogen 2.976 N/A LYS 118.A N ARG 114.A O no hydrogen 3.028 N/A ALA 119.A N GLU 115.A O no hydrogen 3.148 N/A MET 120.A N ILE 116.A O no hydrogen 2.907 N/A GLY 121.A N LEU 117.A O no hydrogen 2.902 N/A GLU 122.A N LYS 118.A O no hydrogen 3.066 N/A ALA 123.A N ALA 119.A O no hydrogen 3.198 N/A ALA 123.A N MET 120.A O no hydrogen 3.166 N/A ARG 125.A N GLU 79.A OE2 no hydrogen 2.788 N/A ARG 125.A NH1 GLU 122.A O no hydrogen 2.905 N/A ARG 125.A NH2 GLU 122.A O no hydrogen 3.333 N/A THR 129.A N ILE 86.A O no hydrogen 2.898 N/A THR 129.A OG1 GLU 85.A OE1 no hydrogen 2.608 N/A VAL 130.A N VAL 159.A O no hydrogen 3.236 N/A LYS 131.A N LEU 88.A O no hydrogen 2.960 N/A MET 132.A N VAL 161.A O no hydrogen 2.895 N/A ARG 133.A NE ARG 165.A O no hydrogen 2.645 N/A ARG 133.A NH1 SER 166.A O no hydrogen 2.796 N/A LEU 134.A N ARG 165.A O no hydrogen 3.507 N/A GLU 137.A N ALA 167.A O no hydrogen 2.865 N/A LYS 139.A N LEU 136.A O no hydrogen 3.239 N/A TYR 142.A OH ASP 183.A OD2 no hydrogen 2.431 N/A GLY 144.A N THR 141.A OG1 no hydrogen 3.034 N/A LEU 145.A N THR 141.A O no hydrogen 3.117 N/A ALA 146.A N TYR 142.A O no hydrogen 2.807 N/A GLN 147.A N ARG 143.A O no hydrogen 2.803 N/A SER 148.A N GLY 144.A O no hydrogen 3.018 N/A SER 148.A OG GLY 144.A O no hydrogen 3.281 N/A VAL 149.A N LEU 145.A O no hydrogen 2.996 N/A GLU 150.A N ALA 146.A O no hydrogen 2.936 N/A ALA 151.A N GLN 147.A O no hydrogen 3.150 N/A MET 152.A N SER 148.A O no hydrogen 3.107 N/A ALA 153.A N VAL 149.A O no hydrogen 2.823 N/A GLU 154.A N GLU 150.A O no hydrogen 2.993 N/A ALA 155.A N ALA 151.A O no hydrogen 3.311 N/A ALA 155.A N MET 152.A O no hydrogen 3.077 N/A GLY 156.A N ALA 153.A O no hydrogen 2.984 N/A VAL 157.A N MET 152.A O no hydrogen 3.181 N/A PHE 160.A N THR 188.A O no hydrogen 2.886 N/A VAL 161.A N VAL 130.A O no hydrogen 2.836 N/A VAL 162.A N VAL 190.A O no hydrogen 2.797 N/A HIS 163.A N MET 132.A O no hydrogen 2.828 N/A ALA 164.A N ASN 192.A O no hydrogen 2.896 N/A ARG 165.A N HIS 163.A O no hydrogen 2.759 N/A ALA 167.A N GLY 135.A O no hydrogen 2.885 N/A ARG 173.A N ALA 164.A O no hydrogen 2.776 N/A HIS 174.A ND1 THR 191.A OG1 no hydrogen 2.677 N/A HIS 174.A NE2 GLY 193.A O no hydrogen 2.850 N/A TRP 176.A N ARG 173.A O no hydrogen 3.015 N/A HIS 178.A N HIS 174.A O no hydrogen 2.982 N/A HIS 178.A NE2 HIS 204.A ND1 no hydrogen 3.230 N/A ARG 179.A N ASP 175.A O no hydrogen 2.859 N/A LEU 180.A N TRP 176.A O no hydrogen 2.891 N/A LYS 181.A N VAL 177.A O no hydrogen 3.131 N/A LYS 181.A NZ PRO 185.A O no hydrogen 3.203 N/A LYS 181.A NZ LEU 187.A O no hydrogen 2.835 N/A LYS 181.A NZ ASP 209.A OD1 no hydrogen 2.927 N/A LYS 181.A NZ ASP 209.A OD2 no hydrogen 2.844 N/A GLY 182.A N HIS 178.A O no hydrogen 3.202 N/A ASP 183.A N ARG 179.A O no hydrogen 2.866 N/A PHE 184.A N LEU 180.A O no hydrogen 2.775 N/A GLN 186.A N GLN 186.A OE1 no hydrogen 2.863 N/A LEU 187.A N PHE 184.A O no hydrogen 2.976 N/A THR 188.A N LYS 158.A O no hydrogen 2.769 N/A PHE 189.A N ASP 209.A OD2 no hydrogen 2.816 N/A VAL 190.A N PHE 160.A O no hydrogen 2.879 N/A THR 191.A N GLY 210.A O no hydrogen 2.983 N/A THR 191.A OG1 HIS 174.A ND1 no hydrogen 2.677 N/A ASN 192.A ND2 MET 212.A O no hydrogen 2.965 N/A ARG 196.A N GLU 200.A OE1 no hydrogen 2.938 N/A ARG 196.A NH2 GLU 219.A OE1 no hydrogen 2.667 N/A GLU 199.A N GLU 199.A OE1 no hydrogen 2.726 N/A GLU 200.A N SER 197.A OG no hydrogen 2.991 N/A ALA 201.A N SER 197.A O no hydrogen 3.022 N/A LEU 202.A N LEU 198.A O no hydrogen 2.840 N/A PHE 203.A N GLU 199.A O no hydrogen 3.106 N/A HIS 204.A N GLU 200.A O no hydrogen 3.331 N/A HIS 204.A ND1 HIS 178.A NE2 no hydrogen 3.230 N/A LEU 205.A N ALA 201.A O no hydrogen 2.862 N/A LYS 206.A N PHE 203.A O no hydrogen 3.429 N/A ARG 207.A N HIS 204.A O no hydrogen 2.805 N/A ARG 207.A NH2 PHE 203.A O no hydrogen 2.855 N/A VAL 208.A N HIS 204.A O no hydrogen 2.939 N/A ASP 209.A N PHE 189.A O no hydrogen 3.038 N/A GLY 210.A N PHE 189.A O no hydrogen 3.178 N/A VAL 211.A N ARG 4.A O no hydrogen 2.939 N/A MET 212.A N THR 191.A O no hydrogen 2.903 N/A LEU 213.A N SER 6.A O no hydrogen 2.892 N/A VAL 217.A N GLY 214.A O no hydrogen 3.058 N/A TYR 218.A N GLY 214.A O no hydrogen 3.229 N/A TYR 218.A OH HIS 267.A ND1 no hydrogen 2.642 N/A GLU 219.A N ARG 215.A O no hydrogen 2.886 N/A ASP 220.A N ALA 216.A O no hydrogen 3.066 N/A VAL 223.A N ASP 220.A O no hydrogen 2.857 N/A LEU 224.A N PRO 221.A O no hydrogen 3.075 N/A GLU 225.A N PHE 222.A O no hydrogen 2.981 N/A ALA 227.A N LEU 224.A O no hydrogen 3.022 N/A ARG 230.A N GLU 226.A O no hydrogen 2.751 N/A ARG 230.A NH2 GLU 226.A OE1 no hydrogen 3.398 N/A VAL 231.A N ALA 227.A O no hydrogen 2.822 N/A PHE 232.A N ALA 227.A O no hydrogen 3.145 N/A LEU 234.A N ASP 228.A O no hydrogen 2.738 N/A ARG 236.A N LEU 234.A O no hydrogen 2.768 N/A ARG 236.A NH1 GLN 24.A O no hydrogen 2.728 N/A ARG 236.A NH2 VAL 25.A O no hydrogen 3.035 N/A ARG 236.A NH2 ASP 228.A OD2 no hydrogen 2.896 N/A ARG 237.A NH1 GLU 226.A OE2 no hydrogen 3.523 N/A ARG 237.A NH2 GLU 226.A OE2 no hydrogen 3.250 N/A GLU 242.A N SER 239.A OG no hydrogen 3.110 N/A VAL 243.A N SER 239.A O no hydrogen 2.998 N/A ALA 244.A N ARG 240.A O no hydrogen 2.840 N/A ARG 245.A N LEU 241.A O no hydrogen 2.922 N/A ARG 245.A NE GLU 302.A OE2 no hydrogen 2.648 N/A ARG 245.A NH2 GLU 302.A OE2 no hydrogen 2.801 N/A ARG 246.A N GLU 242.A O no hydrogen 2.974 N/A ARG 246.A NH1 ARG 246.A O no hydrogen 2.849 N/A MET 247.A N VAL 243.A O no hydrogen 2.838 N/A ARG 248.A N ALA 244.A O no hydrogen 2.906 N/A ARG 248.A NE ASP 295.A OD2 no hydrogen 2.694 N/A ARG 248.A NH1 ASP 295.A OD1 no hydrogen 2.997 N/A ARG 248.A NH1 ASP 295.A OD2 no hydrogen 3.538 N/A ALA 249.A N ARG 245.A O no hydrogen 3.268 N/A TYR 250.A N ARG 246.A O no hydrogen 3.034 N/A TYR 250.A OH HIS 17.A ND1 no hydrogen 2.754 N/A LEU 251.A N MET 247.A O no hydrogen 2.765 N/A GLU 252.A N ARG 248.A O no hydrogen 2.937 N/A GLU 253.A N ALA 249.A O no hydrogen 3.200 N/A GLU 254.A N TYR 250.A O no hydrogen 2.843 N/A VAL 255.A N LEU 251.A O no hydrogen 2.842 N/A LEU 256.A N GLU 252.A O no hydrogen 3.282 N/A LYS 257.A N GLU 253.A O no hydrogen 2.921 N/A GLY 258.A N VAL 255.A O no hydrogen 3.078 N/A THR 259.A N GLU 254.A O no hydrogen 2.869 N/A THR 259.A OG1 GLU 254.A O no hydrogen 3.362 N/A THR 259.A OG1 GLU 254.A OE1 no hydrogen 2.772 N/A ALA 263.A N PRO 260.A O no hydrogen 2.984 N/A VAL 264.A N PRO 261.A O no hydrogen 3.084 N/A LEU 265.A N PRO 261.A O no hydrogen 2.964 N/A ARG 266.A N TRP 262.A O no hydrogen 2.925 N/A ARG 266.A NH1 ASP 12.A O no hydrogen 3.421 N/A ARG 266.A NH2 ASP 12.A O no hydrogen 3.336 N/A ARG 266.A NH2 ASP 12.A OD1 no hydrogen 3.006 N/A HIS 267.A N VAL 264.A O no hydrogen 3.119 N/A HIS 267.A ND1 TYR 218.A OH no hydrogen 2.642 N/A HIS 267.A NE2 ASP 15.A OD2 no hydrogen 2.883 N/A MET 268.A N LEU 265.A O no hydrogen 2.993 N/A ASN 270.A ND2 TYR 218.A O no hydrogen 2.990 N/A LEU 271.A N MET 268.A O no hydrogen 3.362 N/A ARG 273.A N ASN 270.A O no hydrogen 3.086 N/A ARG 273.A NE GLU 219.A O no hydrogen 2.662 N/A ARG 273.A NH2 ASN 270.A OD1 no hydrogen 3.073 N/A ARG 275.A N PHE 272.A O no hydrogen 2.972 N/A GLY 278.A N ARG 275.A O no hydrogen 2.863 N/A TRP 281.A N LYS 277.A O no hydrogen 2.956 N/A TRP 281.A NE1 MET 268.A O no hydrogen 2.854 N/A ARG 282.A N GLY 278.A O no hydrogen 3.239 N/A ARG 283.A N ARG 279.A O no hydrogen 3.031 N/A LEU 284.A N LEU 280.A O no hydrogen 2.858 N/A LEU 285.A N TRP 281.A O no hydrogen 3.155 N/A SER 286.A N ARG 282.A O no hydrogen 2.922 N/A SER 286.A OG ARG 282.A O no hydrogen 3.021 N/A GLU 287.A N ARG 283.A O no hydrogen 2.835 N/A GLY 288.A N LEU 284.A O no hydrogen 3.015 N/A ARG 289.A N LEU 285.A O no hydrogen 2.838 N/A ARG 289.A NE SER 286.A O no hydrogen 2.962 N/A ALA 293.A N SER 290.A OG no hydrogen 3.102 N/A LEU 294.A N SER 290.A O no hydrogen 3.055 N/A ASP 295.A N LEU 291.A O no hydrogen 2.864 N/A ARG 296.A N GLN 292.A O no hydrogen 2.977 N/A ALA 297.A N ALA 293.A O no hydrogen 2.923 N/A LEU 298.A N LEU 294.A O no hydrogen 2.779 N/A ARG 299.A N ASP 295.A O no hydrogen 3.088 N/A LEU 300.A N ARG 296.A O no hydrogen 3.180 N/A MET 301.A N ALA 297.A O no hydrogen 3.064 N/A GLU 302.A N LEU 298.A O no hydrogen 2.848 N/A GLU 303.A N ARG 299.A O no hydrogen 3.125 N/A GLU 304.A N LEU 300.A O no hydrogen 3.061 N/A GLU 304.A N MET 301.A O no hydrogen 2.981 N/A VAL 305.A N MET 301.A O no hydrogen 2.986 N/A GLY 306.A N GLU 302.A O no hydrogen 3.174 N/A