Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4dfe_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 3.A N SER 172.A O no hydrogen 2.914 N/A SER 4.A OG ASP 126.A OD1 no hydrogen 2.712 N/A ARG 5.A N GLN 170.A O no hydrogen 2.860 N/A ARG 5.A NE TYR 321.A O no hydrogen 3.387 N/A ARG 5.A NH1 TYR 321.A O no hydrogen 3.450 N/A ARG 5.A NH1 TYR 321.A OXT no hydrogen 3.088 N/A LEU 7.A N ILE 168.A O no hydrogen 2.791 N/A THR 9.A OG1 ASP 289.A OD1 no hydrogen 2.583 N/A GLY 10.A N ALA 166.A O no hydrogen 2.884 N/A SER 11.A OG ASP 289.A OD2 no hydrogen 2.700 N/A TYR 12.A N ALA 164.A O no hydrogen 2.842 N/A ARG 17.A NE GLU 275.A OE2 no hydrogen 2.750 N/A ARG 17.A NH2 GLU 275.A OE1 no hydrogen 2.952 N/A ARG 17.A NH2 GLU 275.A OE2 no hydrogen 3.413 N/A VAL 18.A N ARG 45.A O no hydrogen 2.763 N/A THR 19.A N ASP 22.A OD2 no hydrogen 3.162 N/A ASN 20.A N HIS 43.A O no hydrogen 2.952 N/A ASN 20.A ND2 ASP 33.A O no hydrogen 3.615 N/A ASN 20.A ND2 ASP 33.A OD1 no hydrogen 3.224 N/A ASN 20.A ND2 ILE 42.A O no hydrogen 2.766 N/A ASP 22.A N THR 19.A OG1 no hydrogen 2.912 N/A LEU 23.A N THR 19.A O no hydrogen 3.094 N/A ALA 24.A N ASN 20.A O no hydrogen 2.861 N/A LYS 25.A N GLN 21.A O no hydrogen 2.958 N/A ARG 26.A N ASP 22.A O no hydrogen 3.084 N/A LEU 27.A N LEU 23.A O no hydrogen 3.100 N/A ALA 28.A N ALA 24.A O no hydrogen 3.060 N/A TRP 35.A N SER 32.A OG no hydrogen 3.154 N/A ILE 36.A N SER 32.A O no hydrogen 2.995 N/A VAL 37.A N ASP 33.A O no hydrogen 3.023 N/A ALA 38.A N GLU 34.A O no hydrogen 2.962 N/A ARG 39.A N TRP 35.A O no hydrogen 3.037 N/A THR 40.A N ILE 36.A O no hydrogen 2.867 N/A THR 40.A OG1 ILE 36.A O no hydrogen 2.588 N/A GLY 41.A N VAL 37.A O no hydrogen 2.963 N/A ILE 42.A N THR 40.A OG1 no hydrogen 3.030 N/A HIS 43.A N GLY 274.A O no hydrogen 2.864 N/A ALA 44.A N GLY 274.A O no hydrogen 3.100 N/A ARG 45.A N VAL 18.A O no hydrogen 3.037 N/A ARG 45.A NH1 ASN 20.A OD1 no hydrogen 3.052 N/A ARG 45.A NH1 VAL 158.A O no hydrogen 2.766 N/A ARG 45.A NH2 VAL 18.A O no hydrogen 2.884 N/A ARG 45.A NH2 ASN 20.A OD1 no hydrogen 3.046 N/A TYR 46.A OH GLU 275.A OE2 no hydrogen 2.700 N/A PHE 47.A N ASN 16.A O no hydrogen 3.222 N/A ALA 48.A N ASP 162.A OD2 no hydrogen 2.722 N/A VAL 52.A N GLU 49.A O no hydrogen 2.769 N/A THR 53.A N ASP 56.A OD2 no hydrogen 3.105 N/A THR 53.A OG1 ASP 87.A OD1 no hydrogen 2.429 N/A THR 54.A OG1 THR 85.A O no hydrogen 2.620 N/A THR 54.A OG1 THR 85.A OG1 no hydrogen 3.048 N/A THR 54.A OG1 THR 144.A OG1 no hydrogen 2.925 N/A SER 55.A N THR 53.A OG1 no hydrogen 3.180 N/A SER 55.A N ASP 87.A OD2 no hydrogen 2.938 N/A SER 55.A OG ASP 87.A OD1 no hydrogen 2.700 N/A ASP 56.A N THR 53.A OG1 no hydrogen 3.285 N/A LEU 57.A N THR 53.A O no hydrogen 3.216 N/A ALA 58.A N THR 54.A O no hydrogen 2.818 N/A PHE 59.A N SER 55.A O no hydrogen 2.788 N/A ALA 61.A N LEU 57.A O no hydrogen 3.310 N/A SER 62.A N ALA 58.A O no hydrogen 2.902 N/A SER 62.A OG ALA 58.A O no hydrogen 2.905 N/A GLN 63.A N PHE 59.A O no hydrogen 2.929 N/A ARG 64.A N ILE 60.A O no hydrogen 3.088 N/A ARG 64.A NH1 SER 11.A O no hydrogen 2.886 N/A ALA 65.A N ALA 61.A O no hydrogen 2.997 N/A ILE 66.A N SER 62.A O no hydrogen 2.803 N/A GLU 67.A N GLN 63.A O no hydrogen 2.897 N/A ALA 68.A N ARG 64.A O no hydrogen 3.031 N/A ALA 69.A N ALA 65.A O no hydrogen 2.818 N/A ASP 70.A N ILE 66.A O no hydrogen 2.902 N/A ASP 70.A N GLU 67.A O no hydrogen 3.094 N/A GLN 74.A N ASP 72.A OD1 no hydrogen 2.920 N/A GLN 74.A NE2 GLY 102.A O no hydrogen 2.806 N/A SER 75.A N ASP 72.A O no hydrogen 2.896 N/A SER 75.A OG ASP 72.A O no hydrogen 2.802 N/A ILE 76.A N PRO 73.A O no hydrogen 3.212 N/A ASP 77.A N THR 136.A O no hydrogen 2.903 N/A ILE 79.A N ALA 108.A O no hydrogen 3.034 N/A ILE 80.A N LEU 138.A O no hydrogen 3.000 N/A VAL 81.A N PHE 110.A O no hydrogen 3.065 N/A ALA 82.A N ILE 140.A O no hydrogen 2.746 N/A THR 83.A OG1 ALA 142.A O no hydrogen 2.662 N/A THR 83.A OG1 GLU 143.A OE1 no hydrogen 2.996 N/A SER 84.A N GLU 143.A OE1 no hydrogen 2.935 N/A THR 85.A N THR 83.A OG1 no hydrogen 3.043 N/A THR 85.A OG1 THR 54.A OG1 no hydrogen 3.048 N/A THR 85.A OG1 THR 83.A OG1 no hydrogen 3.361 N/A THR 85.A OG1 GLU 143.A OE1 no hydrogen 2.937 N/A THR 93.A N ASP 111.A OD2 no hydrogen 2.887 N/A THR 93.A OG1 ASP 111.A OD2 no hydrogen 2.931 N/A ALA 94.A N ASP 111.A OD1 no hydrogen 2.916 N/A CYS 95.A N SER 92.A OG no hydrogen 3.127 N/A CYS 95.A SG SER 92.A OG no hydrogen 3.256 N/A CYS 95.A SG ALA 109.A O no hydrogen 3.998 N/A LEU 96.A N SER 92.A O no hydrogen 3.258 N/A LEU 97.A N THR 93.A O no hydrogen 2.833 N/A GLN 98.A N ALA 94.A O no hydrogen 2.838 N/A GLN 98.A NE2 GLY 107.A O no hydrogen 2.955 N/A ASN 99.A N CYS 95.A O no hydrogen 3.285 N/A LYS 100.A N LEU 96.A O no hydrogen 2.933 N/A LYS 100.A NZ SER 55.A OG no hydrogen 2.776 N/A LEU 101.A N LEU 97.A O no hydrogen 2.928 N/A GLY 102.A N ASN 99.A O no hydrogen 2.808 N/A ILE 103.A N GLN 98.A O no hydrogen 3.073 N/A ARG 104.A N GLN 74.A OE1 no hydrogen 2.934 N/A ASN 105.A ND2 GLN 74.A O no hydrogen 2.842 N/A ASN 105.A ND2 ILE 76.A O no hydrogen 2.863 N/A GLY 107.A N ASN 105.A OD1 no hydrogen 2.878 N/A PHE 110.A N ILE 79.A O no hydrogen 3.132 N/A VAL 112.A N VAL 81.A O no hydrogen 3.035 N/A GLN 113.A NE2 SER 84.A OG no hydrogen 2.964 N/A VAL 115.A N GLN 113.A OE1 no hydrogen 3.056 N/A SER 116.A OG THR 313.A OG1 no hydrogen 2.938 N/A GLY 117.A N VAL 115.A O no hydrogen 2.734 N/A TYR 120.A N SER 116.A O no hydrogen 3.141 N/A TYR 120.A OH HIS 183.A O no hydrogen 2.734 N/A ALA 121.A N GLY 117.A O no hydrogen 2.821 N/A VAL 122.A N PHE 118.A O no hydrogen 2.765 N/A ALA 123.A N ALA 119.A O no hydrogen 2.948 N/A THR 124.A N TYR 120.A O no hydrogen 3.056 N/A THR 124.A OG1 TYR 120.A O no hydrogen 2.852 N/A ALA 125.A N ALA 121.A O no hydrogen 3.022 N/A ASP 126.A N VAL 122.A O no hydrogen 2.925 N/A SER 127.A N ALA 123.A O no hydrogen 3.083 N/A PHE 128.A N THR 124.A O no hydrogen 3.007 N/A ILE 129.A N ALA 125.A O no hydrogen 2.876 N/A ARG 130.A N ASP 126.A O no hydrogen 2.874 N/A SER 131.A N SER 127.A O no hydrogen 3.353 N/A SER 131.A OG SER 127.A O no hydrogen 3.507 N/A SER 131.A OG PHE 128.A O no hydrogen 2.907 N/A GLY 132.A N ILE 129.A O no hydrogen 3.036 N/A GLN 133.A N PHE 128.A O no hydrogen 3.170 N/A GLN 133.A N SER 131.A OG no hydrogen 3.241 N/A HIS 134.A N PHE 128.A O no hydrogen 3.250 N/A HIS 134.A ND1 ASP 77.A OD1 no hydrogen 2.999 N/A ARG 135.A N ASP 77.A OD1 no hydrogen 3.095 N/A ARG 135.A N ASP 77.A OD2 no hydrogen 3.135 N/A THR 136.A N ASP 77.A OD2 no hydrogen 3.218 N/A ALA 137.A N LEU 169.A O no hydrogen 2.803 N/A LEU 138.A N LEU 78.A O no hydrogen 2.832 N/A VAL 139.A N VAL 167.A O no hydrogen 2.766 N/A ILE 140.A N ILE 80.A O no hydrogen 2.913 N/A GLY 141.A N GLY 165.A O no hydrogen 2.942 N/A ALA 142.A N ALA 82.A O no hydrogen 3.108 N/A GLU 143.A N GLY 163.A O no hydrogen 2.883 N/A THR 144.A N THR 85.A OG1 no hydrogen 2.910 N/A THR 144.A OG1 THR 54.A OG1 no hydrogen 2.925 N/A SER 146.A N ASP 162.A OD1 no hydrogen 2.856 N/A SER 146.A OG ASP 162.A OD1 no hydrogen 3.122 N/A SER 146.A OG ASP 162.A OD2 no hydrogen 2.504 N/A ARG 147.A N THR 144.A O no hydrogen 2.992 N/A ARG 147.A NH1 VAL 52.A O no hydrogen 3.347 N/A ILE 148.A N PHE 145.A O no hydrogen 3.148 N/A LYS 152.A N ASP 150.A OD1 no hydrogen 2.891 N/A ASP 153.A N ASP 150.A O no hydrogen 3.023 N/A ARG 154.A NH1 GLU 30.A O no hydrogen 3.084 N/A THR 155.A N ASP 153.A OD1 no hydrogen 2.799 N/A THR 156.A N ASP 153.A O no hydrogen 3.307 N/A THR 156.A OG1 ASP 153.A OD2 no hydrogen 2.686 N/A CYS 157.A N ASP 153.A O no hydrogen 3.023 N/A LEU 159.A N THR 156.A O no hydrogen 3.138 N/A GLY 161.A N ASN 278.A O no hydrogen 2.863 N/A ASP 162.A N TYR 46.A O no hydrogen 2.826 N/A GLY 163.A N GLU 143.A O no hydrogen 2.989 N/A ALA 164.A N TYR 12.A O no hydrogen 3.011 N/A GLY 165.A N GLY 141.A O no hydrogen 2.833 N/A ALA 166.A N GLY 10.A O no hydrogen 2.715 N/A VAL 167.A N VAL 139.A O no hydrogen 2.912 N/A ILE 168.A N GLY 8.A O no hydrogen 3.008 N/A LEU 169.A N ALA 137.A O no hydrogen 2.816 N/A GLN 170.A N ARG 5.A O no hydrogen 2.835 N/A GLN 170.A NE2 THR 136.A OG1 no hydrogen 2.940 N/A ALA 171.A N ARG 135.A O no hydrogen 2.992 N/A SER 172.A N TYR 3.A O no hydrogen 2.825 N/A SER 172.A OG GLU 174.A O no hydrogen 2.771 N/A GLU 174.A N SER 172.A OG no hydrogen 2.990 N/A VAL 177.A N SER 4.A O no hydrogen 3.027 N/A LEU 178.A N VAL 318.A O no hydrogen 2.799 N/A ALA 179.A N VAL 318.A O no hydrogen 3.462 N/A SER 180.A OG SER 317.A OG no hydrogen 2.501 N/A ALA 181.A N ALA 316.A O no hydrogen 2.962 N/A HIS 183.A N TRP 314.A O no hydrogen 2.832 N/A HIS 183.A NE2 GLU 230.A OE1 no hydrogen 2.608 N/A ASP 185.A N PHE 312.A O no hydrogen 2.691 N/A SER 187.A N ASP 185.A OD1 no hydrogen 3.029 N/A SER 187.A OG ASP 185.A OD1 no hydrogen 2.602 N/A SER 187.A OG ASP 185.A OD2 no hydrogen 3.416 N/A HIS 188.A N ASP 185.A O no hydrogen 3.218 N/A SER 189.A N GLY 186.A O no hydrogen 3.189 N/A SER 189.A OG GLY 186.A O no hydrogen 3.206 N/A CYS 193.A N HIS 210.A O no hydrogen 3.143 N/A CYS 193.A SG ASN 190.A O no hydrogen 3.735 N/A GLY 196.A N THR 194.A O no hydrogen 2.825 N/A ASN 197.A N SER 204.A O no hydrogen 3.241 N/A VAL 198.A N ASN 197.A OD1 no hydrogen 2.917 N/A ASN 199.A N VAL 202.A O no hydrogen 2.881 N/A VAL 202.A N ASN 199.A O no hydrogen 3.252 N/A SER 204.A N ASN 197.A O no hydrogen 2.995 N/A SER 204.A OG ASN 197.A O no hydrogen 3.468 N/A SER 206.A N PRO 195.A O no hydrogen 3.032 N/A LEU 209.A N ILE 148.A O no hydrogen 2.760 N/A HIS 210.A N CYS 193.A O no hydrogen 2.863 N/A ASP 212.A N ILE 191.A O no hydrogen 2.889 N/A GLN 214.A N ASP 212.A OD1 no hydrogen 3.247 N/A ALA 215.A N ASP 212.A OD1 no hydrogen 3.211 N/A VAL 216.A N ASP 212.A O no hydrogen 2.996 N/A PHE 217.A N GLY 213.A O no hydrogen 3.047 N/A LYS 218.A N GLN 214.A O no hydrogen 3.289 N/A LEU 219.A N ALA 215.A O no hydrogen 3.109 N/A ALA 220.A N VAL 216.A O no hydrogen 2.746 N/A VAL 221.A N PHE 217.A O no hydrogen 2.964 N/A ASN 222.A N LYS 218.A O no hydrogen 3.117 N/A VAL 223.A N LEU 219.A O no hydrogen 3.003 N/A LEU 224.A N ALA 220.A O no hydrogen 2.969 N/A VAL 227.A N VAL 223.A O no hydrogen 2.970 N/A ALA 228.A N LEU 224.A O no hydrogen 3.155 N/A VAL 229.A N GLU 225.A O no hydrogen 3.189 N/A GLU 230.A N LYS 226.A O no hydrogen 2.930 N/A ALA 231.A N VAL 227.A O no hydrogen 2.867 N/A LEU 232.A N ALA 228.A O no hydrogen 2.882 N/A GLU 233.A N VAL 229.A O no hydrogen 2.773 N/A LYS 234.A N GLU 230.A O no hydrogen 2.909 N/A LYS 234.A NZ SER 180.A O no hydrogen 2.878 N/A ALA 235.A N ALA 231.A O no hydrogen 2.999 N/A ALA 235.A N LEU 232.A O no hydrogen 3.262 N/A ASN 236.A N GLU 233.A O no hydrogen 2.945 N/A LEU 237.A N LEU 232.A O no hydrogen 2.847 N/A SER 238.A N GLN 241.A OE1 no hydrogen 2.962 N/A SER 238.A OG GLN 241.A OE1 no hydrogen 3.380 N/A GLN 241.A N SER 238.A O no hydrogen 2.922 N/A ILE 242.A N ALA 239.A O no hydrogen 3.078 N/A ASP 243.A N ASN 302.A O no hydrogen 3.004 N/A TRP 244.A N ASN 302.A O no hydrogen 3.198 N/A TRP 244.A NE1 GLN 301.A OE1 no hydrogen 2.912 N/A LEU 245.A N ARG 268.A O no hydrogen 2.764 N/A ILE 246.A N LEU 304.A O no hydrogen 2.750 N/A HIS 248.A N GLU 306.A O no hydrogen 2.874 N/A HIS 248.A NE2 ASN 278.A OD1 no hydrogen 2.857 N/A GLN 249.A N SER 283.A OG no hydrogen 2.785 N/A GLN 249.A NE2 PRO 247.A O no hydrogen 2.833 N/A GLN 249.A NE2 ILE 270.A O no hydrogen 3.109 N/A ALA 250.A N HIS 248.A O no hydrogen 3.005 N/A ILE 252.A N THR 40.A O no hydrogen 2.962 N/A ILE 254.A N ASN 251.A OD1 no hydrogen 3.070 N/A MET 255.A N ASN 251.A O no hydrogen 3.247 N/A GLN 256.A N ILE 252.A O no hydrogen 2.816 N/A SER 257.A N ARG 253.A O no hydrogen 3.002 N/A THR 258.A N ILE 254.A O no hydrogen 3.072 N/A THR 258.A OG1 ILE 254.A O no hydrogen 2.963 N/A CYS 259.A N MET 255.A O no hydrogen 3.087 N/A CYS 259.A SG LEU 264.A O no hydrogen 3.733 N/A CYS 259.A SG PRO 265.A O no hydrogen 3.668 N/A ARG 260.A N GLN 256.A O no hydrogen 2.959 N/A LYS 261.A N SER 257.A O no hydrogen 2.850 N/A LEU 262.A N THR 258.A O no hydrogen 3.038 N/A GLY 263.A N ARG 260.A O no hydrogen 2.679 N/A LEU 264.A N CYS 259.A O no hydrogen 3.184 N/A GLN 266.A NE2 GLN 256.A O no hydrogen 3.272 N/A ARG 268.A N PRO 265.A O no hydrogen 3.055 N/A ARG 268.A NH1 GLU 240.A O no hydrogen 3.535 N/A ARG 268.A NH1 GLU 240.A OE2 no hydrogen 3.409 N/A ARG 268.A NH1 ILE 242.A O no hydrogen 2.718 N/A ARG 268.A NH2 GLU 240.A OE2 no hydrogen 2.597 N/A MET 269.A N GLN 266.A O no hydrogen 3.180 N/A ILE 270.A N LEU 245.A O no hydrogen 2.831 N/A THR 272.A N GLN 249.A OE1 no hydrogen 2.753 N/A VAL 273.A N GLN 249.A OE1 no hydrogen 3.007 N/A GLU 275.A N THR 272.A O no hydrogen 2.952 N/A HIS 276.A N THR 272.A O no hydrogen 2.820 N/A GLY 277.A N VAL 273.A O no hydrogen 2.870 N/A ASN 278.A N LEU 159.A O no hydrogen 3.031 N/A SER 280.A N ASN 278.A OD1 no hydrogen 2.950 N/A SER 280.A OG GLU 143.A OE2 no hydrogen 3.131 N/A ALA 281.A N GLU 143.A OE2 no hydrogen 3.211 N/A ALA 282.A N THR 279.A O no hydrogen 2.879 N/A SER 283.A N SER 280.A O no hydrogen 2.889 N/A LEU 286.A N ALA 282.A O no hydrogen 3.089 N/A ALA 287.A N SER 283.A O no hydrogen 3.200 N/A LEU 288.A N ILE 284.A O no hydrogen 2.768 N/A ASP 289.A N PRO 285.A O no hydrogen 3.026 N/A VAL 290.A N LEU 286.A O no hydrogen 3.015 N/A ALA 291.A N ALA 287.A O no hydrogen 3.026 N/A VAL 292.A N LEU 288.A O no hydrogen 2.855 N/A ARG 293.A N ASP 289.A O no hydrogen 2.907 N/A ARG 293.A NE ASP 289.A OD1 no hydrogen 2.866 N/A ARG 293.A NH2 THR 9.A O no hydrogen 2.965 N/A ASP 294.A N VAL 290.A O no hydrogen 2.919 N/A GLY 295.A N VAL 292.A O no hydrogen 3.109 N/A ARG 296.A N ASP 294.A OD1 no hydrogen 3.369 N/A ARG 296.A NE ASP 294.A OD1 no hydrogen 2.959 N/A ARG 296.A NH2 ASP 294.A OD2 no hydrogen 2.750 N/A ILE 297.A N ALA 291.A O no hydrogen 3.120 N/A LYS 298.A N GLN 301.A OE1 no hydrogen 2.834 N/A LYS 298.A NZ ARG 296.A O no hydrogen 3.073 N/A ARG 299.A NH1 VAL 6.A O no hydrogen 2.922 N/A ARG 299.A NH1 TYR 321.A O no hydrogen 2.683 N/A ARG 299.A NH2 VAL 6.A O no hydrogen 3.077 N/A GLY 300.A N TYR 321.A OXT no hydrogen 2.913 N/A GLN 301.A N LYS 298.A O no hydrogen 3.009 N/A ASN 302.A N ASP 243.A OD2 no hydrogen 2.914 N/A ASN 302.A ND2 GLN 241.A O no hydrogen 2.992 N/A VAL 303.A N ILE 319.A O no hydrogen 2.730 N/A LEU 304.A N TRP 244.A O no hydrogen 2.866 N/A ILE 305.A N SER 317.A O no hydrogen 2.903 N/A GLU 306.A N ILE 246.A O no hydrogen 3.391 N/A GLY 307.A N GLY 315.A O no hydrogen 3.096 N/A GLY 309.A N THR 313.A O no hydrogen 2.847 N/A PHE 312.A N ASP 185.A O no hydrogen 2.883 N/A THR 313.A N GLY 309.A O no hydrogen 2.979 N/A THR 313.A OG1 ALA 114.A O no hydrogen 2.901 N/A THR 313.A OG1 SER 116.A OG no hydrogen 2.938 N/A THR 313.A OG1 GLY 310.A O no hydrogen 3.154 N/A TRP 314.A N HIS 183.A O no hydrogen 3.109 N/A GLY 315.A N GLY 307.A O no hydrogen 3.013 N/A ALA 316.A N ALA 181.A O no hydrogen 2.881 N/A SER 317.A N ILE 305.A O no hydrogen 2.811 N/A SER 317.A OG SER 180.A OG no hydrogen 2.501 N/A SER 317.A OG ALA 316.A O no hydrogen 3.269 N/A VAL 318.A N ALA 179.A O no hydrogen 2.956 N/A ILE 319.A N VAL 303.A O no hydrogen 2.838 N/A ARG 320.A N GLY 176.A O no hydrogen 2.760 N/A ARG 320.A NE ASN 302.A OD1 no hydrogen 3.140 N/A ARG 320.A NH2 ASN 302.A OD1 no hydrogen 3.331 N/A TYR 321.A N GLN 301.A O no hydrogen 2.878 N/A