Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4rxa_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 3.A NZ LYS 46.A O no hydrogen 3.028 N/A LYS 3.A NZ ASN 48.A OD1 no hydrogen 3.051 N/A GLN 4.A N GLN 1.A O no hydrogen 3.100 N/A PHE 6.A N GLU 2.A O no hydrogen 3.133 N/A VAL 7.A N LYS 3.A O no hydrogen 2.874 N/A GLN 8.A N GLN 4.A O no hydrogen 2.783 N/A HIS 9.A N ASP 5.A O no hydrogen 3.332 N/A HIS 9.A N PHE 6.A O no hydrogen 3.237 N/A PHE 10.A N VAL 7.A O no hydrogen 3.215 N/A SER 11.A OG GLN 8.A O no hydrogen 3.549 N/A GLN 12.A NE2 TYR 134.A OH no hydrogen 2.992 N/A ILE 13.A N HIS 9.A O no hydrogen 3.014 N/A VAL 14.A N PHE 10.A O no hydrogen 2.753 N/A ARG 15.A N SER 11.A O no hydrogen 2.880 N/A VAL 16.A N GLN 12.A O no hydrogen 2.788 N/A LEU 17.A N ILE 13.A O no hydrogen 3.106 N/A LEU 17.A N VAL 14.A O no hydrogen 3.190 N/A THR 18.A N ARG 15.A O no hydrogen 3.008 N/A THR 18.A OG1 VAL 14.A O no hydrogen 2.702 N/A THR 18.A OG1 ARG 15.A O no hydrogen 3.211 N/A MET 22.A N GLU 19.A O no hydrogen 2.775 N/A HIS 24.A N GLU 21.A O no hydrogen 3.249 N/A ILE 27.A N HIS 24.A O no hydrogen 3.178 N/A GLY 28.A N PRO 25.A O no hydrogen 2.716 N/A ALA 30.A N ILE 27.A O no hydrogen 3.014 N/A ILE 31.A N ILE 27.A O no hydrogen 3.098 N/A ALA 32.A N GLY 28.A O no hydrogen 2.941 N/A ARG 33.A N ASP 29.A O no hydrogen 3.303 N/A ARG 33.A NE ASP 119.A OD2 no hydrogen 3.288 N/A ARG 33.A NH2 ASP 119.A OD2 no hydrogen 2.476 N/A LEU 34.A N ALA 30.A O no hydrogen 3.063 N/A LYS 35.A N ILE 31.A O no hydrogen 2.899 N/A GLU 36.A N ALA 32.A O no hydrogen 3.173 N/A VAL 37.A N ARG 33.A O no hydrogen 3.020 N/A LEU 38.A N LEU 34.A O no hydrogen 3.031 N/A GLU 39.A N LYS 35.A O no hydrogen 3.045 N/A TYR 40.A N GLU 36.A O no hydrogen 2.920 N/A TYR 40.A OH ILE 104.A O no hydrogen 2.398 N/A ASN 41.A N VAL 37.A O no hydrogen 2.905 N/A ASN 41.A ND2 VAL 37.A O no hydrogen 3.107 N/A ALA 42.A N LEU 38.A O no hydrogen 2.851 N/A GLY 44.A N TYR 47.A OH no hydrogen 2.988 N/A ARG 49.A NE SER 192.A OG no hydrogen 2.998 N/A ARG 49.A NH2 SER 192.A OG no hydrogen 3.268 N/A GLY 50.A N GLU 81.A OE1 no hydrogen 2.985 N/A LEU 51.A N TYR 47.A O no hydrogen 2.925 N/A THR 52.A N ASN 48.A O no hydrogen 2.946 N/A THR 52.A N ARG 49.A O no hydrogen 3.223 N/A THR 52.A OG1 ASN 48.A O no hydrogen 2.574 N/A VAL 53.A N GLY 50.A O no hydrogen 3.159 N/A VAL 54.A N LEU 51.A O no hydrogen 3.010 N/A VAL 55.A N LEU 51.A O no hydrogen 3.096 N/A ALA 56.A N THR 52.A O no hydrogen 2.928 N/A PHE 57.A N VAL 53.A O no hydrogen 3.096 N/A ARG 58.A N VAL 54.A O no hydrogen 2.964 N/A ARG 58.A N VAL 55.A O no hydrogen 3.145 N/A ARG 58.A NH1 GLU 2.A OE2 no hydrogen 3.211 N/A GLU 59.A N VAL 55.A O no hydrogen 2.883 N/A LEU 60.A N PHE 57.A O no hydrogen 3.204 N/A VAL 61.A N PHE 57.A O no hydrogen 3.216 N/A GLN 65.A NE2 ARG 58.A O no hydrogen 3.605 N/A SER 69.A N ASP 66.A OD1 no hydrogen 2.906 N/A LEU 70.A N ASP 66.A O no hydrogen 3.192 N/A GLN 71.A N ALA 67.A O no hydrogen 3.107 N/A ARG 72.A N ASP 68.A O no hydrogen 3.055 N/A ALA 73.A N SER 69.A O no hydrogen 3.013 N/A TRP 74.A N LEU 70.A O no hydrogen 2.929 N/A THR 75.A N GLN 71.A O no hydrogen 2.907 N/A THR 75.A OG1 GLN 71.A O no hydrogen 3.076 N/A VAL 76.A N ARG 72.A O no hydrogen 2.952 N/A GLY 77.A N ALA 73.A O no hydrogen 2.884 N/A TRP 78.A N TRP 74.A O no hydrogen 2.961 N/A TRP 78.A NE1 PHE 6.A O no hydrogen 2.843 N/A CYS 79.A N THR 75.A O no hydrogen 2.899 N/A CYS 79.A SG THR 75.A O no hydrogen 3.417 N/A CYS 79.A SG ILE 127.A O no hydrogen 3.566 N/A VAL 80.A N VAL 76.A O no hydrogen 3.121 N/A GLU 81.A N GLY 77.A O no hydrogen 3.202 N/A LEU 82.A N TRP 78.A O no hydrogen 2.821 N/A LEU 83.A N CYS 79.A O no hydrogen 2.936 N/A GLN 84.A N VAL 80.A O no hydrogen 2.899 N/A GLN 84.A NE2 TYR 191.A OH no hydrogen 3.446 N/A ALA 85.A N GLU 81.A O no hydrogen 2.920 N/A PHE 86.A N LEU 82.A O no hydrogen 2.911 N/A PHE 87.A N LEU 83.A O no hydrogen 3.068 N/A LEU 88.A N GLN 84.A O no hydrogen 2.867 N/A VAL 89.A N ALA 85.A O no hydrogen 2.935 N/A ALA 90.A N PHE 86.A O no hydrogen 3.255 N/A ASP 91.A N PHE 87.A O no hydrogen 2.677 N/A ASP 92.A N LEU 88.A O no hydrogen 2.942 N/A MET 94.A N ALA 90.A O no hydrogen 3.037 N/A ASP 95.A N ASP 91.A O no hydrogen 2.950 N/A SER 96.A N ILE 93.A O no hydrogen 3.008 N/A SER 97.A N ASP 92.A O no hydrogen 2.979 N/A SER 97.A OG ASP 95.A OD1 no hydrogen 2.422 N/A ARG 100.A N GLN 103.A O no hydrogen 2.638 N/A ARG 100.A NE ASP 92.A OD2 no hydrogen 3.093 N/A ARG 100.A NH2 ASP 92.A OD1 no hydrogen 2.775 N/A GLN 103.A N ARG 100.A O no hydrogen 2.800 N/A CYS 105.A N LEU 98.A O no hydrogen 3.091 N/A TRP 106.A NE1 ASP 119.A OD2 no hydrogen 2.638 N/A TYR 107.A OH SER 97.A O no hydrogen 2.752 N/A GLN 108.A N CYS 105.A O no hydrogen 2.831 N/A GLN 108.A NE2 SER 97.A O no hydrogen 3.395 N/A LYS 109.A N TRP 106.A O no hydrogen 3.179 N/A VAL 112.A N LYS 109.A O no hydrogen 2.973 N/A ASP 115.A N VAL 112.A O no hydrogen 3.107 N/A ALA 116.A N GLY 113.A O no hydrogen 2.989 N/A ILE 117.A N LEU 114.A O no hydrogen 2.967 N/A ASP 119.A N ASP 115.A O no hydrogen 3.181 N/A ALA 120.A N ALA 116.A O no hydrogen 2.799 N/A ASN 121.A N ILE 117.A O no hydrogen 3.175 N/A LEU 122.A N ASN 118.A O no hydrogen 2.941 N/A LEU 123.A N ASP 119.A O no hydrogen 3.147 N/A GLU 124.A N ALA 120.A O no hydrogen 3.181 N/A ALA 125.A N ASN 121.A O no hydrogen 2.980 N/A CYS 126.A N LEU 122.A O no hydrogen 2.953 N/A CYS 126.A SG LEU 122.A O no hydrogen 3.218 N/A ILE 127.A N GLU 124.A O no hydrogen 3.062 N/A TYR 128.A N ALA 125.A O no hydrogen 3.200 N/A ARG 129.A N ALA 125.A O no hydrogen 3.255 N/A ARG 129.A NH2 LEU 17.A O no hydrogen 2.702 N/A LEU 130.A N CYS 126.A O no hydrogen 3.066 N/A LEU 131.A N ILE 127.A O no hydrogen 3.108 N/A LYS 132.A N TYR 128.A O no hydrogen 3.021 N/A LEU 133.A N ARG 129.A O no hydrogen 2.890 N/A TYR 134.A N LEU 130.A O no hydrogen 2.855 N/A CYS 135.A N LEU 131.A O no hydrogen 2.650 N/A GLN 138.A N CYS 135.A O no hydrogen 2.735 N/A TYR 141.A N GLN 138.A O no hydrogen 3.260 N/A LEU 144.A N TYR 140.A O no hydrogen 2.970 N/A ILE 145.A N TYR 141.A O no hydrogen 3.035 N/A GLU 146.A N LEU 142.A O no hydrogen 2.930 N/A LEU 147.A N ASN 143.A O no hydrogen 2.834 N/A PHE 148.A N LEU 144.A O no hydrogen 2.913 N/A LEU 149.A N ILE 145.A O no hydrogen 2.977 N/A GLN 150.A N GLU 146.A O no hydrogen 2.781 N/A SER 151.A N LEU 147.A O no hydrogen 2.965 N/A SER 151.A OG LEU 147.A O no hydrogen 2.862 N/A SER 152.A N PHE 148.A O no hydrogen 3.053 N/A SER 152.A OG PHE 148.A O no hydrogen 2.881 N/A TYR 153.A N LEU 149.A O no hydrogen 3.039 N/A GLN 154.A N GLN 150.A O no hydrogen 2.884 N/A THR 155.A N SER 151.A O no hydrogen 3.003 N/A THR 155.A OG1 SER 151.A O no hydrogen 2.817 N/A GLU 156.A N SER 152.A O no hydrogen 2.890 N/A ILE 157.A N TYR 153.A O no hydrogen 2.903 N/A GLY 158.A N GLN 154.A O no hydrogen 2.862 N/A GLN 159.A N THR 155.A O no hydrogen 2.870 N/A THR 160.A N GLU 156.A O no hydrogen 2.981 N/A THR 160.A OG1 GLU 156.A O no hydrogen 2.822 N/A LEU 161.A N ILE 157.A O no hydrogen 2.962 N/A ASP 162.A N GLY 158.A O no hydrogen 2.887 N/A LEU 163.A N GLN 159.A O no hydrogen 2.846 N/A LEU 164.A N THR 160.A O no hydrogen 2.949 N/A THR 165.A N ASP 162.A O no hydrogen 3.035 N/A THR 165.A OG1 LEU 161.A O no hydrogen 2.398 N/A ALA 166.A N ASP 162.A O no hydrogen 2.893 N/A PHE 175.A N LEU 172.A O no hydrogen 2.931 N/A THR 176.A N ARG 174.A O no hydrogen 2.807 N/A ARG 179.A N THR 176.A OG1 no hydrogen 3.228 N/A ARG 179.A NH1 THR 165.A OG1 no hydrogen 2.650 N/A TYR 180.A N THR 176.A O no hydrogen 2.852 N/A TYR 180.A OH ASP 231.A OD2 no hydrogen 2.666 N/A LYS 181.A N GLU 177.A O no hydrogen 2.929 N/A LYS 181.A NZ GLU 224.A OE1 no hydrogen 3.146 N/A LYS 181.A NZ GLU 224.A OE2 no hydrogen 3.552 N/A SER 182.A N LYS 178.A O no hydrogen 3.065 N/A ILE 183.A N ARG 179.A O no hydrogen 2.916 N/A VAL 184.A N TYR 180.A O no hydrogen 3.029 N/A LYS 185.A N LYS 181.A O no hydrogen 2.916 N/A TYR 186.A N SER 182.A O no hydrogen 3.268 N/A LYS 187.A N ILE 183.A O no hydrogen 2.868 N/A LYS 187.A NZ GLN 159.A OE1 no hydrogen 3.333 N/A THR 188.A N VAL 184.A O no hydrogen 3.027 N/A THR 188.A OG1 GLN 227.A OE1 no hydrogen 3.476 N/A ALA 189.A N VAL 184.A O no hydrogen 2.909 N/A PHE 190.A N LYS 185.A O no hydrogen 3.169 N/A SER 192.A N THR 188.A O no hydrogen 3.024 N/A SER 192.A OG THR 188.A O no hydrogen 2.673 N/A PHE 193.A N ALA 189.A O no hydrogen 3.061 N/A TYR 194.A N ALA 189.A O no hydrogen 3.415 N/A TYR 194.A OH HIS 212.A ND1 no hydrogen 3.063 N/A LEU 195.A N PHE 190.A O no hydrogen 2.869 N/A ALA 198.A N TYR 194.A O no hydrogen 2.901 N/A ALA 199.A N LEU 195.A O no hydrogen 3.024 N/A ALA 200.A N PRO 196.A O no hydrogen 3.221 N/A MET 201.A N ILE 197.A O no hydrogen 2.724 N/A TYR 202.A N ALA 198.A O no hydrogen 2.875 N/A MET 203.A N ALA 199.A O no hydrogen 2.871 N/A ALA 204.A N ALA 200.A O no hydrogen 3.049 N/A ALA 204.A N MET 201.A O no hydrogen 3.001 N/A GLY 205.A N TYR 202.A O no hydrogen 3.025 N/A ILE 206.A N MET 201.A O no hydrogen 3.031 N/A HIS 212.A N GLY 208.A O no hydrogen 3.084 N/A HIS 212.A ND1 TYR 194.A OH no hydrogen 3.063 N/A HIS 212.A NE2 ILE 206.A O no hydrogen 2.926 N/A ALA 213.A N GLU 209.A O no hydrogen 3.026 N/A ASN 214.A N LYS 210.A O no hydrogen 3.020 N/A ALA 215.A N GLU 211.A O no hydrogen 2.857 N/A LYS 216.A N HIS 212.A O no hydrogen 2.921 N/A LYS 217.A N ALA 213.A O no hydrogen 3.048 N/A ILE 218.A N ASN 214.A O no hydrogen 3.381 N/A LEU 219.A N ALA 215.A O no hydrogen 2.983 N/A LEU 220.A N LYS 216.A O no hydrogen 2.919 N/A MET 222.A N ILE 218.A O no hydrogen 3.071 N/A GLY 223.A N LEU 219.A O no hydrogen 2.922 N/A GLU 224.A N LEU 220.A O no hydrogen 3.002 N/A PHE 225.A N GLU 221.A O no hydrogen 3.119 N/A PHE 226.A N MET 222.A O no hydrogen 2.942 N/A GLN 227.A N GLY 223.A O no hydrogen 3.144 N/A GLN 227.A NE2 GLN 227.A O no hydrogen 3.249 N/A GLN 227.A NE2 ASP 231.A OD1 no hydrogen 3.088 N/A ILE 228.A N GLU 224.A O no hydrogen 3.145 N/A GLN 229.A N PHE 225.A O no hydrogen 2.771 N/A GLN 229.A NE2 ILE 328.A O no hydrogen 2.869 N/A ASP 230.A N PHE 226.A O no hydrogen 2.953 N/A ASP 231.A N GLN 227.A O no hydrogen 2.818 N/A TYR 232.A N ILE 228.A O no hydrogen 2.952 N/A LEU 233.A N GLN 229.A O no hydrogen 2.754 N/A ASP 234.A N ASP 230.A O no hydrogen 2.863 N/A PHE 236.A N TYR 232.A O no hydrogen 2.909 N/A GLY 237.A N LEU 233.A O no hydrogen 2.799 N/A SER 240.A N ASP 238.A OD1 no hydrogen 3.359 N/A VAL 241.A N ASP 238.A O no hydrogen 2.668 N/A THR 242.A N ASP 238.A O no hydrogen 2.742 N/A THR 242.A OG1 ASP 238.A O no hydrogen 3.094 N/A THR 242.A OG1 LYS 244.A O no hydrogen 2.954 N/A GLY 243.A N PRO 239.A O no hydrogen 3.190 N/A THR 247.A OG1 ASP 251.A OD2 no hydrogen 2.404 N/A ASP 248.A N ASP 234.A OD2 no hydrogen 3.198 N/A ASP 251.A N THR 247.A O no hydrogen 3.124 N/A ASP 251.A N ASP 248.A O no hydrogen 3.056 N/A ASN 252.A N ILE 249.A O no hydrogen 3.192 N/A ASN 252.A ND2 PRO 167.A O no hydrogen 3.580 N/A ASN 252.A ND2 ASN 169.A O no hydrogen 2.953 N/A LYS 253.A N ASP 248.A O no hydrogen 3.235 N/A SER 255.A OG ASP 248.A OD2 no hydrogen 3.547 N/A TRP 256.A N ASP 231.A OD2 no hydrogen 2.895 N/A VAL 259.A N SER 255.A O no hydrogen 3.157 N/A GLN 260.A N TRP 256.A O no hydrogen 2.945 N/A CYS 261.A N LEU 257.A O no hydrogen 2.864 N/A LEU 262.A N VAL 258.A O no hydrogen 2.974 N/A GLN 263.A N VAL 259.A O no hydrogen 3.366 N/A ARG 264.A N CYS 261.A O no hydrogen 3.131 N/A THR 266.A N GLN 269.A OE1 no hydrogen 3.148 N/A THR 266.A OG1 GLU 268.A OE1 no hydrogen 3.501 N/A TYR 270.A N THR 266.A O no hydrogen 2.814 N/A GLN 271.A N PRO 267.A O no hydrogen 3.314 N/A TYR 276.A OH LYS 253.A O no hydrogen 2.995 N/A TYR 285.A N VAL 281.A O no hydrogen 2.977 N/A GLU 286.A N LYS 282.A O no hydrogen 3.245 N/A GLU 287.A N ALA 283.A O no hydrogen 3.042 N/A LEU 288.A N LEU 284.A O no hydrogen 3.081 N/A LEU 288.A N TYR 285.A O no hydrogen 3.277 N/A ASP 289.A N GLU 286.A O no hydrogen 2.977 N/A LEU 290.A N TYR 285.A O no hydrogen 3.119 N/A ALA 292.A N ASP 289.A O no hydrogen 3.225 N/A VAL 293.A N ASP 289.A O no hydrogen 3.080 N/A PHE 294.A N LEU 290.A O no hydrogen 2.733 N/A LEU 295.A N PRO 291.A O no hydrogen 3.092 N/A GLN 296.A N ALA 292.A O no hydrogen 2.816 N/A GLN 296.A NE2 ASP 300.A OD1 no hydrogen 3.208 N/A TYR 297.A N VAL 293.A O no hydrogen 2.836 N/A GLU 298.A N PHE 294.A O no hydrogen 2.785 N/A GLU 299.A N LEU 295.A O no hydrogen 3.190 N/A ASP 300.A N GLN 296.A O no hydrogen 3.024 N/A SER 301.A N TYR 297.A O no hydrogen 2.735 N/A SER 301.A OG TYR 329.A OH no hydrogen 2.720 N/A TYR 302.A N GLU 298.A O no hydrogen 2.934 N/A SER 303.A N GLU 299.A O no hydrogen 3.127 N/A HIS 304.A N ASP 300.A O no hydrogen 2.861 N/A ILE 305.A N SER 301.A O no hydrogen 2.895 N/A MET 306.A N TYR 302.A O no hydrogen 3.019 N/A ALA 307.A N SER 303.A O no hydrogen 3.238 N/A LEU 308.A N HIS 304.A O no hydrogen 3.027 N/A ILE 309.A N ILE 305.A O no hydrogen 2.952 N/A GLU 310.A N MET 306.A O no hydrogen 2.903 N/A GLN 311.A N ALA 307.A O no hydrogen 2.818 N/A TYR 312.A N LEU 308.A O no hydrogen 2.762 N/A ALA 313.A N ILE 309.A O no hydrogen 2.989 N/A LEU 316.A N ALA 313.A O no hydrogen 2.773 N/A VAL 320.A N PRO 317.A O no hydrogen 3.092 N/A PHE 321.A N PRO 318.A O no hydrogen 2.819 N/A LEU 322.A N PRO 318.A O no hydrogen 2.881 N/A GLY 323.A N ALA 319.A O no hydrogen 2.857 N/A ALA 325.A N PHE 321.A O no hydrogen 3.045 N/A ARG 326.A N LEU 322.A O no hydrogen 2.932 N/A LYS 327.A N GLY 323.A O no hydrogen 3.291 N/A ILE 328.A N LEU 324.A O no hydrogen 2.965 N/A TYR 329.A N ALA 325.A O no hydrogen 2.963 N/A TYR 329.A OH SER 301.A OG no hydrogen 2.720 N/A