Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4rii_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N HIS 29.A ND1 no hydrogen 2.950 N/A LYS 2.A N ASP 109.A OD2 no hydrogen 2.897 N/A ILE 3.A N ASP 30.A O no hydrogen 2.892 N/A LEU 4.A N LEU 110.A O no hydrogen 3.095 N/A PHE 5.A N PHE 32.A O no hydrogen 2.797 N/A VAL 6.A N VAL 112.A O no hydrogen 2.781 N/A ALA 7.A N GLY 34.A O no hydrogen 2.714 N/A ALA 8.A N THR 13.A OG1 no hydrogen 2.996 N/A THR 13.A N SER 10.A O no hydrogen 2.941 N/A THR 13.A OG1 SER 10.A O no hydrogen 2.680 N/A PHE 15.A N PRO 11.A O no hydrogen 2.978 N/A ALA 16.A N ALA 12.A O no hydrogen 2.937 N/A LEU 17.A N VAL 14.A O no hydrogen 3.183 N/A ALA 18.A N VAL 14.A O no hydrogen 2.966 N/A ALA 18.A N PHE 15.A O no hydrogen 3.379 N/A ALA 21.A N LEU 17.A O no hydrogen 3.032 N/A THR 22.A N ALA 18.A O no hydrogen 2.825 N/A THR 22.A OG1 ALA 18.A O no hydrogen 2.906 N/A THR 22.A OG1 PRO 19.A O no hydrogen 3.151 N/A ALA 23.A N PRO 19.A O no hydrogen 2.815 N/A ALA 24.A N LEU 20.A O no hydrogen 2.929 N/A ARG 25.A N ALA 21.A O no hydrogen 3.085 N/A ARG 25.A NH1 GLY 47.A O no hydrogen 3.114 N/A ARG 25.A NH2 ASN 26.A OD1 no hydrogen 3.146 N/A ASN 26.A N THR 22.A O no hydrogen 2.808 N/A ALA 27.A N ALA 23.A O no hydrogen 3.092 N/A ALA 27.A N ALA 24.A O no hydrogen 3.104 N/A GLY 28.A N ARG 25.A O no hydrogen 3.005 N/A HIS 29.A N ALA 24.A O no hydrogen 3.068 N/A HIS 29.A NE2 GLU 350.A OE2 no hydrogen 2.596 N/A ASP 30.A N MET 1.A O no hydrogen 2.877 N/A PHE 32.A N ILE 3.A O no hydrogen 3.134 N/A MET 33.A N PRO 49.A O no hydrogen 2.957 N/A GLY 34.A N PHE 5.A O no hydrogen 2.788 N/A ALA 35.A N VAL 51.A O no hydrogen 3.177 N/A VAL 36.A N ALA 8.A O no hydrogen 3.320 N/A GLU 37.A N THR 54.A O no hydrogen 2.928 N/A MET 39.A N VAL 36.A O no hydrogen 2.782 N/A VAL 40.A N GLU 37.A O no hydrogen 3.226 N/A ILE 43.A N MET 39.A O no hydrogen 3.239 N/A ALA 44.A N VAL 40.A O no hydrogen 3.001 N/A SER 45.A N PRO 41.A O no hydrogen 2.920 N/A SER 45.A OG PRO 41.A O no hydrogen 3.280 N/A ALA 46.A N ILE 43.A O no hydrogen 2.958 N/A GLY 47.A N ALA 44.A O no hydrogen 2.978 N/A ILE 48.A N ILE 43.A O no hydrogen 3.246 N/A VAL 51.A N MET 33.A O no hydrogen 2.937 N/A THR 53.A N ALA 35.A O no hydrogen 2.871 N/A LEU 56.A N THR 54.A OG1 no hydrogen 3.058 N/A HIS 60.A N PRO 57.A O no hydrogen 3.097 N/A PHE 61.A N ILE 58.A O no hydrogen 2.828 N/A ILE 62.A N ILE 58.A O no hydrogen 2.924 N/A THR 63.A N ARG 59.A O no hydrogen 2.888 N/A THR 63.A OG1 ARG 59.A O no hydrogen 2.783 N/A ASP 65.A N ASN 69.A O no hydrogen 2.930 N/A ARG 66.A NE GLU 151.A OE1 no hydrogen 2.953 N/A ARG 66.A NH1 GLU 155.A OE2 no hydrogen 2.934 N/A ARG 66.A NH2 GLU 151.A O no hydrogen 2.771 N/A ARG 66.A NH2 GLU 151.A OE1 no hydrogen 3.451 N/A ARG 66.A NH2 GLU 155.A OE1 no hydrogen 3.125 N/A ARG 66.A NH2 GLU 155.A OE2 no hydrogen 3.556 N/A GLU 67.A N ASP 65.A OD1 no hydrogen 3.104 N/A GLY 68.A N ASP 65.A O no hydrogen 2.977 N/A GLY 68.A N ASP 65.A OD1 no hydrogen 3.197 N/A ASN 69.A N ASP 65.A OD1 no hydrogen 3.084 N/A VAL 71.A N THR 63.A O no hydrogen 3.083 N/A GLU 75.A N GLU 79.A OE1 no hydrogen 2.655 N/A GLU 79.A N THR 76.A OG1 no hydrogen 3.064 N/A GLU 80.A N THR 76.A O no hydrogen 2.980 N/A LEU 81.A N PRO 77.A O no hydrogen 3.260 N/A PHE 83.A N GLU 79.A O no hydrogen 2.862 N/A ALA 84.A N GLU 80.A O no hydrogen 2.786 N/A GLY 85.A N LEU 81.A O no hydrogen 2.961 N/A HIS 86.A N ASP 82.A O no hydrogen 3.080 N/A HIS 86.A ND1 GLU 151.A OE2 no hydrogen 3.071 N/A TRP 87.A N PHE 83.A O no hydrogen 3.129 N/A PHE 88.A N ALA 84.A O no hydrogen 2.997 N/A GLY 89.A N GLY 85.A O no hydrogen 3.021 N/A ARG 90.A N HIS 86.A O no hydrogen 2.797 N/A ARG 90.A NE PHE 61.A O no hydrogen 2.786 N/A ARG 90.A NH2 PHE 61.A O no hydrogen 3.017 N/A ARG 90.A NH2 ILE 62.A O no hydrogen 3.547 N/A MET 91.A N TRP 87.A O no hydrogen 2.843 N/A ALA 92.A N PHE 88.A O no hydrogen 2.843 N/A ALA 93.A N GLY 89.A O no hydrogen 2.952 N/A GLY 94.A N ARG 90.A O no hydrogen 3.009 N/A SER 95.A N ALA 92.A O no hydrogen 2.978 N/A SER 95.A OG MET 91.A O no hydrogen 2.688 N/A MET 96.A N ALA 93.A O no hydrogen 3.483 N/A LEU 99.A N SER 95.A O no hydrogen 3.193 N/A ARG 100.A N MET 96.A O no hydrogen 2.886 N/A ARG 100.A NE GLU 126.A OE1 no hydrogen 2.762 N/A ARG 100.A NE GLU 126.A OE2 no hydrogen 3.203 N/A ARG 100.A NH2 GLU 126.A OE2 no hydrogen 2.813 N/A GLU 101.A N ASP 97.A O no hydrogen 3.153 N/A VAL 102.A N ALA 98.A O no hydrogen 3.017 N/A THR 103.A N LEU 99.A O no hydrogen 3.053 N/A THR 103.A OG1 LEU 99.A O no hydrogen 2.681 N/A THR 103.A OG1 ARG 100.A O no hydrogen 3.359 N/A ALA 104.A N ARG 100.A O no hydrogen 2.965 N/A ASN 105.A N VAL 102.A O no hydrogen 3.160 N/A ASN 105.A ND2 GLU 101.A O no hydrogen 3.441 N/A TRP 106.A N VAL 102.A O no hydrogen 2.855 N/A ARG 107.A NH2 LEU 127.A O no hydrogen 2.895 N/A ASP 109.A N LYS 2.A O no hydrogen 2.743 N/A VAL 111.A N PRO 130.A O no hydrogen 3.091 N/A VAL 112.A N LEU 4.A O no hydrogen 2.885 N/A GLY 113.A N VAL 132.A O no hydrogen 2.832 N/A GLY 114.A N VAL 6.A O no hydrogen 3.331 N/A GLY 114.A N SER 117.A OG no hydrogen 3.297 N/A SER 117.A N GLY 114.A O no hydrogen 3.257 N/A SER 117.A OG VAL 6.A O no hydrogen 2.754 N/A ALA 120.A N SER 117.A O no hydrogen 3.105 N/A LEU 122.A N PHE 118.A O no hydrogen 3.177 N/A ILE 123.A N ALA 119.A O no hydrogen 2.836 N/A ALA 124.A N ALA 120.A O no hydrogen 2.987 N/A ALA 125.A N ALA 121.A O no hydrogen 3.062 N/A GLU 126.A N LEU 122.A O no hydrogen 2.953 N/A LEU 127.A N ILE 123.A O no hydrogen 2.898 N/A GLY 128.A N ALA 124.A O no hydrogen 2.782 N/A VAL 129.A N ALA 124.A O no hydrogen 3.118 N/A VAL 132.A N VAL 111.A O no hydrogen 2.780 N/A ARG 133.A N LEU 169.A O no hydrogen 2.994 N/A ARG 133.A NE SER 115.A O no hydrogen 3.268 N/A ARG 133.A NH1 ASP 145.A OD2 no hydrogen 2.919 N/A ARG 133.A NH2 SER 115.A O no hydrogen 2.946 N/A ARG 133.A NH2 ASP 145.A OD1 no hydrogen 2.607 N/A ARG 133.A NH2 ASP 145.A OD2 no hydrogen 3.446 N/A GLN 134.A N GLY 113.A O no hydrogen 2.768 N/A GLN 134.A NE2 ALA 16.A O no hydrogen 3.131 N/A GLN 134.A NE2 ALA 135.A O no hydrogen 2.853 N/A ALA 135.A N VAL 171.A O no hydrogen 2.789 N/A TRP 136.A N SER 115.A OG no hydrogen 3.002 N/A GLY 139.A N ASP 137.A OD1 no hydrogen 2.821 N/A ARG 143.A N ASP 140.A O no hydrogen 3.295 N/A ARG 143.A NE ASN 287.A OD1 no hydrogen 3.269 N/A ARG 143.A NH1 ASP 140.A O no hydrogen 2.548 N/A ARG 143.A NH2 ASN 287.A OD1 no hydrogen 2.379 N/A ASP 145.A N TRP 142.A O no hydrogen 3.053 N/A ALA 148.A N THR 144.A O no hydrogen 3.058 N/A SER 149.A N ASP 145.A O no hydrogen 2.692 N/A SER 149.A OG ASP 145.A O no hydrogen 3.071 N/A ASP 150.A N PRO 146.A O no hydrogen 3.228 N/A GLU 151.A N ALA 147.A O no hydrogen 2.908 N/A LEU 152.A N ALA 148.A O no hydrogen 2.940 N/A ARG 153.A N ASP 150.A O no hydrogen 3.186 N/A ARG 153.A NH1 ASP 150.A OD1 no hydrogen 2.746 N/A LEU 156.A N LEU 152.A O no hydrogen 2.798 N/A ARG 157.A N ARG 153.A O no hydrogen 2.904 N/A ALA 158.A N PRO 154.A O no hydrogen 3.171 N/A LEU 159.A N LEU 156.A O no hydrogen 3.046 N/A GLY 160.A N ARG 157.A O no hydrogen 2.708 N/A LEU 161.A N LEU 156.A O no hydrogen 2.840 N/A LEU 164.A N SER 149.A OG no hydrogen 3.102 N/A ALA 168.A N TYR 131.A O no hydrogen 2.786 N/A VAL 171.A N ARG 133.A O no hydrogen 2.838 N/A ASP 172.A N GLN 187.A O no hydrogen 3.015 N/A CYS 174.A N ASP 172.A OD1 no hydrogen 3.020 N/A CYS 174.A SG THR 138.A O no hydrogen 3.671 N/A CYS 174.A SG PRO 175.A O no hydrogen 3.538 N/A SER 177.A N GLU 335.A OE1 no hydrogen 2.907 N/A SER 177.A OG GLU 335.A OE1 no hydrogen 3.345 N/A SER 177.A OG GLU 335.A OE2 no hydrogen 2.496 N/A LEU 178.A N PRO 175.A O no hydrogen 2.818 N/A ARG 179.A N PRO 176.A O no hydrogen 3.237 N/A ARG 179.A NE ASP 172.A OD2 no hydrogen 2.676 N/A ARG 179.A NH2 ASP 172.A OD2 no hydrogen 3.187 N/A ARG 179.A NH2 PRO 184.A O no hydrogen 2.894 N/A ALA 183.A N PRO 180.A O no hydrogen 3.153 N/A GLN 187.A N PHE 170.A O no hydrogen 2.787 N/A GLN 187.A NE2 MET 188.A O no hydrogen 2.933 N/A MET 189.A N ASP 172.A O no hydrogen 2.869 N/A ARG 190.A N PRO 340.A O no hydrogen 2.780 N/A ASN 195.A ND2 GLY 196.A O no hydrogen 3.145 N/A ASN 195.A ND2 ASP 251.A OD1 no hydrogen 2.799 N/A GLN 197.A NE2 ASN 195.A O no hydrogen 3.443 N/A GLN 197.A NE2 ASP 251.A OD1 no hydrogen 2.965 N/A GLN 197.A NE2 ASP 251.A OD2 no hydrogen 3.496 N/A ARG 198.A NE ASP 230.A OD2 no hydrogen 3.112 N/A ARG 198.A NH1 ASP 230.A OD2 no hydrogen 3.230 N/A ARG 198.A NH2 GLN 197.A O no hydrogen 3.099 N/A MET 204.A N GLU 201.A O no hydrogen 3.032 N/A TYR 205.A N PRO 202.A O no hydrogen 3.185 N/A THR 206.A OG1 PRO 202.A O no hydrogen 2.655 N/A ARG 210.A NE ASP 221.A OD2 no hydrogen 2.886 N/A ARG 210.A NH2 GLU 223.A OE2 no hydrogen 2.715 N/A ARG 212.A N ASP 258.A OD1 no hydrogen 3.046 N/A ARG 212.A NH1 TRP 203.A O no hydrogen 2.775 N/A ARG 212.A NH1 THR 256.A OG1 no hydrogen 2.753 N/A ARG 212.A NH2 TRP 203.A O no hydrogen 2.941 N/A ILE 213.A N GLU 223.A O no hydrogen 2.771 N/A LEU 214.A N VAL 259.A O no hydrogen 3.029 N/A VAL 215.A N VAL 225.A O no hydrogen 2.770 N/A THR 216.A N VAL 261.A O no hydrogen 3.003 N/A THR 216.A OG1 ALA 227.A O no hydrogen 2.787 N/A GLY 218.A N THR 216.A OG1 no hydrogen 3.211 N/A ALA 222.A N LEU 220.A O no hydrogen 2.828 N/A GLU 223.A N PRO 211.A O no hydrogen 2.882 N/A VAL 225.A N ILE 213.A O no hydrogen 2.900 N/A ILE 226.A N ARG 244.A O no hydrogen 2.769 N/A ALA 227.A N VAL 215.A O no hydrogen 2.702 N/A THR 228.A N GLY 246.A O no hydrogen 3.087 N/A ALA 233.A N LEU 229.A O no hydrogen 2.910 N/A GLU 234.A N ASP 230.A O no hydrogen 3.279 N/A LEU 236.A N VAL 232.A O no hydrogen 3.100 N/A ARG 237.A N ALA 233.A O no hydrogen 2.812 N/A THR 238.A OG1 GLU 234.A O no hydrogen 3.545 N/A LEU 240.A N LEU 236.A O no hydrogen 2.922 N/A GLY 246.A N ILE 226.A O no hydrogen 3.241 N/A TRP 247.A N ASP 230.A OD1 no hydrogen 2.912 N/A TRP 247.A NE1 GLY 196.A O no hydrogen 2.996 N/A ASP 251.A N ASN 195.A OD1 no hydrogen 3.100 N/A VAL 252.A N PRO 249.A O no hydrogen 3.050 N/A VAL 253.A N PRO 249.A O no hydrogen 3.171 N/A VAL 254.A N LEU 250.A O no hydrogen 3.034 N/A THR 256.A N VAL 253.A O no hydrogen 2.822 N/A THR 256.A OG1 VAL 253.A O no hydrogen 2.617 N/A CYS 257.A N VAL 254.A O no hydrogen 2.853 N/A CYS 257.A SG VAL 253.A O no hydrogen 3.480 N/A ASP 258.A N ARG 212.A O no hydrogen 2.887 N/A VAL 260.A N PRO 278.A O no hydrogen 3.127 N/A VAL 261.A N LEU 214.A O no hydrogen 2.682 N/A HIS 262.A N LEU 280.A O no hydrogen 2.909 N/A HIS 262.A NE2 GLN 279.A OE1 no hydrogen 2.704 N/A HIS 263.A N HIS 263.A ND1 no hydrogen 2.679 N/A ALA 269.A N GLY 265.A O no hydrogen 2.974 N/A LEU 270.A N GLY 266.A O no hydrogen 3.112 N/A THR 271.A N VAL 267.A O no hydrogen 2.927 N/A THR 271.A OG1 VAL 267.A O no hydrogen 2.809 N/A ALA 272.A N THR 268.A O no hydrogen 2.994 N/A MET 273.A N ALA 269.A O no hydrogen 3.005 N/A ASN 274.A N LEU 270.A O no hydrogen 2.828 N/A ALA 275.A N THR 271.A O no hydrogen 3.128 N/A ALA 275.A N ALA 272.A O no hydrogen 3.088 N/A GLY 276.A N MET 273.A O no hydrogen 2.945 N/A VAL 277.A N ALA 272.A O no hydrogen 2.952 N/A GLN 279.A N ALA 300.A O no hydrogen 3.404 N/A GLN 279.A NE2 ALA 269.A O no hydrogen 3.252 N/A LEU 280.A N VAL 260.A O no hydrogen 2.856 N/A ILE 281.A N ILE 302.A O no hydrogen 2.885 N/A VAL 282.A N HIS 262.A O no hydrogen 2.804 N/A GLN 284.A N HIS 263.A O no hydrogen 3.391 N/A ASN 287.A ND2 GLU 80.A OE1 no hydrogen 2.796 N/A GLY 292.A N PHE 288.A O no hydrogen 3.050 N/A LEU 293.A N VAL 289.A O no hydrogen 2.987 N/A ARG 294.A N GLU 290.A O no hydrogen 3.229 N/A ARG 294.A NH1 ASP 140.A OD1 no hydrogen 2.732 N/A ARG 294.A NH2 ASP 140.A OD1 no hydrogen 3.486 N/A ARG 294.A NH2 ASP 140.A OD2 no hydrogen 2.991 N/A ILE 295.A N ALA 291.A O no hydrogen 3.285 N/A SER 296.A N GLY 292.A O no hydrogen 3.032 N/A SER 296.A OG GLY 292.A O no hydrogen 2.890 N/A SER 296.A OG THR 303.A OG1 no hydrogen 2.646 N/A ASP 297.A N LEU 293.A O no hydrogen 2.781 N/A PHE 298.A N ARG 294.A O no hydrogen 2.865 N/A GLY 299.A N ILE 295.A O no hydrogen 3.195 N/A GLY 299.A N SER 296.A O no hydrogen 2.869 N/A ALA 300.A N ILE 295.A O no hydrogen 3.067 N/A ILE 302.A N GLN 279.A O no hydrogen 3.016 N/A THR 303.A OG1 SER 296.A OG no hydrogen 2.646 N/A VAL 304.A N ILE 281.A O no hydrogen 3.189 N/A ASN 307.A ND2 GLN 284.A OE1 no hydrogen 2.652 N/A VAL 312.A N THR 308.A O no hydrogen 3.117 N/A GLU 313.A N PRO 309.A O no hydrogen 3.153 N/A LYS 314.A N GLU 310.A O no hydrogen 3.376 N/A ALA 315.A N ALA 311.A O no hydrogen 3.351 N/A CYS 316.A N VAL 312.A O no hydrogen 2.957 N/A CYS 316.A SG VAL 312.A O no hydrogen 3.629 N/A GLY 317.A N GLU 313.A O no hydrogen 3.125 N/A GLU 318.A N LYS 314.A O no hydrogen 3.135 N/A LEU 319.A N ALA 315.A O no hydrogen 2.909 N/A ILE 320.A N CYS 316.A O no hydrogen 3.031 N/A GLY 321.A N GLY 317.A O no hydrogen 3.009 N/A ASN 322.A N GLU 318.A O no hydrogen 3.143 N/A SER 324.A N ASN 322.A OD1 no hydrogen 3.227 N/A SER 324.A OG ASN 322.A OD1 no hydrogen 3.051 N/A GLU 327.A N PRO 323.A O no hydrogen 3.176 N/A ARG 328.A N SER 324.A O no hydrogen 2.965 N/A ARG 328.A NE GLU 331.A OE2 no hydrogen 2.808 N/A ALA 329.A N TYR 325.A O no hydrogen 3.049 N/A ARG 330.A N ALA 326.A O no hydrogen 2.934 N/A GLU 331.A N GLU 327.A O no hydrogen 3.082 N/A LEU 332.A N ARG 328.A O no hydrogen 2.989 N/A SER 333.A N ALA 329.A O no hydrogen 2.984 N/A SER 333.A OG ASN 274.A O no hydrogen 2.809 N/A ALA 334.A N ARG 330.A O no hydrogen 2.949 N/A GLU 335.A N GLU 331.A O no hydrogen 3.043 N/A ILE 336.A N LEU 332.A O no hydrogen 2.968 N/A ALA 337.A N SER 333.A O no hydrogen 2.959 N/A ALA 338.A N ALA 334.A O no hydrogen 3.110 N/A ALA 338.A N GLU 335.A O no hydrogen 3.267 N/A LEU 339.A N ILE 336.A O no hydrogen 3.184 N/A VAL 345.A N LEU 341.A O no hydrogen 3.005 N/A VAL 346.A N PRO 342.A O no hydrogen 3.100 N/A GLY 347.A N GLU 344.A O no hydrogen 2.955 N/A ALA 348.A N VAL 345.A O no hydrogen 2.768 N/A LEU 349.A N VAL 345.A O no hydrogen 3.359 N/A GLU 350.A N VAL 346.A O no hydrogen 3.052 N/A GLY 351.A N GLY 347.A O no hydrogen 3.095 N/A LEU 352.A N LEU 349.A O no hydrogen 3.180 N/A VAL 353.A N GLU 350.A O no hydrogen 3.191 N/A