Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3wwi_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 8.A OG1 ILE 13.A O no hydrogen 2.828 N/A LEU 10.A N THR 8.A OG1 no hydrogen 3.054 N/A ILE 13.A N LEU 10.A O no hydrogen 3.332 N/A SER 16.A N GLU 112.A OE1 no hydrogen 2.925 N/A SER 16.A OG ASN 66.A OD1 no hydrogen 3.516 N/A SER 16.A OG GLU 112.A OE1 no hydrogen 3.480 N/A SER 16.A OG GLU 112.A OE2 no hydrogen 2.598 N/A ASP 21.A N GLU 109.A OE1 no hydrogen 3.010 N/A ALA 23.A N ASP 21.A OD1 no hydrogen 2.924 N/A ASN 24.A N ASP 21.A O no hydrogen 3.040 N/A ASN 24.A ND2 LYS 107.A O no hydrogen 2.818 N/A ASN 24.A ND2 GLU 109.A OE2 no hydrogen 2.710 N/A LEU 26.A N ASN 24.A OD1 no hydrogen 2.902 N/A ALA 27.A N ASN 24.A O no hydrogen 2.978 N/A GLY 28.A N THR 108.A O no hydrogen 2.843 N/A GLY 29.A N LEU 26.A O no hydrogen 3.080 N/A ALA 30.A N ALA 143.A O no hydrogen 3.016 N/A ALA 31.A N VAL 38.A O no hydrogen 2.923 N/A TRP 32.A N MET 141.A O no hydrogen 2.878 N/A ILE 33.A N ALA 36.A O no hydrogen 2.896 N/A ALA 36.A N ILE 33.A O no hydrogen 2.929 N/A VAL 38.A N ALA 31.A O no hydrogen 2.807 N/A GLU 42.A N PRO 39.A O no hydrogen 2.970 N/A ALA 43.A N PRO 40.A O no hydrogen 3.026 N/A PHE 48.A N SER 46.A OG no hydrogen 3.138 N/A ASP 49.A N SER 46.A O no hydrogen 3.058 N/A GLN 50.A N GLY 122.A O no hydrogen 3.044 N/A GLN 50.A NE2 GLY 122.A O no hydrogen 2.984 N/A GLN 50.A NE2 HIS 135.A ND1 no hydrogen 3.643 N/A GLY 51.A N ASP 49.A OD1 no hydrogen 2.837 N/A TYR 52.A N ASP 49.A O no hydrogen 2.842 N/A LEU 53.A N ASP 49.A O no hydrogen 3.056 N/A HIS 54.A N GLN 50.A O no hydrogen 3.071 N/A SER 55.A N TYR 52.A O no hydrogen 3.489 N/A ASP 56.A N GLN 50.A O no hydrogen 2.945 N/A THR 58.A N ILE 119.A O no hydrogen 3.178 N/A THR 58.A OG1 LYS 180.A O no hydrogen 2.614 N/A THR 60.A N VAL 117.A O no hydrogen 2.995 N/A THR 60.A OG1 HIS 75.A ND1 no hydrogen 2.729 N/A PHE 62.A N VAL 115.A O no hydrogen 3.055 N/A HIS 63.A NE2 ASN 310.A OD1 no hydrogen 2.533 N/A VAL 64.A N ALA 113.A O no hydrogen 2.891 N/A TRP 65.A N ASN 68.A O no hydrogen 2.854 N/A ASN 66.A N GLU 112.A OE2 no hydrogen 2.852 N/A GLY 67.A N ARG 111.A O no hydrogen 3.029 N/A ASN 68.A N TRP 65.A O no hydrogen 2.948 N/A ALA 69.A N THR 318.A O no hydrogen 2.693 N/A PHE 70.A N HIS 63.A O no hydrogen 3.116 N/A ARG 71.A N LEU 316.A O no hydrogen 2.777 N/A ARG 71.A NE ASP 74.A OD2 no hydrogen 3.006 N/A ARG 71.A NH1 THR 242.A OG1 no hydrogen 2.669 N/A ARG 71.A NH1 GLU 245.A OE1 no hydrogen 2.934 N/A ARG 71.A NH2 ASP 74.A OD2 no hydrogen 3.183 N/A ARG 71.A NH2 GLU 245.A OE1 no hydrogen 3.422 N/A ARG 71.A NH2 GLU 245.A OE2 no hydrogen 3.298 N/A HIS 75.A N ARG 71.A O no hydrogen 3.122 N/A HIS 75.A ND1 THR 60.A OG1 no hydrogen 2.729 N/A ILE 76.A N LEU 72.A O no hydrogen 2.953 N/A GLU 77.A N ASP 73.A O no hydrogen 2.931 N/A ARG 78.A N ASP 74.A O no hydrogen 2.865 N/A ARG 78.A NH1 PRO 236.A O no hydrogen 3.114 N/A ARG 78.A NH2 THR 60.A OG1 no hydrogen 2.805 N/A LEU 79.A N HIS 75.A O no hydrogen 2.823 N/A PHE 80.A N ILE 76.A O no hydrogen 2.914 N/A SER 81.A N GLU 77.A O no hydrogen 2.924 N/A ASN 82.A N ARG 78.A O no hydrogen 2.928 N/A ALA 83.A N LEU 79.A O no hydrogen 2.968 N/A GLU 84.A N PHE 80.A O no hydrogen 2.975 N/A SER 85.A N SER 81.A O no hydrogen 2.977 N/A SER 85.A OG SER 81.A O no hydrogen 3.292 N/A MET 86.A N ASN 82.A O no hydrogen 3.215 N/A MET 86.A N ALA 83.A O no hydrogen 3.178 N/A ARG 87.A N GLU 84.A O no hydrogen 2.952 N/A ILE 88.A N ALA 83.A O no hydrogen 2.900 N/A THR 93.A N GLU 96.A OE1 no hydrogen 2.764 N/A THR 93.A OG1 GLU 96.A OE1 no hydrogen 3.445 N/A GLN 94.A NE2 GLU 77.A OE1 no hydrogen 3.181 N/A GLU 96.A N THR 93.A OG1 no hydrogen 2.864 N/A VAL 97.A N THR 93.A O no hydrogen 2.972 N/A LYS 98.A N GLN 94.A O no hydrogen 3.003 N/A LYS 98.A NZ ASP 73.A OD1 no hydrogen 2.345 N/A GLU 99.A N ASP 95.A O no hydrogen 3.027 N/A ILE 100.A N GLU 96.A O no hydrogen 3.052 N/A ALA 101.A N VAL 97.A O no hydrogen 2.963 N/A LEU 102.A N LYS 98.A O no hydrogen 2.876 N/A GLU 103.A N GLU 99.A O no hydrogen 3.052 N/A LEU 104.A N ILE 100.A O no hydrogen 2.818 N/A VAL 105.A N ALA 101.A O no hydrogen 3.086 N/A ALA 106.A N LEU 102.A O no hydrogen 3.014 N/A LYS 107.A N GLU 103.A O no hydrogen 3.046 N/A LYS 107.A NZ GLU 103.A OE2 no hydrogen 3.396 N/A THR 108.A N LEU 104.A O no hydrogen 3.166 N/A THR 108.A OG1 VAL 105.A O no hydrogen 2.699 N/A GLU 109.A N VAL 105.A O no hydrogen 2.979 N/A GLU 109.A N ALA 106.A O no hydrogen 3.072 N/A LEU 110.A N THR 108.A OG1 no hydrogen 3.057 N/A ARG 111.A N TYR 18.A OH no hydrogen 3.134 N/A ARG 111.A NH1 GLU 109.A O no hydrogen 2.747 N/A ALA 113.A N VAL 64.A O no hydrogen 2.882 N/A PHE 114.A N VAL 144.A O no hydrogen 2.851 N/A VAL 115.A N PHE 62.A O no hydrogen 2.865 N/A SER 116.A N TYR 142.A O no hydrogen 2.840 N/A VAL 117.A N THR 60.A O no hydrogen 2.942 N/A SER 118.A N TYR 140.A O no hydrogen 2.858 N/A SER 118.A OG TYR 140.A O no hydrogen 3.290 N/A ILE 119.A N THR 58.A O no hydrogen 2.885 N/A THR 120.A N GLN 138.A O no hydrogen 2.835 N/A THR 120.A OG1 ASP 49.A OD1 no hydrogen 2.746 N/A THR 120.A OG1 ASP 49.A OD2 no hydrogen 3.083 N/A ARG 121.A N ASP 56.A O no hydrogen 3.110 N/A ARG 121.A NE ASP 56.A OD2 no hydrogen 2.486 N/A ARG 121.A NH1 MET 86.A O no hydrogen 3.244 N/A ARG 121.A NH2 ASP 56.A OD1 no hydrogen 2.849 N/A ARG 121.A NH2 ASP 56.A OD2 no hydrogen 3.318 N/A ARG 121.A NH2 MET 86.A O no hydrogen 2.951 N/A TYR 123.A OH GLU 34.A OE1 no hydrogen 2.774 N/A SER 125.A OG HIS 135.A ND1 no hydrogen 2.670 N/A PHE 128.A N THR 126.A OG1 no hydrogen 2.997 N/A GLU 129.A N THR 126.A O no hydrogen 3.264 N/A THR 133.A N ASP 131.A OD1 no hydrogen 3.094 N/A THR 133.A OG1 ASP 131.A OD1 no hydrogen 2.356 N/A LYS 134.A N ASP 131.A O no hydrogen 3.357 N/A HIS 135.A ND1 SER 125.A OG no hydrogen 2.670 N/A ARG 136.A NH1 THR 133.A O no hydrogen 2.619 N/A ARG 136.A NH1 HIS 135.A O no hydrogen 2.636 N/A GLN 138.A N THR 120.A O no hydrogen 2.986 N/A TYR 140.A N SER 118.A O no hydrogen 2.859 N/A TYR 140.A OH ASP 49.A OD2 no hydrogen 2.424 N/A MET 141.A N TRP 32.A O no hydrogen 2.877 N/A TYR 142.A N SER 116.A O no hydrogen 2.955 N/A ALA 143.A N ALA 30.A O no hydrogen 2.783 N/A VAL 144.A N PHE 114.A O no hydrogen 3.027 N/A TYR 146.A N GLU 112.A O no hydrogen 3.250 N/A TRP 148.A NE1 TYR 15.A OH no hydrogen 2.789 N/A ILE 149.A N ALA 276.A O no hydrogen 2.803 N/A ARG 154.A N PRO 151.A O no hydrogen 2.866 N/A ILE 155.A N PRO 151.A O no hydrogen 3.126 N/A ARG 156.A N PHE 152.A O no hydrogen 3.198 N/A ARG 156.A NE ASP 157.A OD1 no hydrogen 3.091 N/A ARG 156.A NH2 ASP 157.A OD2 no hydrogen 3.187 N/A ASP 157.A N ASP 153.A O no hydrogen 2.687 N/A GLY 158.A N ARG 154.A O no hydrogen 2.728 N/A VAL 159.A N PRO 281.A O no hydrogen 2.899 N/A HIS 160.A N GLU 200.A OE1 no hydrogen 2.975 N/A HIS 160.A ND1 SER 284.A OG no hydrogen 2.600 N/A ALA 161.A N SER 284.A O no hydrogen 3.077 N/A MET 162.A N ALA 201.A O no hydrogen 2.884 N/A VAL 163.A N ASP 286.A OD1 no hydrogen 3.013 N/A ALA 164.A N LEU 203.A O no hydrogen 2.913 N/A GLN 165.A N GLU 193.A OE2 no hydrogen 2.947 N/A SER 166.A N GLU 193.A OE1 no hydrogen 2.909 N/A SER 166.A OG GLU 193.A OE1 no hydrogen 2.570 N/A ARG 168.A NH1 VAL 167.A O no hydrogen 3.490 N/A ARG 169.A N LEU 205.A O no hydrogen 2.903 N/A ARG 169.A NE GLU 213.A OE2 no hydrogen 2.790 N/A ARG 169.A NH1 ASP 186.A OD2 no hydrogen 2.748 N/A ARG 169.A NH2 GLU 213.A OE2 no hydrogen 3.014 N/A THR 170.A N ASP 186.A OD2 no hydrogen 3.125 N/A SER 174.A N PRO 171.A O no hydrogen 2.901 N/A ILE 175.A N PRO 171.A O no hydrogen 3.047 N/A GLN 178.A N ASP 176.A OD1 no hydrogen 2.876 N/A GLN 178.A NE2 ARG 232.A O no hydrogen 2.868 N/A VAL 179.A N ASP 176.A O no hydrogen 3.076 N/A LYS 180.A NZ TYR 59.A OH no hydrogen 3.347 N/A ASN 181.A ND2 VAL 179.A O no hydrogen 2.947 N/A GLN 183.A N ASN 181.A OD1 no hydrogen 2.989 N/A TRP 184.A N PHE 182.A O no hydrogen 2.981 N/A ILE 188.A N TRP 184.A O no hydrogen 2.804 N/A ARG 189.A N GLY 185.A O no hydrogen 3.132 N/A ARG 189.A NH2 SER 166.A O no hydrogen 3.471 N/A ALA 190.A N ASP 186.A O no hydrogen 2.923 N/A VAL 191.A N LEU 187.A O no hydrogen 2.990 N/A GLN 192.A N ILE 188.A O no hydrogen 2.861 N/A GLU 193.A N ARG 189.A O no hydrogen 3.021 N/A THR 194.A N ALA 190.A O no hydrogen 3.102 N/A THR 194.A OG1 ALA 190.A O no hydrogen 3.224 N/A HIS 195.A N VAL 191.A O no hydrogen 3.123 N/A ASP 196.A N GLN 192.A O no hydrogen 3.141 N/A ARG 197.A N GLU 193.A O no hydrogen 3.101 N/A ARG 197.A NH1 VAL 163.A O no hydrogen 3.160 N/A ARG 197.A NH1 GLU 193.A OE2 no hydrogen 2.815 N/A GLY 198.A N THR 194.A O no hydrogen 2.963 N/A GLY 198.A N HIS 195.A O no hydrogen 3.301 N/A PHE 199.A N THR 194.A O no hydrogen 3.029 N/A GLU 200.A N HIS 160.A O no hydrogen 3.124 N/A LEU 203.A N MET 162.A O no hydrogen 2.761 N/A LEU 204.A N GLU 213.A O no hydrogen 2.881 N/A ASP 206.A N LEU 210.A O no hydrogen 2.717 N/A ASP 208.A N ASP 206.A OD1 no hydrogen 2.919 N/A GLY 209.A N ASP 206.A O no hydrogen 2.818 N/A LEU 210.A N ASP 206.A OD1 no hydrogen 2.877 N/A LEU 211.A N ILE 259.A O no hydrogen 2.951 N/A ALA 212.A N LEU 204.A O no hydrogen 3.017 N/A GLY 214.A N PHE 217.A O no hydrogen 2.835 N/A GLY 216.A N GLY 214.A O no hydrogen 2.964 N/A ASN 218.A N CYS 273.A O no hydrogen 2.840 N/A ASN 218.A ND2 LEU 235.A O no hydrogen 3.004 N/A VAL 220.A N LEU 271.A O no hydrogen 3.041 N/A VAL 221.A N ARG 228.A O no hydrogen 2.707 N/A ILE 222.A N GLU 269.A O no hydrogen 2.763 N/A LYS 223.A N VAL 226.A O no hydrogen 2.964 N/A LYS 223.A NZ ASP 266.A O no hydrogen 3.172 N/A LYS 223.A NZ ASP 266.A OD2 no hydrogen 3.028 N/A ASP 224.A N ASP 268.A OD2 no hydrogen 2.846 N/A VAL 226.A N LYS 223.A O no hydrogen 3.089 N/A VAL 227.A N GLU 253.A O no hydrogen 3.071 N/A ARG 228.A N VAL 221.A O no hydrogen 2.841 N/A ARG 228.A NH1 GLU 263.A OE1 no hydrogen 3.423 N/A ARG 228.A NH2 GLU 263.A OE1 no hydrogen 3.541 N/A SER 229.A N ILE 255.A O no hydrogen 3.078 N/A SER 229.A OG VAL 219.A O no hydrogen 2.529 N/A GLY 231.A N ALA 257.A O no hydrogen 3.224 N/A LEU 235.A N GLU 213.A OE1 no hydrogen 3.024 N/A GLY 237.A N LEU 235.A O no hydrogen 2.756 N/A LYS 241.A N GLY 237.A O no hydrogen 2.840 N/A LYS 241.A NZ ASP 74.A OD2 no hydrogen 3.303 N/A THR 242.A N ILE 238.A O no hydrogen 3.022 N/A THR 242.A OG1 ILE 238.A O no hydrogen 2.751 N/A VAL 243.A N THR 239.A O no hydrogen 2.833 N/A LEU 244.A N ARG 240.A O no hydrogen 2.988 N/A GLU 245.A N LYS 241.A O no hydrogen 3.073 N/A ILE 246.A N THR 242.A O no hydrogen 2.822 N/A ALA 247.A N VAL 243.A O no hydrogen 2.792 N/A GLU 248.A N LEU 244.A O no hydrogen 2.953 N/A SER 249.A N GLU 245.A O no hydrogen 2.977 N/A SER 249.A OG GLU 245.A O no hydrogen 3.272 N/A LEU 250.A N ILE 246.A O no hydrogen 3.086 N/A LEU 250.A N ALA 247.A O no hydrogen 3.221 N/A GLY 251.A N GLU 248.A O no hydrogen 2.797 N/A HIS 252.A N ALA 247.A O no hydrogen 3.136 N/A HIS 252.A ND1 GLY 225.A O no hydrogen 2.964 N/A ILE 255.A N VAL 227.A O no hydrogen 2.946 N/A ALA 257.A N SER 229.A O no hydrogen 2.929 N/A THR 260.A N GLU 263.A OE1 no hydrogen 3.120 N/A GLU 263.A N THR 260.A OG1 no hydrogen 2.958 N/A LEU 264.A N THR 260.A O no hydrogen 2.811 N/A LEU 265.A N LEU 261.A O no hydrogen 2.974 N/A ASP 266.A N ALA 262.A O no hydrogen 2.977 N/A ASP 266.A N GLU 263.A O no hydrogen 3.263 N/A ALA 267.A N LEU 264.A O no hydrogen 3.496 N/A ASP 268.A N ILE 222.A O no hydrogen 2.812 N/A GLU 269.A N ILE 222.A O no hydrogen 3.063 N/A LEU 271.A N VAL 220.A O no hydrogen 2.958 N/A GLY 272.A N TRP 280.A O no hydrogen 2.797 N/A CYS 273.A N ASN 218.A O no hydrogen 2.994 N/A THR 274.A N GLY 278.A O no hydrogen 2.999 N/A THR 274.A OG1 GLY 216.A O no hydrogen 2.713 N/A THR 275.A OG1 VAL 61.A O no hydrogen 3.361 N/A GLY 277.A N THR 275.A O no hydrogen 3.004 N/A GLY 278.A N THR 274.A O no hydrogen 2.913 N/A TRP 280.A N GLY 272.A O no hydrogen 2.930 N/A PHE 282.A N VAL 270.A O no hydrogen 2.909 N/A VAL 283.A N VAL 159.A O no hydrogen 2.869 N/A SER 284.A OG HIS 160.A ND1 no hydrogen 2.600 N/A VAL 285.A N ASN 288.A O no hydrogen 2.798 N/A ASP 286.A N ALA 161.A O no hydrogen 2.889 N/A ASN 288.A N VAL 285.A O no hydrogen 2.982 N/A ILE 290.A N VAL 283.A O no hydrogen 2.934 N/A SER 291.A OG ASP 268.A O no hydrogen 2.832 N/A GLY 293.A N ILE 290.A O no hydrogen 2.939 N/A VAL 294.A N ASP 292.A OD1 no hydrogen 3.452 N/A ILE 298.A N GLU 269.A OE2 no hydrogen 2.990 N/A THR 299.A N GLU 269.A OE1 no hydrogen 2.885 N/A THR 299.A OG1 GLU 269.A OE1 no hydrogen 2.455 N/A GLN 300.A N GLY 296.A O no hydrogen 3.043 N/A GLN 300.A NE2 PRO 295.A O no hydrogen 3.014 N/A GLN 300.A NE2 GLY 296.A O no hydrogen 3.602 N/A SER 301.A N PRO 297.A O no hydrogen 3.017 N/A SER 301.A OG PRO 297.A O no hydrogen 2.788 N/A ILE 302.A N ILE 298.A O no hydrogen 2.841 N/A ILE 303.A N THR 299.A O no hydrogen 2.905 N/A ARG 304.A N GLN 300.A O no hydrogen 3.030 N/A ARG 304.A NH1 ASP 11.A OD1 no hydrogen 2.630 N/A ARG 304.A NH2 ASP 11.A OD2 no hydrogen 3.405 N/A ARG 305.A N SER 301.A O no hydrogen 2.979 N/A ARG 305.A NH1 GLU 308.A OE1 no hydrogen 2.999 N/A ARG 305.A NH1 GLU 312.A OE1 no hydrogen 3.320 N/A TYR 306.A N ILE 302.A O no hydrogen 2.845 N/A TRP 307.A N ILE 303.A O no hydrogen 3.187 N/A GLU 308.A N ARG 304.A O no hydrogen 3.071 N/A LEU 309.A N ARG 305.A O no hydrogen 2.913 N/A ASN 310.A N TYR 306.A O no hydrogen 3.185 N/A ASN 310.A ND2 TYR 306.A O no hydrogen 2.740 N/A VAL 311.A N GLU 308.A O no hydrogen 3.035 N/A GLU 312.A N GLU 308.A O no hydrogen 2.855 N/A LEU 316.A N SER 314.A OG no hydrogen 3.202 N/A LEU 317.A N SER 314.A O no hydrogen 3.112 N/A THR 318.A N ALA 69.A O no hydrogen 2.986 N/A VAL 320.A N GLY 67.A O no hydrogen 2.938 N/A TYR 322.A OH LEU 110.A O no hydrogen 2.499 N/A