Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1wls_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 1.A N ASP 72.A OD2 no hydrogen 2.354 N/A ARG 1.A NE GLU 70.A O no hydrogen 2.560 N/A ARG 1.A NH2 GLU 70.A O no hydrogen 3.359 N/A ILE 2.A N LYS 39.A O no hydrogen 2.725 N/A LEU 3.A N GLY 73.A O no hydrogen 3.151 N/A ILE 4.A N GLU 41.A O no hydrogen 2.908 N/A LEU 5.A N VAL 75.A O no hydrogen 2.867 N/A GLY 6.A N ARG 43.A O no hydrogen 2.963 N/A GLY 8.A N VAL 47.A O no hydrogen 3.111 N/A ALA 11.A N GLY 8.A O no hydrogen 2.582 N/A SER 12.A N THR 9.A O no hydrogen 3.011 N/A SER 12.A OG THR 9.A O no hydrogen 2.771 N/A VAL 13.A N GLU 20.A O no hydrogen 3.386 N/A GLY 15.A N VAL 13.A O no hydrogen 2.540 N/A SER 21.A OG ASN 46.A OD1 no hydrogen 2.651 N/A ALA 22.A N ALA 11.A O no hydrogen 2.614 N/A LEU 23.A N ALA 11.A O no hydrogen 2.840 N/A SER 24.A OG ASP 44.A OD1 no hydrogen 3.404 N/A SER 26.A N SER 24.A OG no hydrogen 3.291 N/A ILE 28.A N SER 24.A O no hydrogen 3.128 N/A LEU 29.A N VAL 25.A O no hydrogen 2.846 N/A LYS 30.A N SER 26.A O no hydrogen 3.021 N/A LEU 31.A N LYS 27.A O no hydrogen 2.958 N/A ILE 34.A N ALA 32.A O no hydrogen 2.680 N/A SER 36.A N GLY 33.A O no hydrogen 2.832 N/A SER 36.A OG GLY 33.A O no hydrogen 2.412 N/A ARG 43.A N ILE 4.A O no hydrogen 2.977 N/A ARG 43.A NH2 GLU 41.A OE1 no hydrogen 3.399 N/A LEU 45.A N GLY 6.A O no hydrogen 3.081 N/A ASN 46.A ND2 LEU 23.A O no hydrogen 2.893 N/A SER 49.A OG GLY 79.A O no hydrogen 3.483 N/A SER 49.A OG THR 82.A OG1 no hydrogen 2.670 N/A THR 50.A N ASP 48.A OD1 no hydrogen 2.667 N/A LEU 51.A N ASP 48.A O no hydrogen 2.899 N/A ILE 52.A N SER 49.A O no hydrogen 2.865 N/A GLN 53.A N ASP 56.A OD1 no hydrogen 3.075 N/A ASP 56.A N GLN 53.A O no hydrogen 3.046 N/A TRP 57.A N PRO 54.A O no hydrogen 2.931 N/A TRP 57.A NE1 SER 85.A OG no hydrogen 2.924 N/A ARG 59.A N SER 55.A O no hydrogen 2.843 N/A ARG 59.A NH1 ARG 59.A O no hydrogen 3.434 N/A LEU 60.A N ASP 56.A O no hydrogen 2.836 N/A ALA 61.A N TRP 57.A O no hydrogen 2.946 N/A LYS 62.A N GLU 58.A O no hydrogen 2.983 N/A LYS 62.A NZ GLU 58.A OE1 no hydrogen 3.206 N/A GLU 63.A N ARG 59.A O no hydrogen 3.266 N/A ILE 64.A N LEU 60.A O no hydrogen 3.084 N/A GLU 65.A N ALA 61.A O no hydrogen 2.997 N/A LYS 66.A N LYS 62.A O no hydrogen 3.023 N/A GLU 67.A N GLU 63.A O no hydrogen 3.342 N/A GLU 67.A N ILE 64.A O no hydrogen 2.880 N/A VAL 68.A N GLU 65.A O no hydrogen 3.484 N/A TYR 71.A N GLU 67.A O no hydrogen 3.386 N/A TYR 71.A OH GLU 41.A OE2 no hydrogen 2.526 N/A ASP 72.A N ARG 1.A O no hydrogen 2.707 N/A ILE 74.A N PRO 97.A O no hydrogen 2.958 N/A VAL 75.A N LEU 3.A O no hydrogen 2.900 N/A ILE 76.A N VAL 99.A O no hydrogen 2.774 N/A THR 77.A N LEU 5.A O no hydrogen 2.770 N/A HIS 78.A N THR 101.A O no hydrogen 2.899 N/A HIS 78.A ND1 GLY 79.A O no hydrogen 2.776 N/A HIS 78.A NE2 SER 85.A OG no hydrogen 2.638 N/A THR 82.A N SER 49.A OG no hydrogen 2.820 N/A THR 82.A OG1 SER 49.A O no hydrogen 3.330 N/A THR 82.A OG1 SER 49.A OG no hydrogen 2.670 N/A SER 85.A N THR 82.A O no hydrogen 3.060 N/A SER 85.A OG HIS 78.A NE2 no hydrogen 2.638 N/A SER 87.A N ALA 83.A O no hydrogen 3.117 N/A SER 87.A OG ALA 83.A O no hydrogen 2.716 N/A SER 89.A N ALA 86.A O no hydrogen 3.044 N/A SER 89.A OG ALA 86.A O no hydrogen 2.679 N/A PHE 90.A N SER 87.A O no hydrogen 3.218 N/A ARG 92.A N PHE 184.A O no hydrogen 2.823 N/A ARG 92.A NH2 PHE 90.A O no hydrogen 3.103 N/A ASN 93.A ND2 GLU 182.A O no hydrogen 2.580 N/A ILE 98.A N GLY 130.A O no hydrogen 2.824 N/A VAL 99.A N ILE 74.A O no hydrogen 2.810 N/A LEU 100.A N TYR 132.A O no hydrogen 2.824 N/A THR 101.A N ILE 76.A O no hydrogen 2.880 N/A THR 101.A OG1 ALA 134.A O no hydrogen 3.097 N/A SER 103.A OG LEU 104.A O no hydrogen 2.778 N/A GLU 108.A N PRO 105.A O no hydrogen 2.931 N/A SER 111.A OG LEU 104.A O no hydrogen 3.280 N/A SER 111.A OG PRO 105.A O no hydrogen 3.484 N/A ASP 112.A N ASP 112.A OD2 no hydrogen 2.473 N/A ALA 113.A N SER 111.A OG no hydrogen 3.096 N/A ASN 116.A N ASP 112.A O no hydrogen 2.956 N/A ASN 116.A ND2 GLY 102.A O no hydrogen 2.936 N/A LEU 117.A N ALA 113.A O no hydrogen 2.877 N/A ARG 118.A N PRO 114.A O no hydrogen 2.775 N/A THR 119.A N PHE 115.A O no hydrogen 2.889 N/A THR 119.A OG1 PHE 115.A O no hydrogen 2.637 N/A ALA 120.A N ASN 116.A O no hydrogen 2.921 N/A LEU 121.A N LEU 117.A O no hydrogen 2.892 N/A GLU 122.A N ARG 118.A O no hydrogen 2.956 N/A PHE 123.A N THR 119.A O no hydrogen 2.975 N/A VAL 124.A N ALA 120.A O no hydrogen 3.349 N/A LEU 126.A N PHE 123.A O no hydrogen 2.906 N/A GLY 127.A N VAL 124.A O no hydrogen 3.312 N/A ARG 129.A NH1 PRO 94.A O no hydrogen 3.529 N/A ARG 129.A NH1 GLY 180.A O no hydrogen 2.912 N/A ARG 129.A NH2 GLY 180.A O no hydrogen 2.955 N/A TYR 132.A N ILE 98.A O no hydrogen 2.872 N/A TYR 132.A OH ARG 129.A O no hydrogen 2.385 N/A ALA 134.A N LEU 100.A O no hydrogen 3.110 N/A PHE 135.A N LYS 138.A O no hydrogen 2.852 N/A ASN 136.A N ASN 116.A OD1 no hydrogen 3.078 N/A LYS 138.A N PHE 135.A O no hydrogen 2.905 N/A LYS 138.A NZ PHE 154.A O no hydrogen 2.862 N/A VAL 139.A N ALA 163.A O no hydrogen 2.912 N/A GLY 141.A N ILE 131.A O no hydrogen 2.721 N/A ARG 143.A N LEU 140.A O no hydrogen 3.119 N/A ARG 143.A NE GLY 310.A O no hydrogen 2.777 N/A ARG 143.A NH1 GLY 310.A O no hydrogen 3.407 N/A ARG 143.A NH1 THR 313.A OG1 no hydrogen 3.080 N/A ARG 143.A NH2 ASP 280.A OD2 no hydrogen 3.340 N/A SER 145.A N GLU 155.A O no hydrogen 2.910 N/A SER 145.A OG GLU 283.A OE1 no hydrogen 2.711 N/A SER 145.A OG GLU 283.A OE2 no hydrogen 2.495 N/A LYS 146.A NZ THR 80.A OG1 no hydrogen 3.063 N/A LYS 146.A NZ ASP 81.A OD1 no hydrogen 3.170 N/A ILE 147.A N ALA 153.A O no hydrogen 2.902 N/A ARG 148.A N ALA 153.A O no hydrogen 3.340 N/A ARG 148.A NE ASP 152.A O no hydrogen 2.561 N/A ARG 148.A NH1 ASP 152.A O no hydrogen 3.124 N/A GLU 155.A N SER 145.A O no hydrogen 3.090 N/A SER 156.A OG TYR 159.A O no hydrogen 2.604 N/A ILE 157.A N ARG 143.A O no hydrogen 2.739 N/A ASN 158.A ND2 ASP 280.A O no hydrogen 2.992 N/A ASN 161.A ND2 GLU 164.A OE2 no hydrogen 2.892 N/A VAL 162.A N VAL 139.A O no hydrogen 2.976 N/A ALA 163.A N VAL 139.A O no hydrogen 3.050 N/A GLU 164.A N ARG 171.A O no hydrogen 3.193 N/A ILE 165.A N GLY 137.A O no hydrogen 3.002 N/A LYS 166.A N LYS 169.A O no hydrogen 3.065 N/A LYS 169.A N LYS 166.A O no hydrogen 3.038 N/A LEU 170.A N GLU 122.A OE2 no hydrogen 3.048 N/A ARG 171.A N GLU 164.A O no hydrogen 3.077 N/A LEU 173.A N VAL 162.A O no hydrogen 2.619 N/A HIS 174.A N VAL 162.A O no hydrogen 3.369 N/A HIS 174.A NE2 PRO 160.A O no hydrogen 3.226 N/A GLY 180.A N ASN 93.A OD1 no hydrogen 2.843 N/A PHE 184.A N ARG 92.A O no hydrogen 3.092 N/A SER 185.A OG GLU 65.A OE2 no hydrogen 2.560 N/A LYS 188.A NZ ASP 186.A OD1 no hydrogen 3.501 N/A LYS 188.A NZ TRP 290.A O no hydrogen 3.449 N/A LYS 188.A NZ HIS 294.A ND1 no hydrogen 3.077 N/A LYS 192.A N GLU 190.A OE1 no hydrogen 2.913 N/A VAL 193.A N PRO 191.A O no hydrogen 2.951 N/A LEU 194.A N GLY 217.A O no hydrogen 3.007 N/A ILE 196.A N ILE 219.A O no hydrogen 2.944 N/A LYS 197.A NZ GLU 221.A OE2 no hydrogen 2.959 N/A LEU 198.A N GLU 221.A O no hydrogen 2.941 N/A LEU 202.A N ILE 199.A O no hydrogen 3.138 N/A SER 203.A OG ASP 234.A OD1 no hydrogen 3.001 N/A GLY 204.A N ASP 234.A OD1 no hydrogen 2.841 N/A ASP 205.A N SER 203.A OG no hydrogen 2.813 N/A VAL 207.A N GLY 204.A O no hydrogen 2.812 N/A ARG 208.A N GLY 204.A O no hydrogen 2.889 N/A ARG 208.A NH1 GLU 209.A OE1 no hydrogen 3.018 N/A GLU 209.A N ASP 205.A O no hydrogen 2.936 N/A ALA 210.A N ILE 206.A O no hydrogen 3.042 N/A LEU 211.A N ARG 208.A O no hydrogen 3.261 N/A ARG 212.A N ARG 208.A O no hydrogen 3.471 N/A LEU 213.A N GLU 209.A O no hydrogen 2.859 N/A GLY 214.A N LEU 211.A O no hydrogen 3.018 N/A TYR 215.A N ALA 210.A O no hydrogen 2.863 N/A LYS 216.A N LYS 192.A O no hydrogen 2.863 N/A LYS 216.A NZ GLY 214.A O no hydrogen 3.466 N/A ILE 218.A N PRO 247.A O no hydrogen 3.040 N/A ILE 219.A N LEU 194.A O no hydrogen 2.789 N/A LEU 220.A N VAL 249.A O no hydrogen 2.710 N/A GLU 221.A N ILE 196.A O no hydrogen 2.849 N/A GLY 222.A N THR 251.A O no hydrogen 2.817 N/A THR 233.A OG1 LEU 202.A O no hydrogen 2.699 N/A LEU 235.A N THR 233.A OG1 no hydrogen 3.094 N/A VAL 238.A N ASP 234.A O no hydrogen 2.884 N/A VAL 239.A N LEU 235.A O no hydrogen 2.815 N/A SER 240.A N PHE 236.A O no hydrogen 2.985 N/A SER 240.A OG PHE 236.A O no hydrogen 2.966 N/A SER 241.A N VAL 238.A O no hydrogen 3.322 N/A SER 241.A OG VAL 238.A O no hydrogen 3.390 N/A ILE 242.A N VAL 238.A O no hydrogen 3.046 N/A SER 243.A N VAL 239.A O no hydrogen 2.798 N/A SER 243.A OG VAL 239.A O no hydrogen 3.149 N/A SER 243.A OG SER 240.A O no hydrogen 2.974 N/A SER 243.A OG ALA 273.A O no hydrogen 2.793 N/A LYS 244.A N SER 241.A O no hydrogen 3.055 N/A LYS 244.A NZ SER 240.A O no hydrogen 2.604 N/A ARG 245.A N ILE 242.A O no hydrogen 2.844 N/A ILE 246.A N ILE 242.A O no hydrogen 3.040 N/A VAL 249.A N ILE 218.A O no hydrogen 2.804 N/A LEU 250.A N ILE 276.A O no hydrogen 2.832 N/A THR 251.A N LEU 220.A O no hydrogen 2.947 N/A THR 252.A N THR 251.A OG1 no hydrogen 2.595 N/A THR 252.A OG1 GLY 224.A O no hydrogen 2.916 N/A GLN 253.A N GLY 222.A O no hydrogen 2.596 N/A GLN 253.A NE2 LEU 198.A O no hydrogen 2.987 N/A GLN 253.A NE2 GLU 221.A O no hydrogen 2.954 N/A ALA 254.A N THR 252.A OG1 no hydrogen 3.071 N/A TYR 256.A OH GLU 155.A OE2 no hydrogen 2.496 N/A ASP 257.A N ASN 158.A OD1 no hydrogen 2.785 N/A VAL 259.A N GLY 279.A O no hydrogen 2.913 N/A ASP 260.A N VAL 225.A O no hydrogen 2.868 N/A GLN 262.A N ASP 260.A OD1 no hydrogen 2.729 N/A ARG 263.A N ASP 260.A O no hydrogen 3.184 N/A ARG 263.A NE ASP 260.A OD2 no hydrogen 3.241 N/A ARG 263.A NH1 ASP 260.A OD2 no hydrogen 2.607 N/A GLY 267.A N TYR 264.A O no hydrogen 2.877 N/A ARG 268.A N TYR 264.A O no hydrogen 3.071 N/A ARG 268.A NE GLN 262.A O no hydrogen 3.035 N/A ARG 268.A NH2 GLN 262.A O no hydrogen 3.118 N/A ILE 269.A N LYS 265.A O no hydrogen 2.971 N/A ALA 270.A N VAL 266.A O no hydrogen 3.250 N/A LEU 271.A N GLY 267.A O no hydrogen 2.944 N/A GLU 272.A N ARG 268.A O no hydrogen 2.909 N/A ALA 273.A N ILE 269.A O no hydrogen 3.062 N/A ALA 273.A N ALA 270.A O no hydrogen 2.992 N/A GLY 274.A N LEU 271.A O no hydrogen 3.259 N/A VAL 275.A N ALA 270.A O no hydrogen 3.271 N/A ILE 276.A N VAL 248.A O no hydrogen 2.993 N/A ALA 278.A N LEU 250.A O no hydrogen 3.070 N/A THR 281.A OG1 VAL 142.A O no hydrogen 3.309 N/A LYS 282.A NZ THR 252.A O no hydrogen 3.094 N/A LYS 282.A NZ ALA 254.A O no hydrogen 2.977 N/A GLU 283.A N GLU 283.A OE2 no hydrogen 2.781 N/A ALA 284.A N THR 281.A OG1 no hydrogen 3.020 N/A THR 285.A N THR 281.A O no hydrogen 3.014 N/A THR 285.A OG1 THR 281.A O no hydrogen 2.860 N/A ILE 286.A N LYS 282.A O no hydrogen 3.214 N/A THR 287.A N GLU 283.A O no hydrogen 3.137 N/A THR 287.A OG1 GLU 283.A O no hydrogen 2.841 N/A THR 287.A OG1 ALA 284.A O no hydrogen 3.315 N/A LYS 288.A N ALA 284.A O no hydrogen 2.693 N/A LYS 288.A NZ LEU 304.A O no hydrogen 3.062 N/A LYS 288.A NZ LYS 306.A O no hydrogen 2.763 N/A LYS 288.A NZ GLU 311.A OE2 no hydrogen 2.872 N/A LEU 289.A N THR 285.A O no hydrogen 3.069 N/A TRP 290.A NE1 ASP 186.A O no hydrogen 3.132 N/A ILE 291.A N LYS 288.A O no hydrogen 2.844 N/A LEU 292.A N LEU 289.A O no hydrogen 2.889 N/A GLY 293.A N TRP 290.A O no hydrogen 3.002 N/A HIS 294.A N ILE 291.A O no hydrogen 3.038 N/A HIS 294.A NE2 GLU 300.A OE2 no hydrogen 3.007 N/A THR 295.A N ILE 291.A O no hydrogen 3.229 N/A LYS 296.A NZ LEU 292.A O no hydrogen 2.935 N/A ASN 297.A N THR 295.A OG1 no hydrogen 2.906 N/A GLU 300.A N ASN 297.A OD1 no hydrogen 2.945 N/A VAL 301.A N ASN 297.A O no hydrogen 2.936 N/A LYS 302.A N ILE 298.A O no hydrogen 2.942 N/A GLN 303.A N GLU 299.A O no hydrogen 3.050 N/A LEU 304.A N GLU 300.A O no hydrogen 2.930 N/A LYS 306.A N LEU 304.A O no hydrogen 3.093 N/A ILE 308.A N GLU 311.A OE2 no hydrogen 2.719 N/A THR 309.A N GLU 311.A OE1 no hydrogen 2.679 N/A GLY 310.A N ASN 307.A OD1 no hydrogen 3.034 N/A GLU 311.A N GLU 311.A OE1 no hydrogen 2.720 N/A LEU 312.A N ASN 307.A OD1 no hydrogen 3.432 N/A THR 313.A N ASP 280.A OD1 no hydrogen 3.056 N/A THR 313.A OG1 ASP 280.A OD2 no hydrogen 2.652 N/A