Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1w22_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 5.A N VAL 111.A O no hydrogen 2.813 N/A TYR 6.A N ARG 43.A O no hydrogen 2.850 N/A TYR 6.A OH HIS 30.A ND1 no hydrogen 2.726 N/A ILE 7.A N ILE 113.A O no hydrogen 2.906 N/A TYR 8.A N VAL 45.A O no hydrogen 2.924 N/A GLU 11.A N GLU 11.A OE1 no hydrogen 2.652 N/A TYR 12.A N SER 9.A OG no hydrogen 3.126 N/A VAL 13.A N SER 9.A O no hydrogen 3.040 N/A SER 14.A N PRO 10.A O no hydrogen 3.004 N/A SER 14.A OG PRO 10.A O no hydrogen 3.285 N/A SER 14.A OG GLU 11.A O no hydrogen 2.852 N/A MET 15.A N GLU 11.A O no hydrogen 2.974 N/A CYS 16.A N TYR 12.A O no hydrogen 2.821 N/A CYS 16.A SG TYR 12.A O no hydrogen 3.376 N/A CYS 16.A SG SER 116.A OG no hydrogen 3.436 N/A ASP 17.A N VAL 13.A O no hydrogen 2.836 N/A SER 18.A N MET 15.A O no hydrogen 3.345 N/A SER 18.A OG MET 15.A O no hydrogen 2.756 N/A LEU 19.A N CYS 16.A O no hydrogen 3.330 N/A ILE 22.A N LEU 19.A O no hydrogen 3.110 N/A LYS 24.A N ASP 17.A O no hydrogen 3.393 N/A ARG 25.A N ILE 22.A O no hydrogen 3.479 N/A ARG 25.A NH1 GLY 281.A O no hydrogen 2.958 N/A ARG 25.A NH1 GLY 283.A O no hydrogen 2.779 N/A ARG 25.A NH2 GLY 281.A O no hydrogen 2.763 N/A SER 27.A N ASP 17.A OD2 no hydrogen 2.990 N/A SER 27.A OG ASP 17.A OD1 no hydrogen 2.340 N/A MET 28.A N LYS 24.A O no hydrogen 3.030 N/A VAL 29.A N ARG 25.A O no hydrogen 2.840 N/A HIS 30.A N ALA 26.A O no hydrogen 2.849 N/A HIS 30.A ND1 TYR 6.A OH no hydrogen 2.726 N/A SER 31.A N SER 27.A O no hydrogen 2.566 N/A SER 31.A OG SER 27.A O no hydrogen 2.811 N/A LEU 32.A N MET 28.A O no hydrogen 2.953 N/A ILE 33.A N VAL 29.A O no hydrogen 3.125 N/A GLU 34.A N HIS 30.A O no hydrogen 2.764 N/A ALA 35.A N SER 31.A O no hydrogen 2.740 N/A TYR 36.A N LEU 32.A O no hydrogen 3.177 N/A TYR 36.A OH SER 306.A O no hydrogen 2.952 N/A ALA 37.A N GLU 34.A O no hydrogen 2.653 N/A LEU 38.A N ILE 33.A O no hydrogen 2.947 N/A ARG 43.A N PRO 4.A O no hydrogen 2.837 N/A VAL 45.A N TYR 6.A O no hydrogen 3.106 N/A LYS 48.A NZ GLU 54.A OE2 no hydrogen 3.038 N/A ALA 50.A N ALA 91.A O no hydrogen 3.022 N/A SER 51.A N GLU 54.A OE1 no hydrogen 3.050 N/A SER 51.A OG GLU 53.A OE1 no hydrogen 3.407 N/A GLU 54.A N SER 51.A OG no hydrogen 3.109 N/A MET 55.A N SER 51.A O no hydrogen 2.997 N/A ALA 56.A N MET 52.A O no hydrogen 2.927 N/A THR 57.A N GLU 54.A O no hydrogen 3.019 N/A THR 57.A OG1 GLU 54.A O no hydrogen 2.753 N/A PHE 58.A N MET 55.A O no hydrogen 3.416 N/A HIS 59.A N MET 55.A O no hydrogen 3.195 N/A THR 60.A N LYS 124.A O no hydrogen 2.871 N/A TYR 63.A N THR 60.A OG1 no hydrogen 3.079 N/A TYR 63.A OH TYR 132.A O no hydrogen 2.925 N/A LEU 64.A N THR 60.A O no hydrogen 2.875 N/A GLN 65.A N ASP 61.A O no hydrogen 2.869 N/A HIS 66.A N ALA 62.A O no hydrogen 3.163 N/A LEU 67.A N TYR 63.A O no hydrogen 2.965 N/A GLN 68.A N LEU 64.A O no hydrogen 2.925 N/A LYS 69.A N GLN 65.A O no hydrogen 2.888 N/A LYS 69.A N HIS 66.A O no hydrogen 2.791 N/A VAL 70.A N HIS 66.A O no hydrogen 3.096 N/A SER 71.A N LEU 67.A O no hydrogen 3.167 N/A GLN 72.A N LYS 69.A O no hydrogen 2.939 N/A GLN 72.A NE2 GLN 68.A O no hydrogen 3.075 N/A TYR 74.A N GLU 73.A OE2 no hydrogen 2.902 N/A LEU 76.A N GLU 73.A OE2 no hydrogen 3.216 N/A GLY 77.A N CYS 80.A O no hydrogen 2.807 N/A THR 83.A N PRO 81.A O no hydrogen 2.641 N/A THR 83.A OG1 GLU 84.A O no hydrogen 3.204 N/A GLY 85.A N SER 71.A O no hydrogen 3.079 N/A ILE 86.A N THR 83.A O no hydrogen 3.107 N/A PHE 87.A N SER 71.A OG no hydrogen 3.138 N/A TYR 89.A N GLY 85.A O no hydrogen 3.136 N/A ALA 90.A N ILE 86.A O no hydrogen 2.830 N/A ALA 91.A N PHE 87.A O no hydrogen 2.917 N/A ALA 92.A N ASP 88.A O no hydrogen 2.983 N/A ILE 93.A N TYR 89.A O no hydrogen 3.195 N/A GLY 94.A N ALA 90.A O no hydrogen 2.855 N/A GLY 95.A N ALA 91.A O no hydrogen 2.746 N/A ALA 96.A N ALA 92.A O no hydrogen 2.800 N/A THR 97.A N ILE 93.A O no hydrogen 2.997 N/A THR 97.A N GLY 94.A O no hydrogen 3.220 N/A THR 97.A OG1 ASN 114.A OD1 no hydrogen 3.122 N/A THR 97.A OG1 ASP 135.A OD2 no hydrogen 2.899 N/A ILE 98.A N GLY 94.A O no hydrogen 3.027 N/A THR 99.A N GLY 95.A O no hydrogen 2.881 N/A ALA 100.A N ALA 96.A O no hydrogen 3.216 N/A ALA 101.A N THR 97.A O no hydrogen 2.877 N/A GLN 102.A N ILE 98.A O no hydrogen 2.995 N/A CYS 103.A N THR 99.A O no hydrogen 2.955 N/A CYS 103.A SG THR 99.A O no hydrogen 3.102 N/A LEU 104.A N ALA 100.A O no hydrogen 3.136 N/A LEU 104.A N ALA 101.A O no hydrogen 2.886 N/A ILE 105.A N ALA 101.A O no hydrogen 2.926 N/A ASP 106.A N GLN 102.A O no hydrogen 2.970 N/A CYS 109.A SG VAL 111.A O no hydrogen 3.072 N/A LYS 110.A NZ LEU 2.A O no hydrogen 3.119 N/A ALA 112.A N THR 276.A O no hydrogen 2.827 N/A ILE 113.A N VAL 5.A O no hydrogen 2.710 N/A ASN 114.A N ILE 278.A O no hydrogen 2.867 N/A ASN 114.A ND2 TYR 12.A OH no hydrogen 2.627 N/A TRP 115.A NE1 THR 297.A OG1 no hydrogen 2.916 N/A GLY 117.A N ASN 114.A O no hydrogen 2.945 N/A GLY 118.A N ASP 135.A OD1 no hydrogen 3.216 N/A GLY 118.A N ASP 135.A OD2 no hydrogen 2.645 N/A TRP 119.A N ASP 135.A OD1 no hydrogen 2.898 N/A TRP 119.A NE1 SER 116.A O no hydrogen 3.249 N/A HIS 120.A N GLY 118.A O no hydrogen 3.135 N/A HIS 120.A ND1 ASP 154.A OD2 no hydrogen 2.569 N/A HIS 121.A ND1 ASP 161.A OD1 no hydrogen 2.903 N/A LYS 123.A N GLU 126.A O no hydrogen 2.844 N/A LYS 123.A NZ ASP 161.A OD2 no hydrogen 3.092 N/A GLU 126.A N LYS 123.A O no hydrogen 3.409 N/A ALA 127.A N TYR 74.A O no hydrogen 2.669 N/A SER 128.A N CYS 131.A O no hydrogen 2.856 N/A CYS 131.A N SER 128.A O no hydrogen 2.697 N/A CYS 131.A SG GLY 129.A O no hydrogen 3.406 N/A TYR 132.A OH PRO 81.A O no hydrogen 2.817 N/A ASN 134.A N HIS 59.A NE2 no hydrogen 2.951 N/A ASN 134.A ND2 HIS 120.A O no hydrogen 3.179 N/A ASN 134.A ND2 ALA 122.A O no hydrogen 2.933 N/A VAL 137.A N ASN 134.A OD1 no hydrogen 2.917 N/A LEU 138.A N ASN 134.A O no hydrogen 3.159 N/A GLY 139.A N ASP 135.A O no hydrogen 2.760 N/A ILE 140.A N ALA 136.A O no hydrogen 2.935 N/A LEU 141.A N VAL 137.A O no hydrogen 2.753 N/A ARG 142.A N LEU 138.A O no hydrogen 3.005 N/A ARG 142.A NE GLN 102.A OE1 no hydrogen 2.462 N/A ARG 142.A NH1 GLU 54.A OE2 no hydrogen 3.397 N/A ARG 142.A NH2 GLN 102.A OE1 no hydrogen 2.902 N/A LEU 143.A N GLY 139.A O no hydrogen 2.816 N/A ARG 144.A N ILE 140.A O no hydrogen 3.041 N/A ARG 144.A NH1 PHE 147.A O no hydrogen 2.852 N/A ARG 145.A N ARG 142.A O no hydrogen 2.957 N/A LYS 146.A N LEU 143.A O no hydrogen 3.107 N/A LYS 146.A NZ ILE 105.A O no hydrogen 3.445 N/A PHE 147.A N LEU 143.A O no hydrogen 3.034 N/A ARG 149.A NE ASN 234.A O no hydrogen 2.743 N/A ARG 149.A NH2 ASN 234.A O no hydrogen 3.103 N/A ILE 150.A N LYS 172.A O no hydrogen 3.009 N/A LEU 151.A N ALA 237.A O no hydrogen 3.033 N/A TYR 152.A N MET 174.A O no hydrogen 2.830 N/A TYR 152.A OH ASP 154.A OD2 no hydrogen 2.617 N/A VAL 153.A N VAL 239.A O no hydrogen 2.873 N/A ASP 154.A N VAL 176.A O no hydrogen 2.834 N/A LEU 155.A N GLN 241.A O no hydrogen 2.847 N/A ASP 156.A N ASP 154.A OD1 no hydrogen 3.024 N/A LEU 157.A N ASP 245.A OD1 no hydrogen 2.785 N/A HIS 158.A N ASP 156.A OD2 no hydrogen 3.036 N/A HIS 159.A NE2 GLU 164.A OE1 no hydrogen 2.956 N/A GLY 160.A N SER 177.A OG no hydrogen 3.318 N/A ASP 161.A N HIS 159.A O no hydrogen 2.829 N/A GLY 162.A N ASP 161.A OD1 no hydrogen 2.649 N/A GLU 164.A N GLY 160.A O no hydrogen 3.100 N/A ASP 165.A N ASP 161.A O no hydrogen 2.816 N/A ALA 166.A N GLY 162.A O no hydrogen 3.251 N/A PHE 167.A N GLU 164.A O no hydrogen 2.963 N/A SER 168.A N ASP 165.A O no hydrogen 3.416 N/A SER 168.A OG ASP 165.A O no hydrogen 3.049 N/A THR 170.A N PHE 167.A O no hydrogen 3.006 N/A LYS 172.A N THR 170.A OG1 no hydrogen 3.031 N/A MET 174.A N ILE 150.A O no hydrogen 2.896 N/A THR 175.A N TYR 203.A O no hydrogen 3.273 N/A VAL 176.A N TYR 152.A O no hydrogen 2.701 N/A SER 177.A N VAL 205.A O no hydrogen 3.017 N/A SER 177.A OG HIS 179.A ND1 no hydrogen 2.720 N/A LEU 178.A N ASP 154.A O no hydrogen 3.210 N/A HIS 179.A N VAL 207.A O no hydrogen 3.026 N/A HIS 179.A ND1 SER 177.A OG no hydrogen 2.720 N/A HIS 179.A NE2 GLY 190.A O no hydrogen 2.721 N/A LYS 180.A N LEU 157.A O no hydrogen 3.039 N/A LYS 180.A NZ ASP 211.A OD1 no hydrogen 3.518 N/A LYS 180.A NZ ASP 211.A OD2 no hydrogen 3.018 N/A LYS 180.A NZ SER 254.A OG no hydrogen 3.291 N/A PHE 181.A N ILE 209.A O no hydrogen 3.172 N/A PHE 185.A N SER 182.A O no hydrogen 2.825 N/A VAL 192.A N ASP 191.A OD1 no hydrogen 2.721 N/A ASP 194.A N ASP 191.A O no hydrogen 2.972 N/A LEU 197.A N SER 168.A O no hydrogen 3.052 N/A GLY 200.A N LEU 197.A O no hydrogen 2.592 N/A ARG 201.A N GLY 198.A O no hydrogen 2.997 N/A ARG 201.A NE TYR 202.A OH no hydrogen 3.137 N/A TYR 202.A N VAL 195.A O no hydrogen 2.566 N/A TYR 203.A N GLY 200.A O no hydrogen 2.757 N/A SER 204.A N VAL 195.A O no hydrogen 3.155 N/A VAL 205.A N THR 175.A O no hydrogen 2.984 N/A ASN 206.A ND2 GLU 164.A OE1 no hydrogen 2.812 N/A VAL 207.A N SER 177.A O no hydrogen 2.747 N/A ILE 209.A N HIS 179.A O no hydrogen 2.631 N/A GLN 210.A N ASN 335.A OD1 no hydrogen 2.759 N/A GLN 210.A NE2 PHE 181.A O no hydrogen 3.324 N/A GLY 212.A N SER 254.A O no hydrogen 2.929 N/A LYS 217.A NZ ASN 335.A O no hydrogen 2.854 N/A TYR 218.A N GLN 214.A O no hydrogen 2.924 N/A TYR 219.A N ASP 215.A O no hydrogen 2.939 N/A TYR 219.A OH GLU 223.A OE1 no hydrogen 2.716 N/A GLN 220.A N GLU 216.A O no hydrogen 3.025 N/A ILE 221.A N LYS 217.A O no hydrogen 3.120 N/A CYS 222.A N TYR 218.A O no hydrogen 2.903 N/A GLU 223.A N TYR 219.A O no hydrogen 2.763 N/A SER 224.A N GLN 220.A O no hydrogen 2.985 N/A VAL 225.A N ILE 221.A O no hydrogen 3.006 N/A LEU 226.A N CYS 222.A O no hydrogen 2.782 N/A LYS 227.A N GLU 223.A O no hydrogen 2.806 N/A GLU 228.A N SER 224.A O no hydrogen 3.235 N/A VAL 229.A N VAL 225.A O no hydrogen 2.869 N/A TYR 230.A N LEU 226.A O no hydrogen 2.742 N/A GLN 231.A N LYS 227.A O no hydrogen 3.247 N/A ALA 232.A N GLU 228.A O no hydrogen 3.392 N/A PHE 233.A N VAL 229.A O no hydrogen 3.172 N/A LYS 236.A N ARG 149.A O no hydrogen 2.934 N/A VAL 238.A N ALA 275.A O no hydrogen 2.780 N/A VAL 239.A N LEU 151.A O no hydrogen 2.781 N/A LEU 240.A N LEU 277.A O no hydrogen 2.856 N/A GLN 241.A N VAL 153.A O no hydrogen 2.915 N/A GLN 241.A NE2 ASP 156.A OD1 no hydrogen 3.175 N/A LEU 242.A N LEU 279.A O no hydrogen 2.983 N/A ALA 244.A N GLY 282.A O no hydrogen 2.919 N/A ILE 247.A N ALA 244.A O no hydrogen 3.247 N/A ALA 248.A N MET 257.A O no hydrogen 2.695 N/A ASP 250.A N ILE 247.A O no hydrogen 2.968 N/A MET 252.A N ASP 250.A OD2 no hydrogen 2.787 N/A CYS 253.A N ASP 250.A O no hydrogen 2.840 N/A SER 254.A OG MET 252.A O no hydrogen 3.015 N/A ASN 256.A N ILE 213.A O no hydrogen 2.990 N/A ASN 256.A ND2 GLN 214.A OE1 no hydrogen 3.286 N/A ASN 256.A ND2 SER 329.A O no hydrogen 3.066 N/A MET 257.A N THR 246.A O no hydrogen 3.214 N/A THR 258.A N ASP 215.A OD1 no hydrogen 2.904 N/A THR 258.A OG1 ASP 215.A OD1 no hydrogen 3.286 N/A THR 258.A OG1 ASP 215.A OD2 no hydrogen 2.542 N/A VAL 260.A N THR 258.A OG1 no hydrogen 3.283 N/A GLY 261.A N THR 258.A O no hydrogen 3.038 N/A LYS 264.A N VAL 260.A O no hydrogen 3.049 N/A CYS 265.A N GLY 261.A O no hydrogen 3.454 N/A CYS 265.A SG GLY 261.A O no hydrogen 3.588 N/A LEU 266.A N ILE 262.A O no hydrogen 3.108 N/A LYS 267.A N GLY 263.A O no hydrogen 2.864 N/A TYR 268.A N LYS 264.A O no hydrogen 2.939 N/A ILE 269.A N CYS 265.A O no hydrogen 3.099 N/A LEU 270.A N LEU 266.A O no hydrogen 2.774 N/A GLN 271.A N LYS 267.A O no hydrogen 3.077 N/A TRP 272.A N ILE 269.A O no hydrogen 3.287 N/A GLN 273.A N LEU 270.A O no hydrogen 3.086 N/A THR 276.A N LYS 110.A O no hydrogen 2.873 N/A THR 276.A OG1 LEU 274.A O no hydrogen 2.904 N/A LEU 277.A N VAL 238.A O no hydrogen 2.892 N/A ILE 278.A N ALA 112.A O no hydrogen 2.768 N/A LEU 279.A N LEU 240.A O no hydrogen 2.870 N/A GLY 282.A N ASP 156.A OD1 no hydrogen 2.891 N/A TYR 284.A N ASP 250.A OD1 no hydrogen 2.719 N/A THR 289.A N ASN 285.A O no hydrogen 2.979 N/A THR 289.A OG1 ASN 285.A O no hydrogen 3.111 N/A ALA 290.A N LEU 286.A O no hydrogen 3.304 N/A ARG 291.A N ALA 287.A O no hydrogen 3.023 N/A ARG 291.A NE ASN 288.A OD1 no hydrogen 3.188 N/A ARG 291.A NH1 VAL 323.A O no hydrogen 2.647 N/A CYS 292.A N ASN 288.A O no hydrogen 2.670 N/A TRP 293.A N THR 289.A O no hydrogen 2.944 N/A TRP 293.A NE1 LEU 242.A O no hydrogen 3.048 N/A THR 294.A N ALA 290.A O no hydrogen 2.912 N/A TYR 295.A N ARG 291.A O no hydrogen 3.146 N/A LEU 296.A N CYS 292.A O no hydrogen 2.877 N/A THR 297.A N TRP 293.A O no hydrogen 2.821 N/A THR 297.A OG1 TRP 293.A O no hydrogen 2.545 N/A GLY 298.A N THR 294.A O no hydrogen 2.898 N/A VAL 299.A N TYR 295.A O no hydrogen 2.942 N/A ILE 300.A N LEU 296.A O no hydrogen 2.950 N/A LEU 301.A N THR 297.A O no hydrogen 3.029 N/A GLY 302.A N VAL 299.A O no hydrogen 3.300 N/A LYS 303.A NZ GLN 41.A OE1 no hydrogen 2.529 N/A SER 306.A OG GLU 308.A OE1 no hydrogen 3.411 N/A SER 307.A OG GLU 325.A OE1 no hydrogen 3.140 N/A ILE 309.A N TYR 322.A O no hydrogen 3.135 N/A HIS 312.A ND1 PRO 310.A O no hydrogen 2.803 N/A PHE 315.A N HIS 312.A O no hydrogen 3.230 N/A ALA 317.A N PHE 314.A O no hydrogen 2.959 N/A TYR 318.A N PHE 315.A O no hydrogen 3.075 N/A GLY 319.A N ALA 317.A O no hydrogen 2.882 N/A VAL 323.A N ASP 321.A OD1 no hydrogen 3.089 N/A LEU 324.A N SER 307.A O no hydrogen 2.638 N/A SER 329.A N ASN 256.A OD1 no hydrogen 2.961 N/A SER 329.A OG ASN 256.A OD1 no hydrogen 3.362 N/A ARG 331.A NH1 CYS 253.A O no hydrogen 2.775 N/A ARG 331.A NH2 CYS 253.A O no hydrogen 3.502 N/A ARG 334.A N ASP 211.A O no hydrogen 2.981 N/A ASN 335.A N ASP 333.A OD1 no hydrogen 3.045 N/A ASN 335.A ND2 GLN 210.A O no hydrogen 2.803 N/A ASN 335.A ND2 ASP 333.A OD1 no hydrogen 2.966 N/A ARG 339.A NH1 GLN 342.A OE1 no hydrogen 2.673 N/A ILE 340.A N GLU 336.A O no hydrogen 3.431 N/A GLN 341.A N PRO 337.A O no hydrogen 3.326 N/A GLN 342.A N HIS 338.A O no hydrogen 2.908 N/A ILE 343.A N ARG 339.A O no hydrogen 2.833 N/A LEU 344.A N ILE 340.A O no hydrogen 2.977 N/A ASN 345.A N GLN 341.A O no hydrogen 2.889 N/A TYR 346.A N GLN 342.A O no hydrogen 2.964 N/A ILE 347.A N ILE 343.A O no hydrogen 3.198 N/A LYS 348.A N LEU 344.A O no hydrogen 2.793 N/A GLY 349.A N ASN 345.A O no hydrogen 2.956 N/A GLY 349.A N TYR 346.A O no hydrogen 3.134 N/A ASN 350.A N TYR 346.A O no hydrogen 2.992 N/A LEU 351.A N ILE 347.A O no hydrogen 2.825 N/A