Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2xsz_D.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 4.A OG GLY 1.A O no hydrogen 3.406 N/A SER 4.A OG GLU 226.A OE1 no hydrogen 2.730 N/A ILE 6.A N HIS 3.A O no hydrogen 3.139 N/A ARG 7.A N GLN 22.A O no hydrogen 2.714 N/A GLY 10.A N GLN 22.A OE1 no hydrogen 2.867 N/A ASP 12.A N GLU 16.A O no hydrogen 3.166 N/A ALA 14.A N ASP 12.A OD1 no hydrogen 3.275 N/A LEU 15.A N ASP 12.A O no hydrogen 2.915 N/A GLU 16.A N ASP 12.A OD1 no hydrogen 3.357 N/A ARG 18.A N GLY 10.A O no hydrogen 3.231 N/A ARG 18.A NH1 SER 21.A OG no hydrogen 3.299 N/A GLN 19.A NE2 ASP 215.A OD1 no hydrogen 3.557 N/A ALA 20.A N ARG 18.A O no hydrogen 2.647 N/A GLY 25.A N GLN 19.A O no hydrogen 2.710 N/A GLN 26.A NE2 THR 209.A O no hydrogen 2.771 N/A ARG 30.A N GLN 26.A O no hydrogen 3.121 N/A ARG 30.A NE LEU 9.A O no hydrogen 2.830 N/A ARG 30.A NH1 GLY 25.A O no hydrogen 2.664 N/A ARG 30.A NH2 LEU 9.A O no hydrogen 3.288 N/A ARG 30.A NH2 GLY 10.A O no hydrogen 3.020 N/A ARG 31.A N LEU 27.A O no hydrogen 2.967 N/A ARG 31.A NE LEU 15.A O no hydrogen 2.893 N/A ARG 31.A NH2 ALA 14.A O no hydrogen 3.284 N/A ALA 32.A N ALA 28.A O no hydrogen 3.049 N/A ALA 33.A N ALA 29.A O no hydrogen 3.137 N/A GLY 34.A N ARG 30.A O no hydrogen 3.104 N/A VAL 35.A N ARG 31.A O no hydrogen 3.172 N/A VAL 35.A N ALA 32.A O no hydrogen 3.150 N/A VAL 36.A N ALA 32.A O no hydrogen 3.239 N/A LEU 37.A N ALA 33.A O no hydrogen 3.159 N/A GLU 38.A N GLY 34.A O no hydrogen 3.245 N/A ARG 40.A N LEU 37.A O no hydrogen 2.926 N/A ARG 40.A NH1 GLU 38.A OE2 no hydrogen 3.157 N/A GLU 41.A N GLU 38.A O no hydrogen 2.825 N/A GLY 42.A N ILE 39.A O no hydrogen 3.172 N/A ARG 47.A N ILE 44.A O no hydrogen 3.046 N/A VAL 49.A N LEU 174.A O no hydrogen 2.874 N/A LEU 50.A N LEU 204.A O no hydrogen 3.097 N/A ALA 52.A N VAL 206.A O no hydrogen 2.810 N/A GLY 53.A N THR 177.A O no hydrogen 3.027 N/A THR 57.A OG1 GLN 54.A O no hydrogen 2.616 N/A THR 57.A OG1 THR 208.A OG1 no hydrogen 2.958 N/A LYS 59.A NZ GLY 53.A O no hydrogen 3.078 N/A LYS 59.A NZ GLN 54.A O no hydrogen 2.953 N/A ILE 62.A N GLY 58.A O no hydrogen 2.765 N/A ALA 63.A N LYS 59.A O no hydrogen 3.156 N/A ALA 67.A N GLY 64.A O no hydrogen 3.000 N/A THR 72.A OG1 ALA 65.A O no hydrogen 2.585 N/A THR 72.A OG1 GLY 69.A O no hydrogen 2.788 N/A THR 75.A N VAL 147.A O no hydrogen 2.945 N/A THR 75.A OG1 SER 99.A OG no hydrogen 2.967 N/A ILE 77.A N PHE 149.A O no hydrogen 2.802 N/A SER 80.A OG GLU 152.A OE1 no hydrogen 2.884 N/A GLU 81.A N ALA 78.A O no hydrogen 3.188 N/A ILE 82.A N GLY 79.A O no hydrogen 3.477 N/A PHE 83.A N SER 80.A O no hydrogen 3.257 N/A SER 87.A OG THR 89.A OG1 no hydrogen 3.073 N/A LYS 88.A NZ ASP 156.A OD2 no hydrogen 3.453 N/A LYS 88.A NZ GLU 158.A OE1 no hydrogen 3.278 N/A THR 89.A OG1 SER 87.A OG no hydrogen 3.073 N/A ALA 91.A N SER 87.A O no hydrogen 2.742 N/A LEU 92.A N LYS 88.A O no hydrogen 3.036 N/A THR 93.A N THR 89.A O no hydrogen 2.527 N/A THR 93.A OG1 THR 89.A O no hydrogen 2.860 N/A GLN 94.A N GLU 90.A O no hydrogen 3.033 N/A GLN 94.A NE2 GLU 90.A OE2 no hydrogen 2.808 N/A ALA 95.A N ALA 91.A O no hydrogen 3.162 N/A PHE 96.A N LEU 92.A O no hydrogen 2.934 N/A ARG 97.A N THR 93.A O no hydrogen 2.910 N/A ARG 98.A N GLN 94.A O no hydrogen 2.977 N/A SER 99.A N PHE 96.A O no hydrogen 2.973 N/A SER 99.A OG THR 75.A OG1 no hydrogen 2.967 N/A SER 99.A OG ALA 95.A O no hydrogen 3.452 N/A SER 99.A OG VAL 147.A O no hydrogen 2.994 N/A GLY 101.A N ILE 144.A O no hydrogen 3.173 N/A VAL 102.A N VAL 107.A O no hydrogen 2.818 N/A ARG 103.A N GLU 142.A O no hydrogen 2.925 N/A ARG 103.A NE ASP 71.A OD2 no hydrogen 2.985 N/A ARG 103.A NH2 ASP 71.A OD1 no hydrogen 3.331 N/A ARG 103.A NH2 ASP 71.A OD2 no hydrogen 2.941 N/A ILE 104.A N HIS 105.A O no hydrogen 2.936 N/A VAL 107.A N VAL 102.A O no hydrogen 2.775 N/A SER 108.A N GLU 111.A OE1 no hydrogen 3.067 N/A SER 108.A OG GLU 111.A OE1 no hydrogen 3.232 N/A LEU 109.A N ILE 100.A O no hydrogen 2.786 N/A HIS 110.A N ARG 97.A O no hydrogen 2.963 N/A GLU 111.A N SER 108.A OG no hydrogen 3.294 N/A ILE 112.A N SER 108.A O no hydrogen 3.334 N/A ASP 113.A N LEU 109.A O no hydrogen 3.150 N/A VAL 114.A N HIS 110.A O no hydrogen 3.023 N/A ILE 115.A N GLU 111.A O no hydrogen 2.904 N/A ASN 116.A N ILE 112.A O no hydrogen 3.199 N/A ASN 116.A ND2 ILE 112.A O no hydrogen 3.578 N/A SER 117.A N VAL 114.A O no hydrogen 3.260 N/A ILE 120.A N GLU 90.A OE2 no hydrogen 3.021 N/A ARG 125.A N LYS 121.A O no hydrogen 3.259 N/A ARG 125.A NH2 GLU 90.A OE1 no hydrogen 2.749 N/A GLU 126.A N SER 122.A O no hydrogen 3.322 N/A GLN 127.A N GLU 123.A O no hydrogen 3.073 N/A ILE 128.A N VAL 124.A O no hydrogen 3.103 N/A ASN 129.A N ARG 125.A O no hydrogen 2.813 N/A ASN 129.A ND2 ARG 125.A O no hydrogen 2.771 N/A LYS 131.A N GLN 127.A O no hydrogen 2.778 N/A VAL 132.A N ILE 128.A O no hydrogen 2.779 N/A ALA 133.A N ASN 129.A O no hydrogen 3.361 N/A GLU 134.A N ALA 130.A O no hydrogen 3.224 N/A GLU 134.A N LYS 131.A O no hydrogen 3.227 N/A TRP 135.A N LYS 131.A O no hydrogen 3.177 N/A ARG 136.A N VAL 132.A O no hydrogen 3.004 N/A GLU 137.A N ALA 133.A O no hydrogen 3.212 N/A GLU 138.A N GLU 134.A O no hydrogen 2.925 N/A GLY 139.A N TRP 135.A O no hydrogen 3.007 N/A LYS 140.A N TRP 135.A O no hydrogen 3.156 N/A ALA 141.A N TRP 135.A O no hydrogen 3.290 N/A ILE 144.A N GLY 101.A O no hydrogen 2.948 N/A GLY 146.A N SER 99.A O no hydrogen 2.810 N/A VAL 147.A N PRO 73.A O no hydrogen 2.764 N/A LEU 148.A N VAL 173.A O no hydrogen 3.119 N/A PHE 149.A N THR 75.A O no hydrogen 2.734 N/A ILE 150.A N ILE 175.A O no hydrogen 2.886 N/A ASP 151.A N ILE 77.A O no hydrogen 2.840 N/A GLU 152.A N ASP 151.A OD1 no hydrogen 3.100 N/A VAL 153.A N ALA 176.A O no hydrogen 3.156 N/A ASP 156.A N ASP 156.A OD1 no hydrogen 2.741 N/A ASP 156.A N SER 159.A OG no hydrogen 3.032 N/A ILE 157.A N ARG 185.A O no hydrogen 3.129 N/A SER 159.A OG ASP 156.A O no hydrogen 2.842 N/A SER 159.A OG ASP 156.A OD1 no hydrogen 2.585 N/A PHE 160.A N ASP 156.A O no hydrogen 2.816 N/A SER 161.A N ILE 157.A O no hydrogen 2.718 N/A SER 161.A OG ILE 157.A O no hydrogen 2.881 N/A PHE 162.A N GLU 158.A O no hydrogen 3.329 N/A LEU 163.A N SER 159.A O no hydrogen 3.143 N/A ASN 164.A N PHE 160.A O no hydrogen 3.382 N/A ARG 165.A N SER 161.A O no hydrogen 3.231 N/A ALA 166.A N PHE 162.A O no hydrogen 2.815 N/A LEU 167.A N LEU 163.A O no hydrogen 2.858 N/A GLU 168.A N ARG 165.A O no hydrogen 3.302 N/A SER 169.A N ALA 166.A O no hydrogen 3.426 N/A VAL 173.A N GLY 146.A O no hydrogen 2.861 N/A ILE 175.A N LEU 148.A O no hydrogen 2.813 N/A THR 177.A N ILE 51.A O no hydrogen 3.359 N/A ARG 179.A N THR 177.A OG1 no hydrogen 3.043 N/A THR 182.A N SER 191.A O no hydrogen 3.308 N/A THR 182.A OG1 GLY 180.A O no hydrogen 3.141 N/A ARG 183.A NH1 THR 187.A O no hydrogen 2.806 N/A ILE 184.A N TYR 189.A O no hydrogen 2.729 N/A THR 187.A N ILE 184.A O no hydrogen 2.915 N/A THR 187.A OG1 ILE 184.A O no hydrogen 3.071 N/A TYR 189.A N THR 187.A OG1 no hydrogen 2.970 N/A SER 191.A N THR 182.A O no hydrogen 2.901 N/A SER 191.A OG ILE 195.A O no hydrogen 2.624 N/A HIS 193.A N GLY 180.A O no hydrogen 2.666 N/A HIS 193.A ND1 ARG 179.A O no hydrogen 2.694 N/A GLY 194.A N SER 191.A O no hydrogen 2.858 N/A ILE 195.A N PRO 192.A O no hydrogen 3.235 N/A LEU 199.A N PRO 196.A O no hydrogen 2.989 N/A LEU 200.A N PRO 196.A O no hydrogen 3.014 N/A ASP 201.A N ILE 197.A O no hydrogen 2.893 N/A ARG 202.A N LEU 199.A O no hydrogen 3.095 N/A ARG 202.A NE GLY 46.A O no hydrogen 3.224 N/A ARG 202.A NH1 ASN 164.A OD1 no hydrogen 3.187 N/A LEU 203.A N LEU 200.A O no hydrogen 3.023 N/A LEU 204.A N ALA 48.A O no hydrogen 2.952 N/A VAL 206.A N LEU 50.A O no hydrogen 2.809 N/A THR 208.A N ALA 52.A O no hydrogen 2.867 N/A THR 208.A OG1 ALA 52.A O no hydrogen 3.467 N/A THR 208.A OG1 THR 57.A OG1 no hydrogen 2.958 N/A THR 209.A N GLN 26.A OE1 no hydrogen 2.875 N/A ASP 215.A N SER 212.A OG no hydrogen 3.255 N/A THR 216.A N SER 212.A O no hydrogen 3.008 N/A THR 216.A OG1 SER 212.A O no hydrogen 2.713 N/A LYS 217.A N GLU 213.A O no hydrogen 3.053 N/A LYS 217.A NZ GLU 213.A OE2 no hydrogen 2.926 N/A LYS 217.A NZ THR 236.A OG1 no hydrogen 3.309 N/A GLN 218.A N LYS 214.A O no hydrogen 3.108 N/A ILE 219.A N ASP 215.A O no hydrogen 3.027 N/A LEU 220.A N THR 216.A O no hydrogen 3.044 N/A ARG 221.A N LYS 217.A O no hydrogen 2.757 N/A ARG 221.A NH2 GLU 232.A OE2 no hydrogen 2.936 N/A ILE 222.A N GLN 218.A O no hydrogen 3.073 N/A ARG 223.A N ILE 219.A O no hydrogen 2.861 N/A ARG 223.A NH1 SER 4.A OG no hydrogen 3.009 N/A ARG 223.A NH1 HIS 5.A ND1 no hydrogen 3.025 N/A ARG 223.A NH2 GLY 1.A O no hydrogen 3.054 N/A ARG 223.A NH2 GLU 227.A OE2 no hydrogen 3.287 N/A CYS 224.A N LEU 220.A O no hydrogen 2.807 N/A CYS 224.A SG LEU 220.A O no hydrogen 3.305 N/A GLU 225.A N ARG 221.A O no hydrogen 3.357 N/A GLU 226.A N ILE 222.A O no hydrogen 3.133 N/A GLU 227.A N ARG 223.A O no hydrogen 2.932 N/A ASP 228.A N GLU 225.A O no hydrogen 3.296 N/A VAL 229.A N CYS 224.A O no hydrogen 2.766 N/A SER 231.A OG VAL 269.A O no hydrogen 3.413 N/A ALA 234.A N SER 231.A OG no hydrogen 3.128 N/A TYR 235.A N SER 231.A O no hydrogen 3.063 N/A THR 236.A N GLU 232.A O no hydrogen 2.913 N/A THR 236.A OG1 GLU 232.A O no hydrogen 3.063 N/A VAL 237.A N ASP 233.A O no hydrogen 3.237 N/A LEU 238.A N ALA 234.A O no hydrogen 2.780 N/A THR 239.A N TYR 235.A O no hydrogen 2.893 N/A THR 239.A OG1 TYR 235.A O no hydrogen 3.447 N/A THR 239.A OG1 THR 236.A O no hydrogen 2.984 N/A ARG 240.A N THR 236.A O no hydrogen 3.267 N/A ILE 241.A N VAL 237.A O no hydrogen 2.869 N/A GLY 242.A N LEU 238.A O no hydrogen 2.856 N/A LEU 243.A N THR 239.A O no hydrogen 2.789 N/A GLU 244.A N ARG 240.A O no hydrogen 2.854 N/A THR 245.A N ILE 241.A O no hydrogen 2.727 N/A THR 245.A OG1 ILE 241.A O no hydrogen 2.639 N/A THR 245.A OG1 SER 246.A O no hydrogen 3.434 N/A SER 246.A N THR 245.A OG1 no hydrogen 2.634 N/A TYR 249.A N SER 246.A OG no hydrogen 3.026 N/A TYR 249.A OH PHE 281.A O no hydrogen 2.502 N/A ALA 250.A N SER 246.A O no hydrogen 3.096 N/A ILE 251.A N LEU 247.A O no hydrogen 2.760 N/A GLN 252.A N ARG 248.A O no hydrogen 2.799 N/A LEU 253.A N TYR 249.A O no hydrogen 3.049 N/A ILE 254.A N ILE 251.A O no hydrogen 3.067 N/A THR 255.A OG1 GLU 227.A OE1 no hydrogen 3.053 N/A ALA 257.A N LEU 253.A O no hydrogen 2.658 N/A SER 258.A N ILE 254.A O no hydrogen 2.914 N/A SER 258.A OG ILE 254.A O no hydrogen 3.403 N/A SER 258.A OG THR 255.A O no hydrogen 2.675 N/A LEU 259.A N THR 255.A O no hydrogen 3.258 N/A VAL 260.A N ALA 256.A O no hydrogen 3.100 N/A CYS 261.A N ALA 257.A O no hydrogen 3.086 N/A ARG 262.A N SER 258.A O no hydrogen 2.769 N/A LYS 263.A N LEU 259.A O no hydrogen 2.848 N/A ARG 264.A N CYS 261.A O no hydrogen 3.097 N/A LYS 265.A N ARG 262.A O no hydrogen 3.482 N/A THR 267.A N LYS 265.A O no hydrogen 2.714 N/A THR 267.A OG1 GLY 266.A O no hydrogen 2.718 N/A VAL 269.A N GLU 230.A O no hydrogen 3.023 N/A GLN 270.A N ASP 273.A OD2 no hydrogen 3.015 N/A GLN 270.A NE2 GLU 268.A O no hydrogen 2.737 N/A ASP 273.A N GLN 270.A O no hydrogen 3.022 N/A ILE 274.A N GLN 270.A O no hydrogen 3.284 N/A LYS 275.A N VAL 271.A O no hydrogen 2.726 N/A ARG 276.A N ASP 272.A O no hydrogen 2.953 N/A VAL 277.A N ASP 273.A O no hydrogen 3.088 N/A TYR 278.A N ILE 274.A O no hydrogen 3.019 N/A SER 279.A N LYS 275.A O no hydrogen 3.276 N/A SER 279.A OG LYS 275.A O no hydrogen 2.782 N/A LEU 280.A N ARG 276.A O no hydrogen 3.062 N/A PHE 281.A N VAL 277.A O no hydrogen 3.135 N/A SER 285.A OG ASP 283.A OD2 no hydrogen 3.057 N/A ARG 286.A N ASP 283.A OD2 no hydrogen 3.332 N/A ARG 286.A NE ASP 283.A OD1 no hydrogen 2.618 N/A ARG 286.A NH1 TYR 278.A O no hydrogen 3.189 N/A ARG 286.A NH2 TYR 278.A O no hydrogen 2.917 N/A ARG 286.A NH2 PHE 281.A O no hydrogen 3.350 N/A ARG 286.A NH2 ASP 283.A OD1 no hydrogen 2.881 N/A SER 287.A N ASP 283.A O no hydrogen 3.081 N/A THR 288.A N GLU 284.A O no hydrogen 3.276 N/A THR 288.A OG1 GLU 284.A O no hydrogen 3.386 N/A THR 288.A OG1 SER 285.A O no hydrogen 3.001 N/A GLN 289.A N SER 285.A O no hydrogen 3.008 N/A TYR 290.A N ARG 286.A O no hydrogen 3.093 N/A GLU 292.A N GLN 289.A O no hydrogen 2.933 N/A TYR 293.A N TYR 290.A O no hydrogen 3.085 N/A ASP 295.A N LYS 291.A O no hydrogen 2.896 N/A ALA 296.A N GLU 292.A O no hydrogen 3.189 N/A ALA 296.A N TYR 293.A O no hydrogen 3.166 N/A PHE 297.A N TYR 293.A O no hydrogen 3.283 N/A LEU 298.A N GLN 294.A O no hydrogen 3.198 N/A PHE 299.A N ASP 295.A O no hydrogen 3.284 N/A ASN 300.A N ALA 296.A O no hydrogen 3.296 N/A