Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2xs0_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 4.A N ARG 1.A O no hydrogen 3.202 N/A ASN 4.A ND2 ARG 1.A O no hydrogen 3.319 N/A PHE 5.A N ASP 2.A O no hydrogen 3.291 N/A TYR 6.A N VAL 17.A O no hydrogen 3.105 N/A TYR 6.A OH TYR 21.A O no hydrogen 2.582 N/A SER 7.A OG THR 16.A OG1 no hydrogen 2.642 N/A VAL 8.A N PHE 15.A O no hydrogen 3.010 N/A ILE 10.A N SER 13.A O no hydrogen 2.696 N/A SER 13.A N ILE 10.A O no hydrogen 3.079 N/A SER 13.A OG ILE 10.A O no hydrogen 3.299 N/A THR 14.A OG1 GLU 9.A OE1 no hydrogen 3.444 N/A THR 14.A OG1 GLU 9.A OE2 no hydrogen 2.671 N/A PHE 15.A N VAL 8.A O no hydrogen 2.828 N/A THR 16.A N TYR 100.A OH no hydrogen 3.026 N/A THR 16.A OG1 SER 7.A OG no hydrogen 2.642 N/A VAL 17.A N TYR 6.A O no hydrogen 2.985 N/A LYS 19.A N ASN 4.A O no hydrogen 2.977 N/A ARG 20.A NE ASP 40.A OD1 no hydrogen 2.973 N/A ARG 20.A NH1 GLU 346.A OE1 no hydrogen 2.588 N/A ARG 20.A NH2 ASP 40.A OD1 no hydrogen 3.266 N/A ARG 20.A NH2 ASP 40.A OD2 no hydrogen 2.988 N/A ARG 20.A NH2 GLU 346.A OE1 no hydrogen 3.076 N/A TYR 21.A N LEU 18.A O no hydrogen 3.124 N/A GLN 22.A N TYR 39.A O no hydrogen 2.883 N/A GLN 22.A NE2 LYS 19.A O no hydrogen 2.766 N/A LYS 25.A N ALA 37.A O no hydrogen 3.088 N/A ILE 27.A N VAL 35.A O no hydrogen 2.754 N/A GLY 30.A N GLY 33.A O no hydrogen 3.083 N/A GLY 33.A N GLY 30.A O no hydrogen 3.077 N/A VAL 35.A N GLY 28.A O no hydrogen 3.076 N/A CYS 36.A N ILE 49.A O no hydrogen 2.957 N/A ALA 37.A N LYS 25.A O no hydrogen 2.755 N/A ALA 38.A N VAL 47.A O no hydrogen 2.957 N/A TYR 39.A N GLN 22.A O no hydrogen 2.864 N/A ASP 40.A N ARG 45.A O no hydrogen 2.839 N/A ALA 41.A N ARG 20.A O no hydrogen 2.766 N/A ILE 42.A N ASP 40.A OD1 no hydrogen 3.104 N/A LEU 43.A N ASP 40.A OD1 no hydrogen 3.458 N/A VAL 47.A N ALA 38.A O no hydrogen 2.834 N/A ALA 48.A N MET 103.A O no hydrogen 2.901 N/A ILE 49.A N CYS 36.A O no hydrogen 2.773 N/A LYS 50.A N ILE 101.A O no hydrogen 2.834 N/A LYS 50.A NZ GLN 32.A OE1 no hydrogen 2.781 N/A LYS 51.A NZ THR 14.A O no hydrogen 2.896 N/A LEU 52.A N VAL 99.A O no hydrogen 2.756 N/A ARG 54.A N GLN 97.A O no hydrogen 3.157 N/A ARG 54.A NH1 GLN 97.A OE1 no hydrogen 2.528 N/A GLN 57.A N ARG 54.A O no hydrogen 3.056 N/A HIS 61.A N ASN 58.A OD1 no hydrogen 2.830 N/A HIS 61.A ND1 ASN 58.A OD1 no hydrogen 3.175 N/A ALA 62.A N ASN 58.A O no hydrogen 3.138 N/A LYS 63.A N GLN 59.A O no hydrogen 2.853 N/A LYS 63.A NZ ARG 326.A O no hydrogen 2.911 N/A ARG 64.A N THR 60.A O no hydrogen 3.156 N/A ALA 65.A N HIS 61.A O no hydrogen 3.030 N/A TYR 66.A N ALA 62.A O no hydrogen 2.876 N/A ARG 67.A N LYS 63.A O no hydrogen 3.123 N/A ARG 67.A NH1 PHE 165.A O no hydrogen 3.448 N/A ARG 67.A NH2 PHE 165.A O no hydrogen 3.007 N/A GLU 68.A N ARG 64.A O no hydrogen 3.080 N/A LEU 69.A N ALA 65.A O no hydrogen 3.046 N/A VAL 70.A N TYR 66.A O no hydrogen 3.062 N/A LEU 71.A N ARG 67.A O no hydrogen 2.811 N/A MET 72.A N GLU 68.A O no hydrogen 2.800 N/A LYS 73.A N LEU 69.A O no hydrogen 2.887 N/A CYS 74.A N VAL 70.A O no hydrogen 3.161 N/A CYS 74.A SG VAL 70.A O no hydrogen 3.364 N/A CYS 74.A SG LEU 71.A O no hydrogen 3.784 N/A VAL 75.A N LEU 71.A O no hydrogen 2.965 N/A ASN 76.A ND2 ASN 76.A O no hydrogen 2.907 N/A HIS 77.A NE2 GLU 310.A O no hydrogen 2.911 N/A LYS 78.A NZ GLU 310.A OE2 no hydrogen 2.926 N/A ASN 79.A N HIS 77.A ND1 no hydrogen 2.928 N/A ASN 79.A ND2 GLN 129.A OE1 no hydrogen 3.579 N/A ASN 79.A ND2 LEU 160.A O no hydrogen 2.884 N/A ILE 80.A N HIS 77.A O no hydrogen 2.907 N/A ILE 81.A N ILE 162.A O no hydrogen 3.089 N/A GLY 82.A N GLU 104.A OE1 no hydrogen 2.632 N/A LEU 84.A N VAL 102.A O no hydrogen 2.644 N/A ASN 85.A N VAL 102.A O no hydrogen 3.201 N/A ASN 85.A ND2 TYR 21.A OH no hydrogen 2.826 N/A VAL 86.A N ASN 85.A OD1 no hydrogen 2.986 N/A PHE 87.A N TYR 100.A O no hydrogen 3.085 N/A THR 88.A OG1 ASP 98.A O no hydrogen 2.808 N/A SER 92.A OG GLU 95.A OE1 no hydrogen 2.816 N/A GLU 95.A N SER 92.A OG no hydrogen 3.412 N/A PHE 96.A N SER 92.A O no hydrogen 2.826 N/A PHE 96.A N LEU 93.A O no hydrogen 3.285 N/A GLN 97.A N GLN 90.A OE1 no hydrogen 2.766 N/A ASP 98.A N GLN 90.A OE1 no hydrogen 2.751 N/A VAL 99.A N LEU 52.A O no hydrogen 3.071 N/A TYR 100.A N PHE 87.A O no hydrogen 2.942 N/A ILE 101.A N LYS 50.A O no hydrogen 2.880 N/A VAL 102.A N ASN 85.A O no hydrogen 2.710 N/A MET 103.A N ALA 48.A O no hydrogen 2.751 N/A ASP 107.A N VAL 154.A O no hydrogen 2.920 N/A ALA 108.A N VAL 154.A O no hydrogen 3.220 N/A LEU 110.A N PRO 149.A O no hydrogen 2.982 N/A CYS 111.A N ASN 109.A OD1 no hydrogen 2.993 N/A ILE 114.A N LEU 110.A O no hydrogen 3.101 N/A ILE 114.A N CYS 111.A O no hydrogen 3.228 N/A GLN 115.A N CYS 111.A O no hydrogen 3.418 N/A HIS 120.A ND1 TYR 301.A OH no hydrogen 2.797 N/A ARG 122.A N ASP 119.A OD1 no hydrogen 2.838 N/A ARG 122.A NE ASP 119.A OD1 no hydrogen 3.419 N/A ARG 122.A NE ASP 119.A OD2 no hydrogen 3.199 N/A ARG 122.A NH2 ASP 119.A OD2 no hydrogen 3.549 N/A MET 123.A N ASP 119.A O no hydrogen 2.943 N/A SER 124.A N HIS 120.A O no hydrogen 2.775 N/A SER 124.A OG HIS 120.A O no hydrogen 2.786 N/A SER 124.A OG GLU 121.A O no hydrogen 2.853 N/A TYR 125.A N GLU 121.A O no hydrogen 3.153 N/A LEU 126.A N ARG 122.A O no hydrogen 2.862 N/A LEU 127.A N MET 123.A O no hydrogen 3.023 N/A TYR 128.A N SER 124.A O no hydrogen 2.801 N/A TYR 128.A OH GLU 310.A OE1 no hydrogen 2.545 N/A GLN 129.A N TYR 125.A O no hydrogen 2.947 N/A GLN 129.A NE2 TYR 125.A O no hydrogen 3.260 N/A GLN 129.A NE2 CYS 158.A O no hydrogen 2.873 N/A MET 130.A N LEU 126.A O no hydrogen 3.102 N/A LEU 131.A N LEU 127.A O no hydrogen 3.082 N/A CYS 132.A N TYR 128.A O no hydrogen 3.102 N/A CYS 132.A SG TYR 128.A O no hydrogen 3.416 N/A CYS 132.A SG GLU 310.A O no hydrogen 3.834 N/A GLY 133.A N GLN 129.A O no hydrogen 3.083 N/A ILE 134.A N MET 130.A O no hydrogen 2.976 N/A LYS 135.A N LEU 131.A O no hydrogen 2.847 N/A LYS 135.A NZ ASP 294.A OD1 no hydrogen 3.020 N/A LYS 135.A NZ ALA 311.A O no hydrogen 2.838 N/A HIS 136.A N CYS 132.A O no hydrogen 3.025 N/A LEU 137.A N GLY 133.A O no hydrogen 3.125 N/A HIS 138.A N ILE 134.A O no hydrogen 2.851 N/A HIS 138.A NE2 ASP 188.A OD2 no hydrogen 2.932 N/A SER 139.A N LYS 135.A O no hydrogen 2.885 N/A SER 139.A OG HIS 136.A O no hydrogen 2.747 N/A ALA 140.A N LEU 137.A O no hydrogen 2.920 N/A GLY 141.A N HIS 138.A O no hydrogen 2.685 N/A ILE 142.A N LEU 137.A O no hydrogen 3.034 N/A HIS 144.A N ASP 188.A OD2 no hydrogen 2.790 N/A HIS 144.A NE2 ASP 164.A O no hydrogen 3.051 N/A HIS 144.A NE2 ASP 164.A OD1 no hydrogen 2.812 N/A ARG 145.A N ASP 188.A OD1 no hydrogen 2.613 N/A ASP 146.A N HIS 144.A ND1 no hydrogen 3.149 N/A LYS 148.A N ASN 151.A OD1 no hydrogen 3.095 N/A LYS 148.A NZ SER 150.A OG no hydrogen 3.231 N/A ASN 151.A N LYS 148.A O no hydrogen 2.966 N/A ASN 151.A ND2 ASP 146.A O no hydrogen 3.088 N/A ASN 151.A ND2 ASP 164.A OD2 no hydrogen 3.421 N/A ILE 152.A N PRO 149.A O no hydrogen 3.296 N/A VAL 153.A N LYS 161.A O no hydrogen 2.937 N/A VAL 154.A N ALA 108.A O no hydrogen 2.806 N/A LYS 155.A N THR 159.A O no hydrogen 2.847 N/A SER 156.A N ASP 107.A OD2 no hydrogen 2.798 N/A CYS 158.A N LYS 155.A O no hydrogen 2.775 N/A THR 159.A N ASP 157.A OD1 no hydrogen 2.957 N/A THR 159.A OG1 ASP 157.A OD1 no hydrogen 2.597 N/A THR 159.A OG1 ASP 157.A OD2 no hydrogen 3.522 N/A LEU 160.A N GLN 129.A OE1 no hydrogen 2.954 N/A LYS 161.A N VAL 153.A O no hydrogen 2.886 N/A LYS 161.A NZ LYS 78.A O no hydrogen 2.759 N/A LYS 161.A NZ GLU 104.A OE2 no hydrogen 3.282 N/A ILE 162.A N ASN 79.A O no hydrogen 2.829 N/A LEU 163.A N ASN 151.A O no hydrogen 2.831 N/A LEU 167.A N HIS 144.A O no hydrogen 2.871 N/A THR 169.A OG1 GLY 208.A O no hydrogen 3.304 N/A THR 169.A OG1 THR 209.A O no hydrogen 3.446 N/A TYR 172.A OH GLU 198.A OE1 no hydrogen 2.546 N/A TYR 172.A OH GLU 198.A OE2 no hydrogen 3.292 N/A GLU 176.A N GLU 176.A OE1 no hydrogen 3.256 N/A VAL 177.A N ALA 174.A O no hydrogen 2.814 N/A ILE 178.A N ALA 174.A O no hydrogen 3.242 N/A LEU 179.A N PRO 175.A O no hydrogen 3.249 N/A GLY 180.A N VAL 177.A O no hydrogen 3.402 N/A MET 181.A N GLU 176.A O no hydrogen 3.150 N/A GLU 185.A N GLU 185.A OE1 no hydrogen 2.948 N/A ASN 186.A ND2 ALA 287.A O no hydrogen 2.918 N/A ASN 186.A ND2 ARG 290.A O no hydrogen 3.134 N/A VAL 187.A N LYS 184.A O no hydrogen 3.112 N/A ASP 188.A N GLU 185.A O no hydrogen 3.155 N/A ILE 189.A N ASN 186.A O no hydrogen 2.988 N/A TRP 190.A N VAL 187.A O no hydrogen 3.316 N/A SER 191.A OG TYR 172.A O no hydrogen 3.326 N/A VAL 192.A N ASP 188.A O no hydrogen 3.233 N/A GLY 193.A N ILE 189.A O no hydrogen 3.006 N/A CYS 194.A N TRP 190.A O no hydrogen 2.927 N/A CYS 194.A SG TRP 190.A O no hydrogen 3.703 N/A ILE 195.A N SER 191.A O no hydrogen 3.029 N/A MET 196.A N VAL 192.A O no hydrogen 2.977 N/A GLY 197.A N GLY 193.A O no hydrogen 2.929 N/A GLU 198.A N CYS 194.A O no hydrogen 2.732 N/A MET 199.A N ILE 195.A O no hydrogen 2.889 N/A ILE 200.A N MET 196.A O no hydrogen 3.110 N/A LYS 201.A N GLY 197.A O no hydrogen 3.041 N/A LYS 201.A NZ LEU 255.A O no hydrogen 3.245 N/A GLY 202.A N GLU 198.A O no hydrogen 2.820 N/A GLY 208.A N GLN 214.A OE1 no hydrogen 3.002 N/A THR 209.A N ASP 213.A OD2 no hydrogen 3.373 N/A ILE 212.A N ASP 210.A OD1 no hydrogen 3.013 N/A ASP 213.A N ASP 210.A OD1 no hydrogen 3.352 N/A GLN 214.A N ASP 210.A O no hydrogen 3.014 N/A GLN 214.A NE2 PHE 206.A O no hydrogen 2.915 N/A TRP 215.A N HIS 211.A O no hydrogen 3.448 N/A ASN 216.A N ILE 212.A O no hydrogen 3.451 N/A LYS 217.A N ASP 213.A O no hydrogen 3.353 N/A VAL 218.A N TRP 215.A O no hydrogen 2.996 N/A ILE 219.A N TRP 215.A O no hydrogen 3.199 N/A GLU 220.A N ASN 216.A O no hydrogen 2.999 N/A GLN 221.A N VAL 218.A O no hydrogen 3.223 N/A LEU 222.A N VAL 218.A O no hydrogen 2.968 N/A GLY 223.A N ILE 219.A O no hydrogen 2.715 N/A THR 224.A N TYR 247.A O no hydrogen 3.198 N/A THR 224.A OG1 TYR 247.A O no hydrogen 3.057 N/A CYS 226.A SG GLU 228.A OE2 no hydrogen 2.947 N/A PHE 229.A N CYS 226.A O no hydrogen 2.867 N/A MET 230.A N CYS 226.A O no hydrogen 3.312 N/A LYS 232.A N PHE 229.A O no hydrogen 2.754 N/A LYS 232.A NZ ASP 286.A OD1 no hydrogen 3.309 N/A ARG 238.A N GLN 234.A O no hydrogen 2.870 N/A THR 239.A N THR 236.A O no hydrogen 3.313 N/A THR 239.A OG1 PRO 235.A O no hydrogen 2.654 N/A THR 239.A OG1 THR 236.A O no hydrogen 3.067 N/A TYR 240.A N VAL 237.A O no hydrogen 3.041 N/A ASN 243.A N TYR 240.A O no hydrogen 2.797 N/A ASN 243.A ND2 GLU 242.A O no hydrogen 3.461 N/A TYR 247.A N THR 224.A OG1 no hydrogen 2.830 N/A TYR 250.A N GLN 221.A O no hydrogen 2.731 N/A SER 251.A OG GLU 253.A OE1 no hydrogen 3.515 N/A GLU 253.A N SER 251.A OG no hydrogen 3.162 N/A LYS 254.A N SER 251.A O no hydrogen 3.123 N/A LYS 254.A N SER 251.A OG no hydrogen 3.125 N/A LEU 255.A N SER 251.A O no hydrogen 3.087 N/A PHE 256.A N PHE 252.A O no hydrogen 3.252 N/A LEU 260.A N PRO 257.A O no hydrogen 2.806 N/A PHE 261.A N ASP 258.A O no hydrogen 2.944 N/A SER 265.A N ASP 264.A OD1 no hydrogen 2.666 N/A SER 265.A OG ASP 264.A OD1 no hydrogen 3.311 N/A ASN 268.A N SER 265.A O no hydrogen 2.906 N/A ASN 268.A ND2 ASP 264.A OD1 no hydrogen 2.883 N/A LYS 269.A NZ ASP 258.A OD2 no hydrogen 2.754 N/A LYS 271.A N HIS 267.A O no hydrogen 3.158 N/A LYS 271.A NZ GLN 274.A OE1 no hydrogen 3.046 N/A ALA 272.A N ASN 268.A O no hydrogen 3.275 N/A SER 273.A N LYS 269.A O no hydrogen 2.941 N/A SER 273.A OG LYS 269.A O no hydrogen 3.189 N/A SER 273.A OG LEU 270.A O no hydrogen 2.736 N/A GLN 274.A N LEU 270.A O no hydrogen 2.881 N/A ALA 275.A N LYS 271.A O no hydrogen 2.732 N/A ARG 276.A N ALA 272.A O no hydrogen 3.031 N/A ARG 276.A NE PHE 256.A O no hydrogen 3.076 N/A ARG 276.A NH2 PHE 256.A O no hydrogen 3.445 N/A ARG 276.A NH2 ASP 258.A OD1 no hydrogen 2.782 N/A ASP 277.A N SER 273.A O no hydrogen 2.898 N/A LEU 278.A N GLN 274.A O no hydrogen 3.168 N/A LEU 279.A N ALA 275.A O no hydrogen 3.165 N/A SER 280.A N ARG 276.A O no hydrogen 3.235 N/A SER 280.A N ASP 277.A O no hydrogen 3.019 N/A SER 280.A OG ARG 276.A O no hydrogen 3.194 N/A SER 280.A OG ASP 277.A O no hydrogen 2.482 N/A LYS 281.A N ASP 277.A O no hydrogen 3.090 N/A LYS 281.A NZ ASP 277.A OD2 no hydrogen 3.041 N/A MET 282.A N LEU 278.A O no hydrogen 2.903 N/A MET 282.A N LEU 279.A O no hydrogen 3.228 N/A LEU 283.A N LEU 279.A O no hydrogen 2.774 N/A SER 288.A N ASP 286.A OD1 no hydrogen 3.313 N/A SER 288.A OG ASP 286.A OD1 no hydrogen 3.105 N/A LYS 289.A N ASP 286.A O no hydrogen 2.956 N/A ARG 290.A NE VAL 284.A O no hydrogen 2.967 N/A ARG 290.A NH1 GLU 176.A OE1 no hydrogen 3.341 N/A ARG 290.A NH1 GLU 176.A OE2 no hydrogen 3.158 N/A ARG 290.A NH1 ASN 186.A O no hydrogen 2.928 N/A ARG 290.A NH2 GLU 176.A OE1 no hydrogen 2.766 N/A ARG 290.A NH2 VAL 284.A O no hydrogen 3.044 N/A ILE 291.A N LYS 281.A O no hydrogen 2.927 N/A SER 292.A N GLU 295.A OE1 no hydrogen 2.642 N/A SER 292.A OG GLU 295.A OE1 no hydrogen 3.084 N/A GLU 295.A N SER 292.A OG no hydrogen 3.287 N/A ALA 296.A N SER 292.A O no hydrogen 2.907 N/A LEU 297.A N VAL 293.A O no hydrogen 3.124 N/A GLN 298.A N GLU 295.A O no hydrogen 2.869 N/A HIS 299.A N GLU 295.A O no hydrogen 2.999 N/A HIS 299.A NE2 ASP 277.A OD2 no hydrogen 2.881 N/A TYR 301.A N HIS 299.A ND1 no hydrogen 3.167 N/A TYR 301.A OH HIS 120.A ND1 no hydrogen 2.797 N/A ILE 302.A N HIS 299.A O no hydrogen 2.933 N/A ASN 303.A N HIS 299.A O no hydrogen 2.871 N/A TRP 305.A N ILE 302.A O no hydrogen 3.315 N/A TRP 305.A NE1 SER 124.A OG no hydrogen 2.677 N/A TYR 306.A N ASN 303.A O no hydrogen 2.976 N/A TYR 306.A OH GLU 312.A OE2 no hydrogen 2.608 N/A SER 309.A N ASP 307.A OD1 no hydrogen 2.909 N/A SER 309.A OG ASP 307.A OD1 no hydrogen 2.880 N/A SER 309.A OG ASP 307.A OD2 no hydrogen 3.196 N/A GLU 310.A N ASP 307.A O no hydrogen 3.007 N/A ALA 311.A N ASP 307.A O no hydrogen 2.871 N/A GLU 312.A N PRO 308.A O no hydrogen 2.830 N/A LEU 323.A N ASP 320.A O no hydrogen 3.199 N/A ARG 326.A NH1 HIS 328.A NE2 no hydrogen 2.627 N/A ARG 326.A NH2 ASP 320.A OD1 no hydrogen 3.531 N/A ARG 326.A NH2 ASP 320.A OD2 no hydrogen 2.876 N/A THR 329.A N GLU 332.A OE1 no hydrogen 2.559 N/A GLU 332.A N THR 329.A OG1 no hydrogen 3.353 N/A TRP 333.A N THR 329.A O no hydrogen 2.934 N/A LYS 334.A N ILE 330.A O no hydrogen 3.064 N/A LYS 334.A NZ LEU 93.A O no hydrogen 2.877 N/A LYS 334.A NZ GLU 94.A O no hydrogen 3.108 N/A GLU 335.A N GLU 331.A O no hydrogen 3.338 N/A LEU 336.A N GLU 332.A O no hydrogen 2.897 N/A ILE 337.A N TRP 333.A O no hydrogen 2.786 N/A TYR 338.A N LYS 334.A O no hydrogen 2.974 N/A LYS 339.A N GLU 335.A O no hydrogen 2.802 N/A GLU 340.A N LEU 336.A O no hydrogen 2.911 N/A VAL 341.A N ILE 337.A O no hydrogen 2.811 N/A MET 342.A N TYR 338.A O no hydrogen 2.842 N/A ASP 343.A N LYS 339.A O no hydrogen 2.897 N/A