Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7s1n_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 5.A N VAL 16.A O no hydrogen 3.011 N/A TYR 5.A OH TYR 20.A O no hydrogen 2.789 N/A SER 6.A OG THR 15.A OG1 no hydrogen 2.880 N/A VAL 7.A N PHE 14.A O no hydrogen 3.032 N/A VAL 9.A N SER 12.A O no hydrogen 3.120 N/A THR 13.A OG1 GLU 8.A OE1 no hydrogen 2.795 N/A THR 13.A OG1 GLU 8.A OE2 no hydrogen 2.709 N/A PHE 14.A N VAL 7.A O no hydrogen 2.963 N/A THR 15.A N TYR 99.A OH no hydrogen 2.904 N/A THR 15.A OG1 SER 6.A OG no hydrogen 2.880 N/A VAL 16.A N TYR 5.A O no hydrogen 2.989 N/A LYS 18.A N GLN 3.A O no hydrogen 3.087 N/A LYS 18.A NZ ASN 2.A O no hydrogen 2.916 N/A ARG 19.A NE ASP 39.A OD1 no hydrogen 2.966 N/A ARG 19.A NH2 ASP 39.A OD1 no hydrogen 3.343 N/A ARG 19.A NH2 ASP 39.A OD2 no hydrogen 2.825 N/A TYR 20.A N LEU 17.A O no hydrogen 2.927 N/A GLN 21.A N TYR 38.A O no hydrogen 2.839 N/A LYS 24.A N ALA 36.A O no hydrogen 2.915 N/A GLY 29.A N GLY 32.A O no hydrogen 3.151 N/A GLN 31.A N GLY 29.A O no hydrogen 2.260 N/A ILE 33.A N LYS 50.A O no hydrogen 3.226 N/A CYS 35.A N.A ILE 48.A O no hydrogen 2.800 N/A CYS 35.A N.B ILE 48.A O no hydrogen 2.790 N/A CYS 35.A SG.A ALA 36.A O no hydrogen 3.808 N/A CYS 35.A SG.A ILE 48.A O no hydrogen 3.955 N/A CYS 35.A SG.B VAL 34.A O no hydrogen 3.179 N/A ALA 36.A N LYS 24.A O no hydrogen 2.732 N/A ALA 37.A N VAL 46.A O no hydrogen 3.054 N/A TYR 38.A N GLN 21.A O no hydrogen 2.848 N/A TYR 38.A OH ASP 43.A OD1 no hydrogen 2.377 N/A ASP 39.A N ARG 44.A O no hydrogen 2.902 N/A ALA 40.A N ARG 19.A O no hydrogen 2.797 N/A LEU 42.A N ASP 39.A OD1 no hydrogen 3.134 N/A ARG 44.A N ASP 39.A O no hydrogen 3.434 N/A VAL 46.A N ALA 37.A O no hydrogen 2.880 N/A ALA 47.A N MET 102.A O no hydrogen 2.774 N/A ILE 48.A N CYS 35.A O.A no hydrogen 2.743 N/A ILE 48.A N CYS 35.A O.B no hydrogen 2.746 N/A LYS 49.A N LEU 100.A O no hydrogen 2.780 N/A LYS 50.A N ILE 33.A O no hydrogen 2.773 N/A LYS 50.A NZ THR 13.A O no hydrogen 2.570 N/A LEU 51.A N VAL 98.A O no hydrogen 2.710 N/A ARG 53.A N ASP 97.A OD1 no hydrogen 3.340 N/A GLN 56.A N ARG 53.A O no hydrogen 2.911 N/A GLN 56.A NE2 SER 52.A O no hydrogen 3.035 N/A GLN 56.A NE2 ARG 53.A O no hydrogen 3.081 N/A ASN 57.A ND2 HIS 60.A ND1 no hydrogen 3.452 N/A THR 59.A OG1 PHE 169.A O no hydrogen 3.096 N/A HIS 60.A N ASN 57.A OD1 no hydrogen 3.165 N/A ALA 61.A N ASN 57.A O no hydrogen 2.858 N/A LYS 62.A N GLN 58.A O no hydrogen 2.725 N/A ARG 63.A N THR 59.A O no hydrogen 3.171 N/A ARG 63.A NE GLN 31.A OE1 no hydrogen 3.357 N/A ARG 63.A NH1 GLY 165.A O no hydrogen 3.135 N/A ALA 64.A N HIS 60.A O no hydrogen 2.845 N/A TYR 65.A N ALA 61.A O no hydrogen 2.888 N/A TYR 65.A OH ASP 327.A OD2 no hydrogen 2.686 N/A ARG 66.A N LYS 62.A O no hydrogen 2.838 N/A ARG 66.A NH1 PHE 164.A O no hydrogen 3.405 N/A ARG 66.A NH2 PHE 164.A O no hydrogen 2.967 N/A GLU 67.A N ARG 63.A O no hydrogen 2.920 N/A LEU 68.A N ALA 64.A O no hydrogen 3.076 N/A VAL 69.A N TYR 65.A O no hydrogen 3.172 N/A LEU 70.A N ARG 66.A O no hydrogen 3.187 N/A MET 71.A N GLU 67.A O no hydrogen 2.905 N/A LYS 72.A N LEU 68.A O no hydrogen 3.178 N/A LYS 72.A NZ GLU 343.A O no hydrogen 2.832 N/A LYS 72.A NZ GLU 343.A OE1 no hydrogen 2.967 N/A CYS 73.A N LEU 70.A O no hydrogen 2.561 N/A CYS 73.A SG VAL 69.A O no hydrogen 2.619 N/A VAL 74.A N LEU 70.A O no hydrogen 2.967 N/A HIS 76.A NE2 GLU 318.A O no hydrogen 2.860 N/A LYS 77.A NZ GLU 318.A OE2 no hydrogen 2.282 N/A ASN 78.A N HIS 76.A ND1 no hydrogen 3.027 N/A ILE 79.A N HIS 76.A O no hydrogen 2.943 N/A ILE 80.A N ILE 161.A O no hydrogen 2.821 N/A LEU 83.A N VAL 101.A O no hydrogen 2.742 N/A ASN 84.A ND2 TYR 20.A OH no hydrogen 2.836 N/A VAL 85.A N ASN 84.A OD1 no hydrogen 2.962 N/A PHE 86.A N TYR 99.A O no hydrogen 3.032 N/A THR 87.A OG1 ASP 97.A O no hydrogen 2.681 N/A GLN 89.A N THR 87.A OG1 no hydrogen 3.335 N/A THR 91.A OG1 GLU 94.A OE1 no hydrogen 3.179 N/A GLU 94.A N THR 91.A OG1 no hydrogen 3.164 N/A PHE 95.A N LEU 92.A O no hydrogen 3.072 N/A GLN 96.A N GLN 89.A OE1 no hydrogen 2.807 N/A ASP 97.A N GLN 89.A OE1 no hydrogen 2.815 N/A VAL 98.A N LEU 51.A O no hydrogen 3.121 N/A TYR 99.A N PHE 86.A O no hydrogen 2.842 N/A LEU 100.A N LYS 49.A O no hydrogen 2.894 N/A VAL 101.A N ASN 84.A O no hydrogen 3.092 N/A MET 102.A N ALA 47.A O no hydrogen 2.918 N/A LEU 104.A N ASN 45.A O no hydrogen 3.348 N/A ASP 106.A N VAL 153.A O no hydrogen 2.943 N/A ALA 107.A N VAL 153.A O no hydrogen 2.894 N/A ASN 108.A N GLN 111.A OE1 no hydrogen 2.816 N/A ASN 108.A ND2 SER 149.A O no hydrogen 2.784 N/A LEU 109.A N ILE 151.A O no hydrogen 2.824 N/A CYS 110.A N ASN 108.A OD1 no hydrogen 3.202 N/A CYS 110.A SG ASN 108.A OD1 no hydrogen 3.212 N/A GLN 111.A N ASN 108.A O no hydrogen 2.723 N/A VAL 112.A N ASN 108.A O no hydrogen 3.393 N/A ILE 113.A N LEU 109.A O no hydrogen 2.929 N/A GLN 114.A N GLN 111.A O no hydrogen 3.247 N/A MET 115.A N VAL 112.A O no hydrogen 2.885 N/A HIS 119.A ND1 TYR 309.A OH no hydrogen 2.568 N/A GLU 120.A N GLU 120.A OE2 no hydrogen 3.182 N/A ARG 121.A N ASP 118.A OD2 no hydrogen 2.866 N/A MET 122.A N ASP 118.A O no hydrogen 3.063 N/A SER 123.A N HIS 119.A O no hydrogen 2.795 N/A SER 123.A OG HIS 119.A O no hydrogen 2.934 N/A SER 123.A OG GLU 120.A O no hydrogen 3.146 N/A TYR 124.A N GLU 120.A O no hydrogen 3.102 N/A LEU 125.A N ARG 121.A O no hydrogen 2.904 N/A LEU 126.A N MET 122.A O no hydrogen 3.038 N/A TYR 127.A N SER 123.A O no hydrogen 2.897 N/A TYR 127.A OH GLU 318.A OE1 no hydrogen 2.991 N/A GLN 128.A N TYR 124.A O no hydrogen 2.961 N/A GLN 128.A NE2 TYR 124.A O no hydrogen 3.546 N/A GLN 128.A NE2 CYS 157.A O no hydrogen 2.505 N/A MET 129.A N LEU 125.A O no hydrogen 2.911 N/A LEU 130.A N LEU 126.A O no hydrogen 2.973 N/A CYS 131.A N TYR 127.A O no hydrogen 3.005 N/A CYS 131.A SG TYR 127.A O no hydrogen 3.224 N/A CYS 131.A SG GLU 318.A O no hydrogen 4.012 N/A GLY 132.A N GLN 128.A O no hydrogen 2.858 N/A ILE 133.A N MET 129.A O no hydrogen 2.850 N/A LYS 134.A N LEU 130.A O no hydrogen 2.749 N/A LYS 134.A NZ LYS 134.A O no hydrogen 2.473 N/A HIS 135.A N CYS 131.A O no hydrogen 2.951 N/A LEU 136.A N GLY 132.A O no hydrogen 2.949 N/A HIS 137.A N ILE 133.A O no hydrogen 2.944 N/A HIS 137.A NE2 ASP 196.A OD2 no hydrogen 2.762 N/A SER 138.A N LYS 134.A O no hydrogen 2.882 N/A SER 138.A OG HIS 135.A O no hydrogen 2.789 N/A ALA 139.A N HIS 135.A O no hydrogen 2.905 N/A GLY 140.A N HIS 137.A O no hydrogen 2.794 N/A ILE 141.A N LEU 136.A O no hydrogen 2.828 N/A HIS 143.A N ASP 196.A OD2 no hydrogen 3.156 N/A HIS 143.A NE2 ASP 163.A OD1 no hydrogen 2.697 N/A ARG 144.A N ASP 196.A OD1 no hydrogen 2.717 N/A ASP 145.A N HIS 143.A ND1 no hydrogen 3.015 N/A LYS 147.A NZ ASP 145.A OD1 no hydrogen 3.366 N/A LYS 147.A NZ ASP 145.A OD2 no hydrogen 2.586 N/A LYS 147.A NZ THR 177.A O no hydrogen 3.012 N/A ASN 150.A N LYS 147.A O no hydrogen 3.143 N/A ILE 151.A N PRO 148.A O no hydrogen 2.979 N/A VAL 152.A N LYS 160.A O no hydrogen 3.004 N/A VAL 153.A N ALA 107.A O no hydrogen 2.711 N/A LYS 154.A N THR 158.A O no hydrogen 2.823 N/A SER 155.A N ASP 106.A OD2 no hydrogen 2.734 N/A CYS 157.A N LYS 154.A O no hydrogen 2.754 N/A THR 158.A N ASP 156.A OD1 no hydrogen 2.771 N/A THR 158.A OG1 ASP 156.A OD1 no hydrogen 2.383 N/A THR 158.A OG1 ASP 156.A OD2 no hydrogen 3.401 N/A LEU 159.A N GLN 128.A OE1 no hydrogen 3.189 N/A LYS 160.A N VAL 152.A O no hydrogen 2.853 N/A LYS 160.A NZ LYS 77.A O no hydrogen 2.634 N/A ILE 161.A N ASN 78.A O no hydrogen 2.784 N/A LEU 162.A N ASN 150.A O no hydrogen 2.916 N/A PHE 164.A N GLU 67.A OE2 no hydrogen 2.938 N/A GLY 165.A N ASP 163.A OD2 no hydrogen 2.977 N/A LEU 166.A N HIS 143.A O no hydrogen 3.008 N/A SER 168.A OG SER 168.A O no hydrogen 2.352 N/A TYR 180.A OH GLU 206.A OE1 no hydrogen 2.598 N/A ARG 181.A N ARG 178.A O no hydrogen 3.290 N/A ARG 181.A NE ASP 145.A OD1 no hydrogen 2.812 N/A ARG 181.A NH1 TYR 219.A OH no hydrogen 3.180 N/A ARG 181.A NH2 ASP 145.A OD2 no hydrogen 3.118 N/A GLU 184.A N GLU 184.A OE1 no hydrogen 2.623 N/A ILE 186.A N ALA 182.A O no hydrogen 2.782 N/A LEU 187.A N PRO 183.A O no hydrogen 2.791 N/A MET 189.A N GLU 184.A O no hydrogen 2.864 N/A ASN 194.A ND2 PRO 295.A O no hydrogen 3.161 N/A ASN 194.A ND2 ARG 298.A O no hydrogen 3.167 N/A VAL 195.A N LYS 192.A O no hydrogen 2.883 N/A ASP 196.A N GLU 193.A O no hydrogen 3.346 N/A ILE 197.A N ASN 194.A O no hydrogen 3.191 N/A SER 199.A OG TYR 180.A O no hydrogen 2.548 N/A VAL 200.A N ASP 196.A O no hydrogen 3.183 N/A GLY 201.A N ILE 197.A O no hydrogen 2.875 N/A CYS 202.A N TRP 198.A O no hydrogen 2.903 N/A CYS 202.A SG TYR 179.A O no hydrogen 4.023 N/A CYS 202.A SG TRP 198.A O no hydrogen 3.569 N/A ILE 203.A N SER 199.A O no hydrogen 3.001 N/A MET 204.A N VAL 200.A O no hydrogen 2.862 N/A GLY 205.A N GLY 201.A O no hydrogen 2.856 N/A GLU 206.A N CYS 202.A O no hydrogen 3.115 N/A MET 207.A N ILE 203.A O no hydrogen 2.913 N/A VAL 208.A N MET 204.A O no hydrogen 3.135 N/A ARG 209.A N GLY 205.A O no hydrogen 2.857 N/A ARG 209.A NH1 GLN 229.A OE1 no hydrogen 2.873 N/A ARG 209.A NH2 GLN 229.A OE1 no hydrogen 3.393 N/A ARG 209.A NH2 LEU 263.A O no hydrogen 3.044 N/A HIS 210.A N GLU 206.A O no hydrogen 2.561 N/A ARG 217.A N ASP 221.A OD2 no hydrogen 3.085 N/A ARG 217.A NE ASP 221.A OD2 no hydrogen 2.796 N/A ARG 217.A NH2 ASP 221.A OD1 no hydrogen 3.134 N/A ARG 217.A NH2 ASP 221.A OD2 no hydrogen 3.283 N/A TYR 219.A N ASP 218.A OD2 no hydrogen 2.766 N/A GLN 222.A N ASP 218.A O no hydrogen 3.095 N/A GLN 222.A NE2 ARG 178.A O no hydrogen 2.869 N/A TRP 223.A N TYR 219.A O no hydrogen 3.041 N/A ASN 224.A N ILE 220.A O no hydrogen 3.160 N/A LYS 225.A N ASP 221.A O no hydrogen 3.002 N/A VAL 226.A N GLN 222.A O no hydrogen 3.032 N/A ILE 227.A N TRP 223.A O no hydrogen 3.017 N/A GLU 228.A N ASN 224.A O no hydrogen 2.955 N/A GLN 229.A NE2 LEU 213.A O no hydrogen 3.050 N/A GLN 229.A NE2 LYS 225.A O no hydrogen 2.801 N/A LEU 230.A N VAL 226.A O no hydrogen 2.921 N/A GLY 231.A N ILE 227.A O no hydrogen 2.997 N/A THR 232.A N TYR 255.A O no hydrogen 3.106 N/A PHE 237.A N CYS 234.A O no hydrogen 2.559 N/A MET 238.A N CYS 234.A O no hydrogen 3.148 N/A LYS 239.A N PRO 235.A O no hydrogen 3.085 N/A LYS 240.A N PHE 237.A O no hydrogen 3.290 N/A LEU 241.A N MET 238.A O no hydrogen 2.756 N/A ARG 246.A N GLN 242.A O no hydrogen 2.630 N/A ARG 246.A NH1 GLU 250.A OE2 no hydrogen 3.111 N/A ASN 247.A N PRO 243.A O no hydrogen 2.924 N/A TYR 248.A N THR 244.A O no hydrogen 3.208 N/A VAL 249.A N VAL 245.A O no hydrogen 3.103 N/A GLU 250.A N ARG 246.A O no hydrogen 2.919 N/A ASN 251.A N ASN 247.A O no hydrogen 3.085 N/A ASN 251.A N TYR 248.A O no hydrogen 3.250 N/A ARG 252.A N VAL 249.A O no hydrogen 2.896 N/A LYS 254.A NZ GLU 250.A O no hydrogen 3.559 N/A TYR 255.A N THR 232.A OG1 no hydrogen 3.201 N/A LEU 258.A N GLN 229.A O no hydrogen 2.883 N/A LYS 262.A N THR 259.A OG1 no hydrogen 3.339 N/A LEU 263.A N THR 259.A O no hydrogen 2.895 N/A PHE 264.A N PHE 260.A O no hydrogen 2.743 N/A LEU 268.A N PRO 265.A O no hydrogen 3.135 N/A PHE 269.A N ASP 266.A O no hydrogen 2.843 N/A ASP 272.A N ASP 272.A OD1 no hydrogen 2.385 N/A HIS 275.A ND1 ASN 276.A OD1 no hydrogen 3.273 N/A ASN 276.A N SER 273.A OG no hydrogen 2.984 N/A ASN 276.A ND2 ASP 272.A OD1 no hydrogen 2.809 N/A LYS 277.A N SER 273.A O no hydrogen 3.001 N/A LYS 277.A NZ ALA 271.A O no hydrogen 3.399 N/A LEU 278.A N GLU 274.A O no hydrogen 3.000 N/A LYS 279.A N HIS 275.A O no hydrogen 3.045 N/A ALA 280.A N ASN 276.A O no hydrogen 2.892 N/A SER 281.A N LYS 277.A O no hydrogen 3.285 N/A SER 281.A OG LEU 278.A O no hydrogen 2.925 N/A GLN 282.A N LEU 278.A O no hydrogen 2.905 N/A ALA 283.A N LYS 279.A O no hydrogen 2.690 N/A ARG 284.A N ALA 280.A O no hydrogen 2.764 N/A ARG 284.A NE PHE 264.A O no hydrogen 2.985 N/A ARG 284.A NH2 PHE 264.A O no hydrogen 3.202 N/A ARG 284.A NH2 ASP 266.A OD1 no hydrogen 2.314 N/A ASP 285.A N SER 281.A O no hydrogen 3.004 N/A LEU 286.A N GLN 282.A O no hydrogen 2.933 N/A LEU 287.A N ALA 283.A O no hydrogen 3.010 N/A SER 288.A N ARG 284.A O no hydrogen 2.967 N/A SER 288.A OG ASP 285.A O no hydrogen 2.610 N/A LYS 289.A N LEU 286.A O no hydrogen 2.706 N/A LYS 289.A NZ ASP 285.A OD1 no hydrogen 2.824 N/A LYS 289.A NZ ASP 285.A OD2 no hydrogen 3.327 N/A MET 290.A N LEU 287.A O no hydrogen 3.142 N/A LEU 291.A N LEU 287.A O no hydrogen 2.910 N/A VAL 292.A N MET 290.A O no hydrogen 2.788 N/A ALA 296.A N ASP 294.A OD1 no hydrogen 2.547 N/A LYS 297.A N ASP 294.A O no hydrogen 3.274 N/A ARG 298.A N PRO 295.A O no hydrogen 3.183 N/A ARG 298.A NE VAL 292.A O no hydrogen 2.793 N/A ARG 298.A NH1 GLU 184.A OE2 no hydrogen 2.761 N/A ARG 298.A NH1 ASN 194.A O no hydrogen 3.123 N/A ARG 298.A NH2 GLU 184.A OE1 no hydrogen 2.881 N/A ARG 298.A NH2 GLU 184.A OE2 no hydrogen 3.557 N/A ARG 298.A NH2 VAL 292.A O no hydrogen 3.081 N/A ILE 299.A N LYS 289.A O no hydrogen 2.991 N/A ALA 304.A N SER 300.A O no hydrogen 2.955 N/A LEU 305.A N VAL 301.A O no hydrogen 3.057 N/A HIS 307.A N ALA 304.A O no hydrogen 2.916 N/A HIS 307.A NE2 ASP 285.A OD2 no hydrogen 2.567 N/A TYR 309.A N HIS 307.A ND1 no hydrogen 2.971 N/A TYR 309.A OH HIS 119.A ND1 no hydrogen 2.568 N/A ILE 310.A N HIS 307.A O no hydrogen 2.787 N/A ASN 311.A N HIS 307.A O no hydrogen 2.657 N/A ASN 311.A ND2 GLN 306.A O no hydrogen 3.412 N/A TRP 313.A N ILE 310.A O no hydrogen 3.288 N/A TRP 313.A NE1 SER 123.A OG no hydrogen 2.752 N/A TYR 314.A N ASN 311.A O no hydrogen 3.347 N/A GLU 318.A N ASP 315.A O no hydrogen 2.848 N/A HIS 331.A N GLN 58.A OE1 no hydrogen 3.365 N/A THR 332.A N GLU 335.A OE1 no hydrogen 2.996 N/A GLU 335.A N THR 332.A OG1 no hydrogen 3.242 N/A TRP 336.A N THR 332.A O no hydrogen 2.851 N/A TRP 336.A NE1 GLN 58.A OE1 no hydrogen 2.689 N/A LYS 337.A N ILE 333.A O no hydrogen 2.854 N/A LYS 337.A NZ GLU 93.A O no hydrogen 3.494 N/A LYS 337.A NZ PHE 95.A O no hydrogen 3.229 N/A GLU 338.A N GLU 334.A O no hydrogen 3.237 N/A LEU 339.A N GLU 335.A O no hydrogen 3.085 N/A ILE 340.A N TRP 336.A O no hydrogen 2.895 N/A TYR 341.A N LYS 337.A O no hydrogen 2.845 N/A LYS 342.A N GLU 338.A O no hydrogen 2.901 N/A GLU 343.A N LEU 339.A O no hydrogen 3.367 N/A VAL 344.A N ILE 340.A O no hydrogen 2.871 N/A MET 345.A N TYR 341.A O no hydrogen 2.853 N/A