Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3sgz_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 3.A N ASP 7.A OD2 no hydrogen 2.858 N/A ASP 7.A N CYS 4.A O no hydrogen 3.094 N/A PHE 8.A N CYS 4.A O no hydrogen 3.451 N/A LYS 9.A N LEU 5.A O no hydrogen 2.980 N/A LYS 9.A NZ TYR 34.A OH no hydrogen 3.049 N/A ALA 10.A N ALA 6.A O no hydrogen 3.037 N/A HIS 11.A N ASP 7.A O no hydrogen 2.983 N/A ALA 12.A N PHE 8.A O no hydrogen 2.825 N/A GLN 13.A N LYS 9.A O no hydrogen 3.236 N/A GLN 15.A N HIS 11.A O no hydrogen 3.113 N/A GLN 15.A N ALA 12.A O no hydrogen 3.043 N/A LEU 16.A N GLN 13.A O no hydrogen 3.405 N/A SER 17.A OG SER 20.A OG no hydrogen 3.081 N/A LYS 18.A NZ ASP 22.A OD2 no hydrogen 3.058 N/A SER 20.A N SER 17.A OG no hydrogen 3.043 N/A SER 20.A OG SER 17.A OG no hydrogen 3.081 N/A TRP 21.A N SER 17.A O no hydrogen 2.954 N/A ASP 22.A N LYS 18.A O no hydrogen 2.816 N/A PHE 23.A N THR 19.A O no hydrogen 3.069 N/A ILE 24.A N SER 20.A O no hydrogen 3.008 N/A GLU 25.A N TRP 21.A O no hydrogen 2.861 N/A GLY 26.A N ASP 22.A O no hydrogen 2.755 N/A ALA 28.A N GLY 234.A O no hydrogen 2.910 N/A ASP 29.A N ASN 163.A O no hydrogen 2.848 N/A GLY 31.A N ALA 28.A O no hydrogen 2.905 N/A ILE 32.A N ASP 238.A OD2 no hydrogen 2.904 N/A THR 33.A N ASP 238.A OD1 no hydrogen 2.812 N/A THR 33.A OG1 ASP 238.A OD1 no hydrogen 3.180 N/A THR 33.A OG1 VAL 240.A O no hydrogen 3.198 N/A TYR 34.A OH GLU 25.A OE2 no hydrogen 2.752 N/A SER 35.A OG GLY 31.A O no hydrogen 3.556 N/A GLU 36.A N ILE 32.A O no hydrogen 2.957 N/A ASN 37.A N THR 33.A O no hydrogen 2.890 N/A ASN 37.A ND2 ASN 231.A OD1 no hydrogen 2.969 N/A ILE 38.A N SER 35.A O no hydrogen 3.177 N/A ALA 39.A N SER 35.A O no hydrogen 3.071 N/A ALA 40.A N GLU 36.A O no hydrogen 2.813 N/A LYS 42.A N ILE 38.A O no hydrogen 3.088 N/A LYS 42.A NZ ASP 271.A OD1 no hydrogen 2.841 N/A ARG 43.A N ALA 39.A O no hydrogen 3.111 N/A ARG 43.A NH1 GLU 36.A OE2 no hydrogen 3.356 N/A ARG 43.A NH2 GLU 36.A OE1 no hydrogen 2.853 N/A ARG 43.A NH2 ASP 245.A OD2 no hydrogen 2.885 N/A ILE 44.A N PHE 41.A O no hydrogen 3.219 N/A ARG 45.A NH1 LYS 42.A O no hydrogen 2.748 N/A ARG 45.A NH2 LYS 42.A O no hydrogen 3.368 N/A ARG 47.A N LEU 331.A O no hydrogen 2.753 N/A ARG 47.A NH1 GLN 333.A OE1 no hydrogen 2.855 N/A ARG 49.A N SER 319.A O no hydrogen 2.958 N/A ARG 52.A NH1 GLY 320.A O no hydrogen 3.068 N/A SER 55.A N ASP 53.A OD1 no hydrogen 2.981 N/A SER 55.A OG ASP 53.A OD1 no hydrogen 2.689 N/A ASP 58.A N GLN 322.A O no hydrogen 2.906 N/A THR 59.A OG1 SER 69.A O no hydrogen 2.852 N/A ARG 60.A N ASP 58.A OD1 no hydrogen 2.976 N/A ARG 60.A NE ASP 58.A OD1 no hydrogen 2.875 N/A ARG 60.A NE ASP 58.A OD2 no hydrogen 3.399 N/A ARG 60.A NH2 ASP 58.A OD2 no hydrogen 2.774 N/A THR 61.A N ILE 68.A O no hydrogen 3.169 N/A ILE 63.A N GLN 66.A O no hydrogen 2.938 N/A GLN 64.A N GLU 259.A OE1 no hydrogen 2.884 N/A GLN 66.A N ILE 63.A O no hydrogen 2.909 N/A ILE 68.A N THR 61.A O no hydrogen 2.883 N/A SER 69.A N ASN 99.A O no hydrogen 2.923 N/A SER 69.A OG ALA 98.A O no hydrogen 2.604 N/A CYS 73.A N ILE 283.A O no hydrogen 2.837 N/A ILE 74.A N CYS 101.A O no hydrogen 2.968 N/A SER 75.A N LEU 285.A O no hydrogen 2.824 N/A SER 75.A OG ASP 263.A OD1 no hydrogen 2.743 N/A THR 77.A OG1 HIS 80.A NE2 no hydrogen 2.831 N/A PHE 79.A N TYR 107.A O no hydrogen 2.902 N/A HIS 80.A N GLU 88.A OE2 no hydrogen 2.912 N/A HIS 80.A ND1 THR 91.A OG1 no hydrogen 2.906 N/A HIS 80.A NE2 THR 77.A OG1 no hydrogen 2.831 N/A SER 81.A N.A SER 109.A OG no hydrogen 3.018 N/A SER 81.A N.B SER 109.A OG no hydrogen 3.011 N/A SER 81.A OG.A PRO 85.A O no hydrogen 3.251 N/A SER 81.A OG.B SER 109.A OG no hydrogen 2.589 N/A ILE 82.A N PHE 79.A O no hydrogen 3.036 N/A ALA 83.A N HIS 80.A O no hydrogen 2.956 N/A TRP 84.A N HIS 80.A O no hydrogen 3.204 N/A GLY 87.A N TRP 84.A O no hydrogen 2.841 N/A GLU 88.A N GLU 88.A OE1 no hydrogen 2.796 N/A LYS 89.A N ASP 86.A O no hydrogen 2.995 N/A THR 91.A N GLY 87.A O no hydrogen 3.259 N/A THR 91.A OG1 HIS 80.A ND1 no hydrogen 2.906 N/A THR 91.A OG1 GLY 87.A O no hydrogen 3.412 N/A ALA 92.A N GLU 88.A O no hydrogen 2.836 N/A ARG 93.A N LYS 89.A O no hydrogen 3.093 N/A ALA 94.A N SER 90.A O no hydrogen 3.107 N/A ALA 95.A N THR 91.A O no hydrogen 2.867 N/A GLN 96.A N ALA 92.A O no hydrogen 2.997 N/A GLU 97.A N ARG 93.A O no hydrogen 3.086 N/A ALA 98.A N ALA 94.A O no hydrogen 2.936 N/A ASN 99.A N GLN 96.A O no hydrogen 3.136 N/A ILE 100.A N ALA 95.A O no hydrogen 3.312 N/A TYR 102.A N PHE 123.A O no hydrogen 3.024 N/A VAL 103.A N ILE 74.A O no hydrogen 3.006 N/A ILE 104.A N.A TRP 125.A O no hydrogen 2.933 N/A ILE 104.A N.B TRP 125.A O no hydrogen 2.933 N/A SER 106.A N GLN 127.A OE1 no hydrogen 3.375 N/A TYR 107.A N SER 105.A OG no hydrogen 2.858 N/A SER 109.A N GLU 88.A OE1 no hydrogen 3.195 N/A SER 109.A N GLU 88.A OE2 no hydrogen 2.800 N/A SER 109.A OG SER 81.A OG.B no hydrogen 2.589 N/A TYR 110.A N GLU 88.A OE1 no hydrogen 3.294 N/A TYR 110.A OH PRO 85.A O no hydrogen 2.728 N/A ASP 114.A N SER 111.A OG no hydrogen 3.157 N/A ILE 115.A N SER 111.A O no hydrogen 3.020 N/A VAL 116.A N LEU 112.A O no hydrogen 2.932 N/A ALA 117.A N GLU 113.A O no hydrogen 2.979 N/A ALA 118.A N ASP 114.A O no hydrogen 3.260 N/A ALA 118.A N ILE 115.A O no hydrogen 3.135 N/A ALA 119.A N VAL 116.A O no hydrogen 3.074 N/A GLY 122.A N ALA 119.A O no hydrogen 3.077 N/A ARG 124.A NH1 ALA 119.A O no hydrogen 2.666 N/A ARG 124.A NH2 ALA 119.A O no hydrogen 2.956 N/A ARG 124.A NH2 PRO 120.A O no hydrogen 3.397 N/A TRP 125.A N TYR 102.A O no hydrogen 2.981 N/A PHE 126.A N ALA 151.A O no hydrogen 2.966 N/A GLN 127.A N ILE 104.A O.A no hydrogen 2.862 N/A GLN 127.A N ILE 104.A O.B no hydrogen 2.862 N/A LEU 128.A N VAL 153.A O no hydrogen 3.162 N/A TYR 129.A N SER 106.A OG no hydrogen 3.096 N/A TYR 129.A OH THR 158.A OG1.B no hydrogen 3.088 N/A ASP 135.A N ASP 133.A OD2 no hydrogen 2.707 N/A PHE 136.A N ASP 133.A OD2 no hydrogen 3.445 N/A ASN 137.A N ASP 133.A O no hydrogen 3.180 N/A LYS 138.A N TRP 134.A O no hydrogen 2.974 N/A GLN 139.A N ASP 135.A O no hydrogen 3.051 N/A MET 140.A N PHE 136.A O no hydrogen 2.876 N/A VAL 141.A N ASN 137.A O no hydrogen 3.029 N/A GLN 142.A N LYS 138.A O no hydrogen 2.947 N/A ARG 143.A N GLN 139.A O no hydrogen 2.906 N/A ALA 144.A N MET 140.A O no hydrogen 2.924 N/A GLU 145.A N VAL 141.A O no hydrogen 3.002 N/A ALA 146.A N GLN 142.A O no hydrogen 2.921 N/A LEU 147.A N ARG 143.A O no hydrogen 3.008 N/A GLY 148.A N GLU 145.A O no hydrogen 3.036 N/A PHE 149.A N ALA 144.A O no hydrogen 3.080 N/A LYS 150.A N ARG 124.A O no hydrogen 2.907 N/A LYS 150.A NZ GLY 148.A O no hydrogen 2.768 N/A LEU 152.A N PRO 204.A O no hydrogen 2.922 N/A VAL 153.A N PHE 126.A O no hydrogen 2.793 N/A ILE 154.A N ILE 206.A O no hydrogen 2.926 N/A ILE 156.A N LYS 208.A O no hydrogen 2.887 N/A THR 158.A OG1.A ASP 157.A OD2 no hydrogen 2.915 N/A THR 158.A OG1.B TYR 129.A OH no hydrogen 3.088 N/A ARG 164.A NE ARG 235.A O no hydrogen 2.926 N/A ARG 164.A NH2 ARG 235.A O no hydrogen 3.286 N/A ARG 165.A NH1 ASP 30.A OD2 no hydrogen 3.069 N/A ARG 165.A NH2 ASP 30.A OD2 no hydrogen 3.024 N/A ARG 166.A NH1 ASP 22.A OD2 no hydrogen 3.155 N/A LYS 168.A N ARG 164.A O no hydrogen 3.054 N/A ARG 169.A N ARG 165.A O no hydrogen 2.955 N/A ASN 170.A N ARG 166.A O no hydrogen 2.913 N/A ASN 170.A ND2 ASP 22.A OD2 no hydrogen 2.942 N/A GLN 171.A N ASP 167.A O no hydrogen 2.862 N/A LEU 172.A N LYS 168.A O no hydrogen 3.116 N/A ASN 173.A N ARG 169.A O no hydrogen 3.172 N/A ASN 173.A N ASN 170.A O no hydrogen 3.264 N/A LEU 174.A N ASN 170.A O no hydrogen 2.995 N/A ILE 178.A N GLU 175.A O no hydrogen 2.991 N/A LEU 179.A N GLU 175.A O no hydrogen 3.114 N/A LYS 180.A N ALA 176.A O no hydrogen 2.962 N/A ALA 181.A N ILE 178.A O no hydrogen 3.457 N/A LYS 186.A NZ MET 130.A O no hydrogen 2.992 N/A ALA 187.A N PRO 185.A O no hydrogen 2.952 N/A CYS 190.A N ASP 193.A OD1 no hydrogen 2.896 N/A CYS 190.A SG SER 188.A O no hydrogen 3.769 N/A CYS 190.A SG ASP 193.A OD1 no hydrogen 3.535 N/A LEU 194.A N CYS 190.A O no hydrogen 3.094 N/A SER 195.A N TRP 191.A O no hydrogen 3.144 N/A LEU 196.A N ASN 192.A O no hydrogen 3.243 N/A LEU 197.A N ASP 193.A O no hydrogen 2.890 N/A GLN 198.A N LEU 194.A O no hydrogen 2.893 N/A GLN 198.A NE2 HIS 222.A O no hydrogen 2.885 N/A SER 199.A N SER 195.A O no hydrogen 3.104 N/A SER 199.A N LEU 196.A O no hydrogen 2.972 N/A SER 199.A OG LEU 196.A O no hydrogen 2.649 N/A ILE 200.A N LEU 197.A O no hydrogen 3.030 N/A LEU 203.A N THR 201.A OG1 no hydrogen 3.111 N/A ILE 206.A N LEU 152.A O no hydrogen 2.874 N/A LEU 207.A N GLY 226.A O no hydrogen 2.999 N/A LYS 208.A N ILE 154.A O no hydrogen 2.833 N/A GLY 209.A N VAL 228.A O no hydrogen 2.912 N/A LYS 213.A N GLU 249.A OE2 no hydrogen 2.867 N/A GLU 214.A N GLU 214.A OE2 no hydrogen 2.808 N/A ASP 215.A N THR 212.A OG1 no hydrogen 3.164 N/A ALA 216.A N THR 212.A O no hydrogen 2.985 N/A GLU 217.A N LYS 213.A O no hydrogen 2.901 N/A LEU 218.A N GLU 214.A O no hydrogen 3.071 N/A ALA 219.A N ASP 215.A O no hydrogen 2.847 N/A MET 220.A N ALA 216.A O no hydrogen 3.030 N/A LYS 221.A N GLU 217.A O no hydrogen 2.987 N/A HIS 222.A N LEU 218.A O no hydrogen 2.987 N/A HIS 222.A N ALA 219.A O no hydrogen 3.199 N/A ASN 223.A N MET 220.A O no hydrogen 2.984 N/A VAL 224.A N ALA 219.A O no hydrogen 3.345 N/A GLN 225.A N ILE 205.A O no hydrogen 2.914 N/A ILE 227.A N GLU 259.A O no hydrogen 3.090 N/A VAL 228.A N LEU 207.A O no hydrogen 2.766 N/A VAL 229.A N TYR 261.A O no hydrogen 2.792 N/A SER 230.A OG ASP 263.A OD1 no hydrogen 3.554 N/A SER 230.A OG ASP 263.A OD2 no hydrogen 2.612 N/A ASN 231.A ND2 ASN 37.A OD1 no hydrogen 2.855 N/A ASN 231.A ND2 SER 241.A O no hydrogen 2.928 N/A HIS 232.A N SER 230.A OG no hydrogen 2.979 N/A HIS 232.A ND1 ASP 157.A OD2 no hydrogen 2.810 N/A GLY 234.A N ASN 231.A O no hydrogen 3.157 N/A GLY 234.A N ASN 231.A OD1 no hydrogen 3.191 N/A ARG 235.A N HIS 232.A O no hydrogen 3.107 N/A ARG 235.A NH1 PHE 23.A O no hydrogen 2.843 N/A ARG 235.A NH1 GLU 25.A O no hydrogen 2.924 N/A ARG 235.A NH2 PHE 23.A O no hydrogen 2.970 N/A GLU 239.A N THR 33.A OG1 no hydrogen 2.882 N/A VAL 240.A N THR 33.A OG1 no hydrogen 3.200 N/A SER 243.A N ASN 37.A OD1 no hydrogen 3.167 N/A SER 243.A OG ASP 263.A O no hydrogen 2.642 N/A ASP 245.A N ALA 242.A O no hydrogen 3.046 N/A ALA 246.A N ALA 242.A O no hydrogen 2.967 N/A LEU 247.A N SER 243.A O no hydrogen 2.933 N/A ARG 248.A N ASP 245.A O no hydrogen 3.171 N/A ARG 248.A NH2 SER 335.A OG no hydrogen 3.390 N/A VAL 250.A N ALA 246.A O no hydrogen 3.214 N/A VAL 251.A N LEU 247.A O no hydrogen 2.885 N/A ALA 252.A N ARG 248.A O no hydrogen 3.010 N/A ALA 253.A N GLU 249.A O no hydrogen 3.039 N/A VAL 254.A N VAL 250.A O no hydrogen 2.920 N/A LYS 255.A N VAL 251.A O no hydrogen 2.938 N/A LYS 257.A N VAL 254.A O no hydrogen 3.043 N/A LYS 257.A NZ MET 220.A O no hydrogen 2.887 N/A TYR 261.A N ILE 227.A O no hydrogen 2.758 N/A TYR 261.A OH GLN 64.A OE1 no hydrogen 2.944 N/A TYR 261.A OH GLU 259.A OE1 no hydrogen 2.608 N/A MET 262.A N CYS 282.A O.A no hydrogen 3.262 N/A MET 262.A N CYS 282.A O.B no hydrogen 3.214 N/A ASP 263.A N VAL 229.A O no hydrogen 3.052 N/A ARG 267.A N ASP 271.A OD2 no hydrogen 2.868 N/A ARG 267.A NH1 VAL 266.A O no hydrogen 2.846 N/A THR 268.A N ASP 271.A OD2 no hydrogen 2.968 N/A THR 268.A OG1 GLU 311.A OE2 no hydrogen 2.584 N/A GLY 269.A N GLU 311.A OE2 no hydrogen 2.762 N/A ASP 271.A N THR 268.A O no hydrogen 2.904 N/A VAL 272.A N THR 268.A O no hydrogen 3.427 N/A LEU 273.A N GLY 269.A O no hydrogen 2.947 N/A LYS 274.A N THR 270.A O no hydrogen 2.859 N/A LYS 274.A NZ PHE 41.A O no hydrogen 2.739 N/A LYS 274.A NZ ILE 44.A O no hydrogen 2.737 N/A ALA 275.A N ASP 271.A O no hydrogen 2.997 N/A LEU 276.A N VAL 272.A O no hydrogen 2.974 N/A ALA 277.A N LEU 273.A O no hydrogen 2.847 N/A LEU 278.A N LYS 274.A O no hydrogen 2.978 N/A GLY 279.A N LEU 276.A O no hydrogen 3.092 N/A ALA 280.A N ALA 275.A O no hydrogen 2.936 N/A ARG 281.A N VAL 260.A O no hydrogen 2.763 N/A ARG 281.A NE THR 62.A O no hydrogen 2.890 N/A ARG 281.A NH2 THR 62.A O no hydrogen 3.565 N/A ARG 281.A NH2 THR 62.A OG1 no hydrogen 2.887 N/A CYS 282.A SG.A ILE 283.A O no hydrogen 3.792 N/A CYS 282.A SG.B ILE 283.A O no hydrogen 3.580 N/A ILE 283.A N PRO 71.A O no hydrogen 2.961 N/A PHE 284.A N MET 262.A O no hydrogen 2.868 N/A LEU 285.A N CYS 73.A O no hydrogen 2.769 N/A ARG 287.A NE ILE 24.A O no hydrogen 2.964 N/A ARG 287.A NE GLU 25.A O no hydrogen 3.185 N/A ARG 287.A NH2 GLU 25.A O no hydrogen 2.793 N/A ARG 287.A NH2 GLY 233.A O no hydrogen 2.842 N/A ILE 289.A N GLY 286.A O no hydrogen 3.192 N/A TRP 291.A N ARG 287.A O no hydrogen 2.918 N/A GLY 292.A N PRO 288.A O no hydrogen 2.918 N/A LEU 293.A N ILE 289.A O no hydrogen 2.976 N/A ALA 294.A N LEU 290.A O no hydrogen 2.892 N/A CYS 295.A N TRP 291.A O no hydrogen 3.067 N/A CYS 295.A SG PHE 8.A O no hydrogen 3.556 N/A CYS 295.A SG HIS 11.A ND1 no hydrogen 3.296 N/A CYS 295.A SG TRP 291.A O no hydrogen 3.381 N/A LYS 296.A N GLY 292.A O no hydrogen 3.002 N/A LYS 296.A NZ GLU 303.A OE1 no hydrogen 2.738 N/A GLY 297.A N LEU 293.A O no hydrogen 2.823 N/A GLY 300.A N LYS 296.A O no hydrogen 3.347 N/A VAL 301.A N GLY 297.A O no hydrogen 3.132 N/A LYS 302.A N GLU 298.A O no hydrogen 2.943 N/A LYS 302.A NZ ASP 306.A OD1 no hydrogen 3.036 N/A LYS 302.A NZ ASP 306.A OD2 no hydrogen 2.924 N/A GLU 303.A N ASP 299.A O no hydrogen 2.894 N/A VAL 304.A N GLY 300.A O no hydrogen 2.978 N/A LEU 305.A N VAL 301.A O no hydrogen 2.998 N/A ASP 306.A N LYS 302.A O no hydrogen 2.833 N/A ILE 307.A N GLU 303.A O no hydrogen 2.739 N/A LEU 308.A N VAL 304.A O no hydrogen 2.999 N/A THR 309.A N LEU 305.A O no hydrogen 2.960 N/A THR 309.A OG1 LEU 305.A O no hydrogen 2.766 N/A ALA 310.A N ASP 306.A O no hydrogen 2.865 N/A GLU 311.A N ILE 307.A O no hydrogen 2.888 N/A LEU 312.A N LEU 308.A O no hydrogen 2.911 N/A HIS 313.A N THR 309.A O no hydrogen 2.879 N/A ARG 314.A N ALA 310.A O no hydrogen 2.928 N/A CYS 315.A N GLU 311.A O no hydrogen 2.924 N/A CYS 315.A SG GLU 311.A O no hydrogen 3.540 N/A CYS 315.A SG LEU 312.A O no hydrogen 3.640 N/A MET 316.A N LEU 312.A O no hydrogen 2.910 N/A THR 317.A N HIS 313.A O no hydrogen 2.972 N/A THR 317.A OG1 HIS 313.A O no hydrogen 2.796 N/A LEU 318.A N ARG 314.A O no hydrogen 2.864 N/A SER 319.A N CYS 315.A O no hydrogen 2.884 N/A SER 319.A OG CYS 315.A O no hydrogen 2.743 N/A SER 319.A OG MET 316.A O no hydrogen 3.440 N/A GLY 320.A N MET 316.A O no hydrogen 3.006 N/A CYS 321.A N MET 316.A O no hydrogen 2.916 N/A CYS 321.A SG SER 319.A OG no hydrogen 3.554 N/A CYS 321.A SG GLU 326.A O no hydrogen 3.917 N/A GLN 322.A N GLU 326.A OE2 no hydrogen 2.781 N/A GLN 322.A NE2 LYS 56.A O no hydrogen 2.965 N/A GLU 326.A N SER 323.A O no hydrogen 2.941 N/A ILE 327.A N VAL 324.A O no hydrogen 3.070 N/A ASP 330.A N SER 328.A OG no hydrogen 3.150 N/A LEU 331.A N SER 328.A O no hydrogen 3.051 N/A ILE 332.A N PRO 329.A O no hydrogen 2.949 N/A GLN 333.A N ARG 45.A O no hydrogen 2.904 N/A SER 335.A OG GLN 333.A O no hydrogen 2.980 N/A SER 335.A OG PHE 334.A O no hydrogen 2.238 N/A ARG 336.A NE ASP 330.A O no hydrogen 3.231 N/A