Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4z9l_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 3.A N ASP 1.A OD1 no hydrogen 3.059 N/A GLN 3.A NE2 ASP 1.A OD1 no hydrogen 3.154 N/A PHE 4.A N ASP 1.A O no hydrogen 3.174 N/A TYR 5.A N VAL 16.A O no hydrogen 2.926 N/A TYR 5.A OH TYR 20.A O no hydrogen 2.642 N/A SER 6.A OG THR 15.A OG1 no hydrogen 2.682 N/A VAL 7.A N PHE 14.A O no hydrogen 2.876 N/A VAL 9.A N SER 12.A O no hydrogen 2.761 N/A SER 12.A N VAL 9.A O no hydrogen 2.894 N/A THR 13.A OG1 GLU 8.A OE2 no hydrogen 2.903 N/A PHE 14.A N VAL 7.A O no hydrogen 2.892 N/A THR 15.A N TYR 99.A OH no hydrogen 2.976 N/A THR 15.A OG1 SER 6.A OG no hydrogen 2.682 N/A VAL 16.A N TYR 5.A O no hydrogen 3.029 N/A LYS 18.A N GLN 3.A O no hydrogen 2.915 N/A LYS 18.A NZ ASN 2.A O no hydrogen 2.780 N/A ARG 19.A NE ASP 39.A OD1 no hydrogen 2.920 N/A ARG 19.A NH2 ASP 39.A OD1 no hydrogen 3.271 N/A ARG 19.A NH2 ASP 39.A OD2 no hydrogen 2.722 N/A TYR 20.A N LEU 17.A O no hydrogen 3.074 N/A GLN 21.A N TYR 38.A O no hydrogen 2.771 N/A GLN 21.A NE2 LYS 18.A O no hydrogen 3.310 N/A LYS 24.A N ALA 36.A O no hydrogen 2.884 N/A ILE 26.A N VAL 34.A O no hydrogen 2.878 N/A GLY 29.A N GLY 32.A O no hydrogen 3.106 N/A GLN 31.A NE2 GLU 67.A OE1.A no hydrogen 2.829 N/A VAL 34.A N GLY 27.A O no hydrogen 2.800 N/A CYS 35.A N ILE 48.A O no hydrogen 2.871 N/A ALA 36.A N LYS 24.A O no hydrogen 2.791 N/A ALA 37.A N VAL 46.A O no hydrogen 2.869 N/A TYR 38.A N GLN 21.A O no hydrogen 2.808 N/A TYR 38.A OH ASP 43.A OD1 no hydrogen 2.697 N/A ASP 39.A N ARG 44.A O no hydrogen 2.814 N/A ALA 40.A N ARG 19.A O no hydrogen 2.799 N/A VAL 41.A N ASP 39.A OD1 no hydrogen 2.922 N/A LEU 42.A N ASP 39.A OD1 no hydrogen 3.281 N/A ASP 43.A N ASP 39.A O no hydrogen 2.847 N/A ARG 44.A N ASP 39.A O no hydrogen 3.362 N/A VAL 46.A N ALA 37.A O no hydrogen 2.744 N/A ALA 47.A N MET 102.A O no hydrogen 2.865 N/A ILE 48.A N CYS 35.A O no hydrogen 2.789 N/A LYS 49.A N LEU 100.A O no hydrogen 2.865 N/A LYS 49.A NZ GLN 31.A OE1 no hydrogen 2.723 N/A LYS 50.A N ILE 33.A O no hydrogen 2.969 N/A LYS 50.A NZ SER 12.A OG no hydrogen 3.082 N/A LYS 50.A NZ THR 13.A O no hydrogen 2.804 N/A LEU 51.A N VAL 98.A O no hydrogen 2.752 N/A ARG 53.A N GLN 96.A O no hydrogen 2.921 N/A ARG 53.A NH1 GLN 96.A OE1 no hydrogen 2.848 N/A GLN 56.A N ARG 53.A O no hydrogen 2.975 N/A GLN 56.A NE2 SER 52.A O no hydrogen 2.903 N/A GLN 56.A NE2 ARG 53.A O no hydrogen 3.040 N/A GLN 58.A NE2 HIS 318.A O no hydrogen 2.801 N/A HIS 60.A N ASN 57.A OD1 no hydrogen 3.039 N/A ALA 61.A N ASN 57.A O no hydrogen 2.934 N/A LYS 62.A N GLN 58.A O no hydrogen 2.915 N/A ARG 63.A N THR 59.A O no hydrogen 3.307 N/A ARG 63.A NE GLU 67.A OE2.A no hydrogen 2.701 N/A ARG 63.A NH2 GLU 67.A OE2.A no hydrogen 3.397 N/A ALA 64.A N HIS 60.A O no hydrogen 2.883 N/A TYR 65.A N ALA 61.A O no hydrogen 2.853 N/A ARG 66.A N LYS 62.A O no hydrogen 2.839 N/A ARG 66.A NH1 PHE 164.A O no hydrogen 3.263 N/A ARG 66.A NH2 PHE 164.A O no hydrogen 3.199 N/A GLU 67.A N ARG 63.A O no hydrogen 2.948 N/A LEU 68.A N ALA 64.A O no hydrogen 3.118 N/A VAL 69.A N TYR 65.A O no hydrogen 3.075 N/A LEU 70.A N ARG 66.A O no hydrogen 2.892 N/A MET 71.A N GLU 67.A O no hydrogen 2.888 N/A LYS 72.A N VAL 69.A O no hydrogen 3.121 N/A CYS 73.A N VAL 69.A O no hydrogen 3.130 N/A ASN 75.A N HIS 135.A NE2 no hydrogen 3.398 N/A HIS 76.A NE2 GLU 311.A O no hydrogen 2.787 N/A LYS 77.A NZ GLU 311.A OE2 no hydrogen 2.761 N/A ASN 78.A N HIS 76.A ND1 no hydrogen 2.894 N/A ASN 78.A ND2 GLN 128.A OE1 no hydrogen 3.139 N/A ASN 78.A ND2 LEU 159.A O no hydrogen 2.958 N/A ILE 79.A N HIS 76.A O no hydrogen 3.120 N/A ILE 80.A N ILE 161.A O no hydrogen 2.877 N/A LEU 83.A N VAL 101.A O no hydrogen 2.770 N/A ASN 84.A N VAL 101.A O no hydrogen 3.384 N/A ASN 84.A ND2 TYR 20.A OH no hydrogen 2.896 N/A VAL 85.A N ASN 84.A OD1 no hydrogen 2.992 N/A PHE 86.A N TYR 99.A O no hydrogen 2.963 N/A THR 87.A OG1 ASP 97.A O no hydrogen 2.738 N/A GLN 89.A N THR 87.A OG1 no hydrogen 3.302 N/A THR 91.A OG1 GLU 94.A OE2 no hydrogen 2.918 N/A GLU 94.A N THR 91.A OG1 no hydrogen 3.205 N/A PHE 95.A N THR 91.A O no hydrogen 2.767 N/A PHE 95.A N LEU 92.A O no hydrogen 3.228 N/A GLN 96.A N GLN 89.A OE1 no hydrogen 2.792 N/A ASP 97.A N GLN 89.A OE1 no hydrogen 2.846 N/A VAL 98.A N LEU 51.A O no hydrogen 3.078 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 2.885 N/A VAL 101.A N ASN 84.A O no hydrogen 2.860 N/A MET 102.A N ALA 47.A O no hydrogen 3.103 N/A LEU 104.A N ASN 45.A O no hydrogen 3.116 N/A ASP 106.A N VAL 153.A O no hydrogen 3.006 N/A ALA 107.A N VAL 153.A O no hydrogen 3.073 N/A ASN 108.A N GLN 111.A OE1 no hydrogen 2.983 N/A LEU 109.A N ILE 151.A O no hydrogen 2.802 N/A GLN 111.A N ASN 108.A OD1 no hydrogen 3.029 N/A VAL 112.A N ASN 108.A O no hydrogen 3.450 N/A ILE 113.A N LEU 109.A O no hydrogen 2.809 N/A GLN 114.A N CYS 110.A O no hydrogen 3.198 N/A GLN 114.A N GLN 111.A O no hydrogen 3.174 N/A MET 115.A N VAL 112.A O no hydrogen 3.090 N/A HIS 119.A ND1 TYR 302.A OH no hydrogen 2.798 N/A GLU 120.A N ASP 118.A OD2 no hydrogen 3.162 N/A ARG 121.A N ASP 118.A OD2 no hydrogen 3.458 N/A ARG 121.A NH1 ASP 118.A OD1 no hydrogen 2.863 N/A MET 122.A N ASP 118.A O no hydrogen 2.970 N/A SER 123.A N HIS 119.A O no hydrogen 2.805 N/A SER 123.A OG HIS 119.A O no hydrogen 2.753 N/A SER 123.A OG GLU 120.A O no hydrogen 3.149 N/A TYR 124.A N GLU 120.A O no hydrogen 2.916 N/A LEU 125.A N ARG 121.A O no hydrogen 2.957 N/A LEU 126.A N MET 122.A O no hydrogen 3.178 N/A TYR 127.A N SER 123.A O no hydrogen 2.890 N/A TYR 127.A OH GLU 311.A OE1 no hydrogen 2.680 N/A GLN 128.A N TYR 124.A O no hydrogen 3.003 N/A GLN 128.A NE2 TYR 124.A O no hydrogen 3.383 N/A GLN 128.A NE2 CYS 157.A O no hydrogen 2.809 N/A MET 129.A N LEU 125.A O no hydrogen 3.003 N/A LEU 130.A N LEU 126.A O no hydrogen 2.961 N/A CYS 131.A N TYR 127.A O no hydrogen 2.897 N/A CYS 131.A SG TYR 127.A O no hydrogen 3.336 N/A GLY 132.A N GLN 128.A O no hydrogen 2.928 N/A ILE 133.A N MET 129.A O no hydrogen 2.816 N/A LYS 134.A N LEU 130.A O no hydrogen 2.839 N/A LYS 134.A NZ ASP 295.A OD1 no hydrogen 2.819 N/A HIS 135.A N CYS 131.A O no hydrogen 3.029 N/A LEU 136.A N GLY 132.A O no hydrogen 3.128 N/A HIS 137.A N ILE 133.A O no hydrogen 2.928 N/A HIS 137.A NE2 ASP 191.A OD2 no hydrogen 2.814 N/A SER 138.A N LYS 134.A O no hydrogen 3.025 N/A SER 138.A OG HIS 135.A O no hydrogen 2.760 N/A ALA 139.A N LEU 136.A O no hydrogen 3.117 N/A GLY 140.A N HIS 137.A O no hydrogen 2.951 N/A ILE 141.A N LEU 136.A O no hydrogen 2.813 N/A HIS 143.A N ASP 191.A OD2 no hydrogen 3.159 N/A HIS 143.A NE2 ASP 163.A O no hydrogen 3.081 N/A HIS 143.A NE2 ASP 163.A OD1 no hydrogen 2.828 N/A ARG 144.A N ASP 191.A OD1 no hydrogen 2.786 N/A ASP 145.A N HIS 143.A ND1 no hydrogen 3.125 N/A LYS 147.A NZ ASP 145.A OD1 no hydrogen 3.454 N/A LYS 147.A NZ ASP 145.A OD2 no hydrogen 2.989 N/A LYS 147.A NZ THR 172.A O no hydrogen 3.432 N/A ASN 150.A N LYS 147.A O no hydrogen 3.088 N/A ILE 151.A N PRO 148.A O no hydrogen 3.180 N/A VAL 152.A N LYS 160.A O no hydrogen 2.993 N/A VAL 153.A N ALA 107.A O no hydrogen 2.812 N/A LYS 154.A N THR 158.A O no hydrogen 2.989 N/A LYS 154.A NZ GLU 103.A OE2 no hydrogen 2.824 N/A SER 155.A N ASP 106.A OD2 no hydrogen 2.781 N/A SER 155.A OG ASP 106.A OD2 no hydrogen 3.207 N/A CYS 157.A N LYS 154.A O no hydrogen 2.928 N/A CYS 157.A SG ARG 121.A O no hydrogen 3.942 N/A THR 158.A N ASP 156.A OD1 no hydrogen 3.171 N/A THR 158.A OG1 ASP 156.A OD1 no hydrogen 2.691 N/A LEU 159.A N GLN 128.A OE1 no hydrogen 2.907 N/A LYS 160.A N VAL 152.A O no hydrogen 2.999 N/A LYS 160.A NZ LYS 77.A O no hydrogen 2.966 N/A ILE 161.A N ASN 78.A O no hydrogen 2.946 N/A LEU 162.A N ASN 150.A O no hydrogen 2.836 N/A PHE 164.A N GLU 67.A OE1.B no hydrogen 3.129 N/A GLY 165.A N ASP 163.A OD2 no hydrogen 3.339 N/A LEU 166.A N HIS 143.A O no hydrogen 2.968 N/A TYR 175.A OH GLU 201.A OE1 no hydrogen 2.650 N/A ARG 176.A N ARG 173.A O no hydrogen 3.050 N/A ARG 176.A NE ASP 145.A OD1 no hydrogen 3.044 N/A ARG 176.A NH1 TYR 214.A OH no hydrogen 2.989 N/A ARG 176.A NH2 ASP 145.A OD2 no hydrogen 2.929 N/A GLU 179.A N GLU 179.A OE1 no hydrogen 2.768 N/A VAL 180.A N ALA 177.A O no hydrogen 2.815 N/A ILE 181.A N ALA 177.A O no hydrogen 3.003 N/A LEU 182.A N PRO 178.A O no hydrogen 2.945 N/A GLY 183.A N VAL 180.A O no hydrogen 3.423 N/A MET 184.A N GLU 179.A O no hydrogen 2.961 N/A GLU 188.A N GLU 188.A OE1 no hydrogen 2.851 N/A ASN 189.A ND2 PRO 288.A O no hydrogen 2.740 N/A ASN 189.A ND2 ARG 291.A O no hydrogen 2.985 N/A VAL 190.A N LYS 187.A O no hydrogen 3.166 N/A ASP 191.A N GLU 188.A O no hydrogen 3.228 N/A ILE 192.A N ASN 189.A O no hydrogen 3.030 N/A SER 194.A OG TYR 175.A O no hydrogen 2.681 N/A VAL 195.A N ASP 191.A O no hydrogen 3.167 N/A GLY 196.A N ILE 192.A O no hydrogen 2.943 N/A CYS 197.A N TRP 193.A O no hydrogen 2.932 N/A CYS 197.A SG TRP 193.A O no hydrogen 3.372 N/A ILE 198.A N SER 194.A O no hydrogen 2.964 N/A MET 199.A N VAL 195.A O no hydrogen 2.773 N/A GLY 200.A N GLY 196.A O no hydrogen 2.795 N/A GLU 201.A N CYS 197.A O no hydrogen 2.978 N/A MET 202.A N ILE 198.A O no hydrogen 2.810 N/A VAL 203.A N MET 199.A O no hydrogen 3.208 N/A ARG 204.A N GLY 200.A O no hydrogen 2.905 N/A ARG 204.A NE LEU 258.A O no hydrogen 3.339 N/A ARG 204.A NH1 GLN 224.A OE1 no hydrogen 2.833 N/A ARG 204.A NH2 GLN 224.A OE1 no hydrogen 2.867 N/A ARG 204.A NH2 LEU 258.A O no hydrogen 3.244 N/A HIS 205.A N GLU 201.A O no hydrogen 2.812 N/A HIS 205.A ND1 ILE 113.A O no hydrogen 2.691 N/A GLY 211.A N PHE 209.A O no hydrogen 3.015 N/A ARG 212.A N ASP 216.A OD2 no hydrogen 2.976 N/A ASP 216.A N ASP 213.A OD1 no hydrogen 2.872 N/A GLN 217.A N ASP 213.A O no hydrogen 2.830 N/A TRP 218.A N TYR 214.A O no hydrogen 2.883 N/A ASN 219.A N ILE 215.A O no hydrogen 3.096 N/A LYS 220.A N ASP 216.A O no hydrogen 3.067 N/A LYS 220.A NZ ASP 216.A OD1 no hydrogen 2.876 N/A LYS 220.A NZ ASP 216.A OD2 no hydrogen 3.220 N/A VAL 221.A N GLN 217.A O no hydrogen 3.169 N/A ILE 222.A N TRP 218.A O no hydrogen 3.141 N/A GLU 223.A N ASN 219.A O no hydrogen 2.879 N/A GLN 224.A N VAL 221.A O no hydrogen 3.272 N/A GLN 224.A NE2 LEU 208.A O no hydrogen 2.959 N/A GLN 224.A NE2 LYS 220.A O no hydrogen 3.552 N/A LEU 225.A N VAL 221.A O no hydrogen 2.924 N/A GLY 226.A N ILE 222.A O no hydrogen 2.830 N/A THR 227.A N TYR 250.A O no hydrogen 2.848 N/A THR 227.A OG1 TYR 250.A O no hydrogen 3.250 N/A CYS 229.A SG ASP 287.A OD2 no hydrogen 3.519 N/A PHE 232.A N CYS 229.A O no hydrogen 3.199 N/A MET 233.A N CYS 229.A O no hydrogen 3.478 N/A LYS 234.A N PRO 230.A O no hydrogen 3.032 N/A LYS 235.A N PHE 232.A O no hydrogen 3.063 N/A LYS 235.A NZ ASP 287.A OD1 no hydrogen 2.792 N/A LEU 236.A N MET 233.A O no hydrogen 3.137 N/A ARG 241.A N GLN 237.A O no hydrogen 2.797 N/A ASN 242.A N PRO 238.A O no hydrogen 2.962 N/A TYR 243.A N THR 239.A O no hydrogen 3.188 N/A VAL 244.A N VAL 240.A O no hydrogen 2.831 N/A GLU 245.A N ARG 241.A O no hydrogen 2.925 N/A ASN 246.A N ASN 242.A O no hydrogen 2.998 N/A ARG 247.A N VAL 244.A O no hydrogen 3.439 N/A TYR 250.A N THR 227.A OG1 no hydrogen 2.839 N/A LEU 253.A N GLN 224.A O no hydrogen 2.799 N/A LYS 257.A N THR 254.A OG1 no hydrogen 3.322 N/A LEU 258.A N THR 254.A O no hydrogen 2.813 N/A PHE 259.A N PHE 255.A O no hydrogen 2.816 N/A LEU 263.A N PRO 260.A O no hydrogen 2.932 N/A PHE 264.A N ASP 261.A O no hydrogen 2.780 N/A ASN 269.A N SER 266.A OG no hydrogen 3.205 N/A LYS 270.A N SER 266.A O no hydrogen 3.103 N/A LEU 271.A N GLU 267.A O no hydrogen 2.980 N/A LYS 272.A N HIS 268.A O no hydrogen 2.999 N/A LYS 272.A NZ GLN 275.A OE1 no hydrogen 2.802 N/A ALA 273.A N ASN 269.A O no hydrogen 2.793 N/A SER 274.A N LYS 270.A O no hydrogen 3.153 N/A GLN 275.A N LEU 271.A O no hydrogen 2.947 N/A ALA 276.A N LYS 272.A O no hydrogen 2.841 N/A ARG 277.A N ALA 273.A O no hydrogen 3.042 N/A ARG 277.A NE PHE 259.A O no hydrogen 3.158 N/A ARG 277.A NH2 PHE 259.A O no hydrogen 3.093 N/A ASP 278.A N SER 274.A O no hydrogen 3.125 N/A LEU 279.A N GLN 275.A O no hydrogen 3.024 N/A LEU 280.A N ALA 276.A O no hydrogen 2.975 N/A SER 281.A N ARG 277.A O no hydrogen 2.916 N/A SER 281.A OG ASP 278.A O no hydrogen 2.719 N/A LYS 282.A N LEU 279.A O no hydrogen 3.012 N/A MET 283.A N LEU 279.A O no hydrogen 3.087 N/A MET 283.A N LEU 280.A O no hydrogen 3.283 N/A LEU 284.A N LEU 280.A O no hydrogen 2.977 N/A ALA 289.A N ASP 287.A OD1 no hydrogen 3.254 N/A LYS 290.A N ASP 287.A O no hydrogen 3.025 N/A LYS 290.A NZ ASP 287.A OD2 no hydrogen 2.818 N/A ARG 291.A N PRO 288.A O no hydrogen 3.445 N/A ARG 291.A NE VAL 285.A O no hydrogen 2.839 N/A ARG 291.A NH1 GLU 179.A OE1 no hydrogen 3.436 N/A ARG 291.A NH1 GLU 179.A OE2 no hydrogen 2.800 N/A ARG 291.A NH1 ASN 189.A O no hydrogen 2.912 N/A ARG 291.A NH2 GLU 179.A OE1 no hydrogen 2.830 N/A ARG 291.A NH2 VAL 285.A O no hydrogen 3.170 N/A ARG 291.A NH2 ILE 286.A O no hydrogen 2.957 N/A ILE 292.A N LYS 282.A O no hydrogen 3.186 N/A ASP 296.A N SER 293.A OG no hydrogen 3.077 N/A ALA 297.A N SER 293.A O no hydrogen 3.034 N/A LEU 298.A N VAL 294.A O no hydrogen 3.070 N/A GLN 299.A N ASP 296.A O no hydrogen 3.049 N/A HIS 300.A N ALA 297.A O no hydrogen 3.211 N/A HIS 300.A NE2 ASP 278.A OD2 no hydrogen 2.780 N/A TYR 302.A N HIS 300.A ND1 no hydrogen 3.036 N/A TYR 302.A OH HIS 119.A ND1 no hydrogen 2.798 N/A ILE 303.A N HIS 300.A O no hydrogen 2.996 N/A ASN 304.A N HIS 300.A O no hydrogen 2.790 N/A TRP 306.A N ILE 303.A O no hydrogen 3.136 N/A TRP 306.A NE1 SER 123.A OG no hydrogen 2.697 N/A TYR 307.A N ASN 304.A O no hydrogen 3.193 N/A TYR 307.A OH GLU 313.A OE2 no hydrogen 2.844 N/A ASP 308.A N TYR 127.A OH no hydrogen 3.088 N/A ALA 310.A N ASP 308.A OD1 no hydrogen 3.227 N/A GLU 311.A N ASP 308.A O no hydrogen 2.977 N/A VAL 312.A N ASP 308.A O no hydrogen 3.000 N/A GLU 313.A N PRO 309.A O no hydrogen 2.819 N/A THR 319.A N GLU 322.A OE1 no hydrogen 2.851 N/A GLU 322.A N THR 319.A OG1 no hydrogen 3.405 N/A TRP 323.A N THR 319.A O no hydrogen 3.131 N/A TRP 323.A NE1 GLN 58.A OE1 no hydrogen 2.828 N/A LYS 324.A N ILE 320.A O no hydrogen 2.860 N/A LYS 324.A NZ LEU 92.A O no hydrogen 2.976 N/A LYS 324.A NZ GLU 93.A O no hydrogen 3.108 N/A GLU 325.A N GLU 321.A O no hydrogen 3.128 N/A LEU 326.A N GLU 322.A O no hydrogen 2.833 N/A ILE 327.A N TRP 323.A O no hydrogen 2.842 N/A TYR 328.A N LYS 324.A O no hydrogen 2.968 N/A LYS 329.A N GLU 325.A O no hydrogen 2.948 N/A GLU 330.A N LEU 326.A O no hydrogen 3.154 N/A VAL 331.A N ILE 327.A O no hydrogen 2.955 N/A MET 332.A N TYR 328.A O no hydrogen 2.958 N/A ASN 333.A N LYS 329.A O no hydrogen 2.806 N/A