Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4loq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 3.A NH1 PRO 90.A O no hydrogen 3.157 N/A TYR 7.A N VAL 18.A O no hydrogen 2.848 N/A TYR 7.A OH TYR 22.A O no hydrogen 2.495 N/A GLN 9.A N TRP 16.A O no hydrogen 3.254 N/A LEU 11.A N THR 14.A O no hydrogen 3.190 N/A THR 14.A N LEU 11.A O no hydrogen 3.122 N/A TRP 16.A N GLN 9.A O no hydrogen 2.930 N/A GLU 17.A N TYR 101.A OH no hydrogen 2.954 N/A VAL 18.A N TYR 7.A O no hydrogen 3.000 N/A GLU 20.A N THR 5.A O no hydrogen 2.855 N/A ARG 21.A NE ASP 41.A OD1 no hydrogen 2.763 N/A ARG 21.A NH2 ASP 41.A OD1 no hydrogen 3.224 N/A ARG 21.A NH2 ASP 41.A OD2 no hydrogen 2.683 N/A TYR 22.A N PRO 19.A O no hydrogen 2.932 N/A TYR 22.A OH ASP 86.A OD2 no hydrogen 2.530 N/A GLN 23.A N PHE 40.A O no hydrogen 2.805 N/A GLN 23.A NE2.A GLU 20.A O no hydrogen 2.926 N/A SER 26.A N ALA 38.A O no hydrogen 2.937 N/A VAL 28.A N VAL 36.A O no hydrogen 2.821 N/A GLY 31.A N GLY 34.A O no hydrogen 3.045 N/A SER 35.A N LYS 52.A O no hydrogen 3.257 N/A VAL 36.A N GLY 29.A O no hydrogen 2.919 N/A CYS 37.A N VAL 50.A O no hydrogen 2.814 N/A ALA 38.A N SER 26.A O no hydrogen 2.681 N/A ALA 39.A N VAL 48.A O no hydrogen 2.672 N/A PHE 40.A N GLN 23.A O no hydrogen 2.907 N/A ASP 41.A N HIS 46.A O no hydrogen 2.997 N/A THR 42.A N ARG 21.A O no hydrogen 2.698 N/A THR 42.A OG1 ARG 21.A O no hydrogen 3.200 N/A LYS 43.A N ASP 41.A OD1 no hydrogen 3.184 N/A THR 44.A OG1 ASP 41.A OD2 no hydrogen 2.631 N/A GLY 45.A N ASP 41.A O no hydrogen 2.799 N/A VAL 48.A N ALA 39.A O no hydrogen 2.777 N/A ALA 49.A N THR 104.A O no hydrogen 2.932 N/A VAL 50.A N CYS 37.A O no hydrogen 2.783 N/A LYS 51.A N LEU 102.A O no hydrogen 2.728 N/A LYS 51.A NZ ALA 32.A O no hydrogen 2.968 N/A LYS 51.A NZ GLU 69.A OE2 no hydrogen 2.453 N/A LYS 52.A N SER 35.A O no hydrogen 3.031 N/A LYS 52.A NZ THR 14.A OG1 no hydrogen 3.120 N/A LYS 52.A NZ ILE 15.A O no hydrogen 2.533 N/A LEU 53.A N VAL 100.A O no hydrogen 2.992 N/A SER 54.A N TYR 33.A O no hydrogen 3.179 N/A GLN 58.A N ARG 55.A O no hydrogen 3.385 N/A SER 59.A OG HIS 62.A ND1 no hydrogen 2.917 N/A HIS 62.A N SER 59.A OG no hydrogen 3.382 N/A HIS 62.A ND1 SER 59.A OG no hydrogen 2.917 N/A ALA 63.A N SER 59.A O no hydrogen 2.932 N/A LYS 64.A N ILE 60.A O no hydrogen 2.933 N/A LYS 64.A NZ GLU 326.A O no hydrogen 3.042 N/A LYS 64.A NZ GLU 326.A OE1 no hydrogen 3.516 N/A ARG 65.A N ILE 61.A O no hydrogen 3.067 N/A ARG 65.A NH1 GLU 69.A OE1 no hydrogen 2.867 N/A THR 66.A N HIS 62.A O no hydrogen 2.947 N/A THR 66.A OG1 PRO 56.A O no hydrogen 3.121 N/A THR 66.A OG1 HIS 62.A O no hydrogen 2.719 N/A TYR 67.A N ALA 63.A O no hydrogen 3.181 N/A ARG 68.A N LYS 64.A O no hydrogen 2.912 N/A ARG 68.A NE GLU 326.A OE2 no hydrogen 2.580 N/A ARG 68.A NH2 GLU 326.A OE1 no hydrogen 2.927 N/A ARG 68.A NH2 GLU 326.A OE2 no hydrogen 3.168 N/A GLU 69.A N ARG 65.A O no hydrogen 3.021 N/A LEU 70.A N THR 66.A O no hydrogen 3.126 N/A ARG 71.A N TYR 67.A O no hydrogen 2.969 N/A ARG 71.A NH1 TYR 67.A OH no hydrogen 2.918 N/A LEU 72.A N ARG 68.A O no hydrogen 3.248 N/A LEU 73.A N GLU 69.A O no hydrogen 2.819 N/A LYS 74.A N LEU 70.A O no hydrogen 2.724 N/A LYS 74.A NZ GLU 342.A O no hydrogen 2.850 N/A LYS 74.A NZ GLU 342.A OE1 no hydrogen 2.532 N/A HIS 75.A N ARG 71.A O no hydrogen 3.152 N/A HIS 75.A N LEU 72.A O no hydrogen 3.021 N/A HIS 75.A NE2 ASP 319.A O no hydrogen 2.890 N/A MET 76.A N LEU 72.A O no hydrogen 3.202 N/A LYS 77.A N TYR 138.A OH no hydrogen 3.188 N/A GLU 79.A N GLU 79.A OE1.B no hydrogen 3.164 N/A ASN 80.A N HIS 78.A ND1 no hydrogen 2.867 N/A ASN 80.A ND2 LEU 162.A O no hydrogen 3.037 N/A ILE 82.A N ILE 164.A O no hydrogen 3.164 N/A LEU 85.A N VAL 103.A O no hydrogen 2.918 N/A ASP 86.A N VAL 103.A O no hydrogen 3.344 N/A PHE 88.A N TYR 101.A O no hydrogen 2.991 N/A THR 89.A OG1 ASP 99.A O no hydrogen 2.662 N/A ARG 92.A N GLU 96.A OE1 no hydrogen 3.072 N/A PHE 97.A N LEU 94.A O no hydrogen 3.190 N/A TYR 101.A N PHE 88.A O no hydrogen 2.993 N/A LEU 102.A N LYS 51.A O no hydrogen 2.972 N/A VAL 103.A N ASP 86.A O no hydrogen 2.933 N/A THR 104.A N ALA 49.A O no hydrogen 3.025 N/A THR 104.A OG1 GLY 83.A O no hydrogen 2.695 N/A LEU 106.A N ARG 47.A O no hydrogen 3.154 N/A ALA 109.A N VAL 156.A O no hydrogen 2.904 N/A ASP 110.A N ASN 113.A OD1 no hydrogen 2.948 N/A LEU 111.A N LEU 154.A O no hydrogen 3.200 N/A ASN 112.A N ASP 110.A OD1 no hydrogen 2.632 N/A ASN 113.A N ASP 110.A OD1 no hydrogen 3.165 N/A ILE 114.A N ASP 110.A O no hydrogen 3.363 N/A VAL 115.A N LEU 111.A O no hydrogen 2.949 N/A LYS 116.A N ASN 112.A O no hydrogen 3.241 N/A CYS 117.A N ILE 114.A O no hydrogen 3.075 N/A CYS 117.A SG ASN 113.A O no hydrogen 3.254 N/A CYS 117.A SG ILE 114.A O no hydrogen 4.000 N/A GLN 118.A N ILE 114.A O no hydrogen 3.081 N/A THR 121.A N HIS 124.A ND1 no hydrogen 3.293 N/A THR 121.A OG1 HIS 124.A ND1 no hydrogen 2.837 N/A HIS 124.A N THR 121.A OG1 no hydrogen 3.090 N/A HIS 124.A ND1 THR 121.A OG1 no hydrogen 2.837 N/A VAL 125.A N THR 121.A O no hydrogen 3.155 N/A GLN 126.A N ASP 122.A O no hydrogen 2.997 N/A PHE 127.A N ASP 123.A O no hydrogen 3.262 N/A LEU 128.A N HIS 124.A O no hydrogen 3.050 N/A ILE 129.A N VAL 125.A O no hydrogen 2.978 N/A TYR 130.A N GLN 126.A O no hydrogen 2.991 N/A TYR 130.A OH GLU 315.A OE2 no hydrogen 2.557 N/A GLN 131.A N PHE 127.A O no hydrogen 2.884 N/A GLN 131.A NE2 PHE 127.A O no hydrogen 3.475 N/A GLN 131.A NE2 CYS 160.A O no hydrogen 2.931 N/A ILE 132.A N LEU 128.A O no hydrogen 3.094 N/A LEU 133.A N ILE 129.A O no hydrogen 2.975 N/A ARG 134.A N TYR 130.A O no hydrogen 3.040 N/A ARG 134.A NE ASP 314.A O no hydrogen 2.941 N/A ARG 134.A NH1 GLU 79.A OE1.A no hydrogen 3.531 N/A ARG 134.A NH2 GLU 79.A OE1.B no hydrogen 3.416 N/A GLY 135.A N GLN 131.A O no hydrogen 3.052 N/A LEU 136.A N ILE 132.A O no hydrogen 2.919 N/A LYS 137.A N LEU 133.A O no hydrogen 2.836 N/A LYS 137.A NZ GLU 315.A O no hydrogen 3.418 N/A TYR 138.A N ARG 134.A O no hydrogen 3.314 N/A ILE 139.A N GLY 135.A O no hydrogen 2.849 N/A HIS 140.A N LEU 136.A O no hydrogen 2.828 N/A HIS 140.A NE2 ASP 203.A OD2 no hydrogen 2.758 N/A SER 141.A N LYS 137.A O no hydrogen 2.952 N/A SER 141.A OG TYR 138.A O no hydrogen 2.572 N/A ALA 142.A N TYR 138.A O no hydrogen 3.319 N/A ALA 142.A N ILE 139.A O no hydrogen 3.184 N/A ASP 143.A N HIS 140.A O no hydrogen 2.972 N/A ILE 144.A N ILE 139.A O no hydrogen 3.342 N/A HIS 146.A N ASP 203.A OD2 no hydrogen 3.234 N/A HIS 146.A NE2 LEU 165.A O no hydrogen 2.908 N/A ARG 147.A N ASP 203.A OD1 no hydrogen 2.892 N/A ARG 147.A NE TYR 198.A OH no hydrogen 3.111 N/A ARG 147.A NH1 TYR 198.A OH no hydrogen 2.877 N/A ARG 147.A NH2 GLY 168.A O no hydrogen 3.412 N/A ASP 148.A N HIS 146.A ND1 no hydrogen 3.172 N/A LYS 150.A NZ THR 183.A OG1 no hydrogen 2.982 N/A ASN 153.A N LYS 150.A O no hydrogen 3.276 N/A ASN 153.A ND2 ASP 148.A O no hydrogen 2.705 N/A ASN 153.A ND2 ASP 148.A OD2 no hydrogen 3.359 N/A LEU 154.A N PRO 151.A O no hydrogen 3.053 N/A ALA 155.A N LYS 163.A O no hydrogen 2.880 N/A VAL 156.A N ALA 109.A O no hydrogen 2.674 N/A ASN 157.A N GLU 161.A O no hydrogen 3.264 N/A ASN 157.A ND2 GLU 161.A OE1 no hydrogen 2.825 N/A ASP 159.A N ASN 157.A OD1 no hydrogen 2.956 N/A CYS 160.A N ASN 157.A O no hydrogen 2.831 N/A GLU 161.A N ASN 157.A OD1 no hydrogen 3.185 N/A LEU 162.A N GLN 131.A OE1 no hydrogen 2.876 N/A LYS 163.A N ALA 155.A O no hydrogen 2.852 N/A ILE 164.A N ASN 80.A O no hydrogen 2.829 N/A LEU 165.A N ASN 153.A O no hydrogen 3.178 N/A GLY 168.A N HIS 146.A O no hydrogen 3.000 N/A ARG 171.A N LEU 169.A O no hydrogen 2.698 N/A HIS 172.A NE2 ILE 191.A O no hydrogen 2.985 N/A ASP 175.A N THR 173.A OG1 no hydrogen 3.084 N/A THR 178.A OG1 ASP 175.A O no hydrogen 2.799 N/A THR 183.A N GLY 179.A O no hydrogen 3.133 N/A THR 183.A OG1 ASP 148.A OD1 no hydrogen 2.457 N/A THR 183.A OG1 ASP 148.A OD2 no hydrogen 3.399 N/A THR 183.A OG1 GLY 179.A O no hydrogen 3.040 N/A TRP 185.A N ALA 182.A O no hydrogen 3.019 N/A TRP 185.A NE1 GLY 223.A O no hydrogen 3.076 N/A TYR 186.A N THR 183.A O no hydrogen 3.227 N/A TYR 186.A OH GLU 213.A OE1 no hydrogen 2.323 N/A ARG 187.A NH2 ARG 147.A O no hydrogen 3.225 N/A GLU 190.A N GLU 190.A OE1 no hydrogen 2.959 N/A ILE 191.A N ALA 188.A O no hydrogen 2.913 N/A MET 192.A N PRO 189.A O no hydrogen 3.236 N/A MET 196.A N ASN 194.A OD1 no hydrogen 3.221 N/A THR 201.A N ASN 199.A OD1 no hydrogen 3.135 N/A THR 201.A OG1 ASN 199.A OD1 no hydrogen 2.209 N/A VAL 202.A N ASN 199.A O no hydrogen 3.178 N/A ASP 203.A N GLN 200.A O no hydrogen 3.217 N/A ILE 204.A N THR 201.A O no hydrogen 3.219 N/A TRP 205.A N THR 201.A O no hydrogen 3.509 N/A SER 206.A N VAL 202.A O no hydrogen 3.296 N/A SER 206.A OG TYR 186.A O no hydrogen 2.737 N/A SER 206.A OG VAL 202.A O no hydrogen 3.329 N/A VAL 207.A N ASP 203.A O no hydrogen 2.878 N/A GLY 208.A N ILE 204.A O no hydrogen 2.971 N/A CYS 209.A N TRP 205.A O no hydrogen 3.000 N/A CYS 209.A SG TRP 185.A O no hydrogen 3.966 N/A CYS 209.A SG TRP 205.A O no hydrogen 3.838 N/A ILE 210.A N SER 206.A O no hydrogen 2.890 N/A MET 211.A N VAL 207.A O no hydrogen 2.762 N/A ALA 212.A N GLY 208.A O no hydrogen 3.113 N/A GLU 213.A N CYS 209.A O no hydrogen 3.348 N/A LEU 214.A N ILE 210.A O no hydrogen 2.918 N/A LEU 215.A N MET 211.A O no hydrogen 3.063 N/A THR 216.A N ALA 212.A O no hydrogen 3.018 N/A THR 216.A OG1 ALA 212.A O no hydrogen 3.056 N/A GLY 217.A N GLU 213.A O no hydrogen 2.716 N/A ARG 218.A N THR 216.A OG1 no hydrogen 3.001 N/A THR 219.A OG1 GLU 213.A OE2 no hydrogen 2.999 N/A GLY 223.A N PHE 221.A O no hydrogen 2.946 N/A THR 224.A N ASP 228.A OD2 no hydrogen 3.167 N/A THR 224.A OG1 ASP 225.A OD2 no hydrogen 3.506 N/A THR 224.A OG1 ASP 228.A OD2 no hydrogen 3.348 N/A HIS 226.A N HIS 226.A ND1.B no hydrogen 2.981 N/A ASP 228.A N ASP 225.A OD1 no hydrogen 2.743 N/A GLN 229.A N ASP 225.A O no hydrogen 2.810 N/A GLN 229.A NE2 PHE 221.A O no hydrogen 2.611 N/A LEU 230.A N HIS 226.A O no hydrogen 3.012 N/A LYS 231.A N ILE 227.A O no hydrogen 2.956 N/A LEU 232.A N ASP 228.A O no hydrogen 3.029 N/A ILE 233.A N GLN 229.A O no hydrogen 3.229 N/A LEU 234.A N LEU 230.A O no hydrogen 3.012 N/A ARG 235.A N LYS 231.A O no hydrogen 2.883 N/A LEU 236.A N ILE 233.A O no hydrogen 2.745 N/A VAL 237.A N ILE 233.A O no hydrogen 3.113 N/A GLY 238.A N LEU 234.A O no hydrogen 2.746 N/A THR 239.A N MET 263.A O no hydrogen 2.787 N/A THR 239.A OG1 MET 263.A O no hydrogen 3.512 N/A LEU 244.A N GLY 241.A O no hydrogen 3.228 N/A LEU 245.A N GLY 241.A O no hydrogen 2.921 N/A LYS 247.A N LEU 244.A O no hydrogen 3.020 N/A ILE 248.A N LEU 244.A O no hydrogen 3.252 N/A SER 249.A OG LEU 245.A O no hydrogen 3.159 N/A SER 249.A OG SER 250.A O no hydrogen 3.077 N/A ALA 253.A N SER 250.A OG no hydrogen 3.254 N/A ARG 254.A N SER 250.A O no hydrogen 2.890 N/A ARG 254.A NH1 SER 249.A O no hydrogen 3.118 N/A ASN 255.A N GLU 251.A O no hydrogen 2.910 N/A TYR 256.A N SER 252.A O no hydrogen 3.018 N/A ILE 257.A N ALA 253.A O no hydrogen 3.023 N/A GLN 258.A N ARG 254.A O no hydrogen 3.035 N/A SER 259.A N ASN 255.A O no hydrogen 3.027 N/A SER 259.A OG TYR 256.A O no hydrogen 2.756 N/A LEU 260.A N ILE 257.A O no hydrogen 3.003 N/A MET 263.A N THR 239.A OG1 no hydrogen 2.867 N/A LYS 265.A NZ MET 266.A O no hydrogen 3.094 N/A LYS 265.A NZ GLU 284.A OE1 no hydrogen 2.694 N/A LYS 265.A NZ GLU 284.A OE2 no hydrogen 2.932 N/A MET 266.A N LEU 236.A O no hydrogen 2.865 N/A PHE 268.A N GLU 284.A OE2 no hydrogen 3.394 N/A ALA 269.A N ASN 267.A OD1 no hydrogen 3.007 N/A ASN 270.A N ASN 267.A O no hydrogen 2.853 N/A PHE 272.A N PHE 268.A O no hydrogen 3.122 N/A ILE 273.A N VAL 271.A O no hydrogen 3.108 N/A ALA 275.A N PHE 272.A O no hydrogen 3.294 N/A ASN 276.A ND2 ASP 122.A OD2 no hydrogen 3.089 N/A LEU 278.A N ASN 276.A OD1 no hydrogen 2.548 N/A ALA 279.A N ASN 276.A O no hydrogen 2.672 N/A VAL 280.A N ASN 276.A O no hydrogen 3.099 N/A ASP 281.A N PRO 277.A O no hydrogen 3.011 N/A LEU 282.A N LEU 278.A O no hydrogen 3.168 N/A LEU 283.A N ALA 279.A O no hydrogen 3.031 N/A GLU 284.A N VAL 280.A O no hydrogen 2.861 N/A LYS 285.A N LEU 282.A O no hydrogen 2.875 N/A LYS 285.A NZ ASP 281.A OD2 no hydrogen 2.975 N/A MET 286.A N LEU 283.A O no hydrogen 3.101 N/A LEU 287.A N LEU 283.A O no hydrogen 3.033 N/A VAL 288.A N MET 286.A O no hydrogen 2.955 N/A LYS 293.A N ASP 290.A O no hydrogen 3.153 N/A LYS 293.A NZ ASP 290.A OD2 no hydrogen 3.438 N/A ARG 294.A N SER 291.A O no hydrogen 3.102 N/A ARG 294.A NE VAL 288.A O no hydrogen 2.718 N/A ARG 294.A NH1 GLU 190.A OE2 no hydrogen 3.022 N/A ARG 294.A NH1 THR 201.A O no hydrogen 3.228 N/A ARG 294.A NH2 GLU 190.A OE1 no hydrogen 3.306 N/A ARG 294.A NH2 VAL 288.A O no hydrogen 2.832 N/A ILE 295.A N LYS 285.A O no hydrogen 2.993 N/A THR 296.A N GLN 299.A OE1 no hydrogen 2.978 N/A GLN 299.A N THR 296.A OG1 no hydrogen 3.238 N/A ALA 300.A N THR 296.A O no hydrogen 2.987 N/A LEU 301.A N ALA 297.A O no hydrogen 3.223 N/A LEU 301.A N ALA 298.A O no hydrogen 3.189 N/A ALA 302.A N GLN 299.A O no hydrogen 2.830 N/A HIS 303.A N ALA 300.A O no hydrogen 3.154 N/A HIS 303.A NE2 ASP 281.A OD2 no hydrogen 2.607 N/A TYR 305.A N HIS 303.A ND1 no hydrogen 3.055 N/A TYR 305.A OH ASP 122.A OD1 no hydrogen 2.558 N/A PHE 306.A N HIS 303.A O no hydrogen 3.330 N/A ALA 307.A N ALA 304.A O no hydrogen 3.162 N/A TYR 309.A N PHE 306.A O no hydrogen 2.980 N/A HIS 310.A N PHE 306.A O no hydrogen 2.870 N/A HIS 310.A ND1 GLU 315.A OE2 no hydrogen 2.756 N/A ASP 311.A N GLU 315.A OE2 no hydrogen 3.170 N/A ASP 313.A N ASP 311.A OD1 no hydrogen 2.962 N/A ASP 314.A N ASP 311.A O no hydrogen 2.983 N/A ALA 318.A N SER 141.A OG no hydrogen 2.830 N/A TYR 321.A N ALA 142.A O no hydrogen 3.126 N/A GLN 323.A NE2 ASP 143.A O no hydrogen 3.328 N/A SER 324.A N ASP 322.A OD1 no hydrogen 3.338 N/A GLU 326.A N GLN 323.A O no hydrogen 3.159 N/A SER 327.A N SER 324.A O no hydrogen 2.957 N/A SER 327.A OG.A SER 324.A O no hydrogen 3.047 N/A ARG 328.A N PHE 325.A O no hydrogen 3.024 N/A LEU 331.A N GLU 334.A OE1 no hydrogen 3.110 N/A TRP 335.A N LEU 331.A O no hydrogen 2.921 N/A LYS 336.A N ILE 332.A O no hydrogen 2.894 N/A LYS 336.A NZ ASN 98.A OD1 no hydrogen 3.290 N/A SER 337.A N ASP 333.A O no hydrogen 3.129 N/A SER 337.A N GLU 334.A O no hydrogen 3.153 N/A LEU 338.A N GLU 334.A O no hydrogen 3.151 N/A THR 339.A N TRP 335.A O no hydrogen 2.886 N/A THR 339.A OG1 TRP 335.A O no hydrogen 2.769 N/A TYR 340.A N LYS 336.A O no hydrogen 3.065 N/A ASP 341.A N SER 337.A O no hydrogen 3.249 N/A GLU 342.A N LEU 338.A O no hydrogen 3.368 N/A VAL 343.A N THR 339.A O no hydrogen 3.161 N/A VAL 343.A N TYR 340.A O no hydrogen 3.234 N/A ILE 344.A N TYR 340.A O no hydrogen 3.145 N/A SER 345.A N ASP 341.A O no hydrogen 2.931 N/A SER 345.A OG ASP 341.A O no hydrogen 3.030 N/A PHE 346.A N VAL 343.A O no hydrogen 3.151 N/A