Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ezp_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 4.A N VAL 113.A O no hydrogen 2.867 N/A TYR 5.A N ARG 42.A O no hydrogen 2.985 N/A TYR 5.A OH HIS 29.A ND1 no hydrogen 2.883 N/A ILE 6.A N ILE 115.A O no hydrogen 2.911 N/A TYR 7.A N VAL 44.A O no hydrogen 3.215 N/A SER 8.A OG GLU 10.A OE1 no hydrogen 3.519 N/A TYR 11.A N SER 8.A OG no hydrogen 3.002 N/A TYR 11.A OH ASN 116.A OD1 no hydrogen 2.585 N/A VAL 12.A N SER 8.A O no hydrogen 3.052 N/A SER 13.A N PRO 9.A O no hydrogen 3.063 N/A MET 14.A N GLU 10.A O no hydrogen 3.079 N/A CYS 15.A N TYR 11.A O no hydrogen 2.900 N/A CYS 15.A SG TYR 11.A O no hydrogen 3.674 N/A ASP 16.A N VAL 12.A O no hydrogen 2.999 N/A SER 17.A N MET 14.A O no hydrogen 3.183 N/A SER 17.A OG SER 13.A O no hydrogen 3.058 N/A SER 17.A OG MET 14.A O no hydrogen 2.917 N/A LEU 18.A N.A CYS 15.A O no hydrogen 2.950 N/A LYS 23.A N ASP 16.A O no hydrogen 3.466 N/A ARG 24.A N ILE 21.A O no hydrogen 3.145 N/A ARG 24.A NH1 GLY 283.A O no hydrogen 3.047 N/A ARG 24.A NH1 GLY 285.A O no hydrogen 2.954 N/A ARG 24.A NH2 GLY 283.A O no hydrogen 2.755 N/A SER 26.A N ASP 16.A OD2 no hydrogen 2.920 N/A SER 26.A OG ASP 16.A OD1 no hydrogen 2.330 N/A SER 26.A OG ASP 16.A OD2 no hydrogen 3.404 N/A MET 27.A N LYS 23.A O no hydrogen 3.056 N/A VAL 28.A N ARG 24.A O no hydrogen 3.011 N/A HIS 29.A N ALA 25.A O no hydrogen 3.030 N/A HIS 29.A ND1 TYR 5.A OH no hydrogen 2.883 N/A SER 30.A N SER 26.A O no hydrogen 2.701 N/A SER 30.A OG SER 26.A O no hydrogen 2.983 N/A SER 30.A OG MET 27.A O no hydrogen 3.355 N/A LEU 31.A N MET 27.A O no hydrogen 3.069 N/A ILE 32.A N VAL 28.A O no hydrogen 3.003 N/A GLU 33.A N HIS 29.A O no hydrogen 2.743 N/A ALA 34.A N SER 30.A O no hydrogen 2.839 N/A TYR 35.A N ILE 32.A O no hydrogen 3.397 N/A TYR 35.A OH SER 308.A O no hydrogen 2.773 N/A ALA 36.A N GLU 33.A O no hydrogen 2.793 N/A LEU 37.A N ILE 32.A O no hydrogen 3.252 N/A LYS 39.A N ALA 36.A O no hydrogen 3.478 N/A GLN 40.A N LEU 37.A O no hydrogen 3.226 N/A ARG 42.A N PRO 3.A O no hydrogen 2.784 N/A VAL 44.A N TYR 5.A O no hydrogen 2.860 N/A LYS 45.A NZ GLU 10.A OE1 no hydrogen 2.953 N/A LYS 47.A N THR 101.A OG1 no hydrogen 3.010 N/A LYS 47.A NZ GLU 53.A OE2 no hydrogen 2.933 N/A ALA 49.A N ALA 93.A O no hydrogen 3.019 N/A SER 50.A N GLU 53.A OE1 no hydrogen 2.913 N/A SER 50.A OG GLU 53.A OE1 no hydrogen 3.204 N/A GLU 53.A N SER 50.A O no hydrogen 2.954 N/A GLU 53.A N SER 50.A OG no hydrogen 3.254 N/A MET 54.A N SER 50.A O no hydrogen 3.117 N/A THR 56.A N GLU 53.A O no hydrogen 3.224 N/A THR 56.A OG1 GLU 53.A O no hydrogen 2.717 N/A PHE 57.A N MET 54.A O no hydrogen 3.208 N/A HIS 58.A N MET 54.A O no hydrogen 3.004 N/A THR 59.A N LYS 126.A O no hydrogen 2.962 N/A TYR 62.A N THR 59.A OG1 no hydrogen 3.024 N/A TYR 62.A OH TYR 134.A O no hydrogen 2.575 N/A LEU 63.A N THR 59.A O no hydrogen 2.795 N/A GLN 64.A N ASP 60.A O no hydrogen 2.741 N/A HIS 65.A N ALA 61.A O no hydrogen 3.045 N/A LEU 66.A N TYR 62.A O no hydrogen 2.735 N/A GLN 67.A N LEU 63.A O no hydrogen 2.971 N/A LYS 68.A N GLN 64.A O no hydrogen 2.966 N/A VAL 69.A N HIS 65.A O no hydrogen 3.051 N/A SER 70.A N LEU 66.A O no hydrogen 3.022 N/A SER 70.A N GLN 67.A O no hydrogen 3.094 N/A SER 70.A OG ASP 90.A OD1 no hydrogen 3.133 N/A GLN 71.A N LYS 68.A O no hydrogen 3.453 N/A CYS 82.A SG CYS 133.A O no hydrogen 4.021 N/A GLY 87.A N SER 70.A O no hydrogen 2.632 N/A ILE 88.A N THR 85.A O no hydrogen 3.270 N/A PHE 89.A N SER 70.A OG no hydrogen 2.982 N/A TYR 91.A N GLY 87.A O no hydrogen 3.207 N/A TYR 91.A O.B ASP 90.A O no hydrogen 3.616 N/A TYR 91.A OH.B CYS 15.A O no hydrogen 3.110 N/A ALA 92.A N ILE 88.A O no hydrogen 2.856 N/A ALA 93.A N PHE 89.A O no hydrogen 3.099 N/A ALA 94.A N ASP 90.A O no hydrogen 3.245 N/A ILE 95.A N TYR 91.A O.B no hydrogen 3.155 N/A GLY 96.A N ALA 92.A O no hydrogen 2.764 N/A GLY 97.A N ALA 93.A O no hydrogen 2.935 N/A ALA 98.A N ILE 95.A O no hydrogen 3.225 N/A THR 99.A N GLY 96.A O no hydrogen 3.112 N/A THR 99.A OG1 ASP 137.A OD2 no hydrogen 2.806 N/A ILE 100.A N GLY 96.A O no hydrogen 3.052 N/A THR 101.A N GLY 97.A O no hydrogen 2.935 N/A THR 101.A OG1 GLY 97.A O no hydrogen 2.587 N/A ALA 102.A N ALA 98.A O no hydrogen 3.400 N/A ALA 103.A N THR 99.A O no hydrogen 2.803 N/A GLN 104.A N ILE 100.A O no hydrogen 3.024 N/A GLN 104.A NE2 GLN 104.A O no hydrogen 3.585 N/A GLN 104.A NE2 ASP 108.A OD2 no hydrogen 3.546 N/A CYS 105.A SG THR 101.A O no hydrogen 3.308 N/A LEU 106.A N ALA 103.A O no hydrogen 3.039 N/A ILE 107.A N ALA 103.A O no hydrogen 3.332 N/A ASP 108.A N CYS 105.A O no hydrogen 3.233 N/A CYS 111.A SG VAL 113.A O no hydrogen 3.831 N/A LYS 112.A NZ GLN 275.A O no hydrogen 3.513 N/A ALA 114.A N THR 278.A O no hydrogen 2.913 N/A ILE 115.A N VAL 4.A O no hydrogen 2.756 N/A ASN 116.A N ILE 280.A O no hydrogen 2.938 N/A ASN 116.A ND2 THR 99.A OG1 no hydrogen 2.912 N/A TRP 117.A NE1 THR 299.A OG1 no hydrogen 2.995 N/A GLY 119.A N ASN 116.A O no hydrogen 2.964 N/A GLY 120.A N ASP 137.A OD1 no hydrogen 3.421 N/A GLY 120.A N ASP 137.A OD2 no hydrogen 3.003 N/A TRP 121.A N ASP 137.A OD1 no hydrogen 2.957 N/A HIS 122.A ND1 ASP 156.A OD2 no hydrogen 2.586 N/A HIS 123.A ND1 ASP 163.A OD2 no hydrogen 2.789 N/A LYS 125.A N GLU 128.A O no hydrogen 2.845 N/A LYS 125.A NZ HIS 123.A O no hydrogen 3.405 N/A LYS 125.A NZ ASP 163.A OD1 no hydrogen 3.222 N/A GLU 128.A N LYS 125.A O no hydrogen 3.329 N/A ALA 129.A N TYR 76.A O no hydrogen 2.870 N/A SER 130.A N CYS 133.A O no hydrogen 3.171 N/A CYS 133.A N SER 130.A O no hydrogen 2.868 N/A CYS 133.A SG GLY 131.A O no hydrogen 3.647 N/A TYR 134.A OH PRO 83.A O no hydrogen 3.339 N/A ASN 136.A N HIS 58.A NE2 no hydrogen 3.079 N/A ASN 136.A ND2 ALA 124.A O no hydrogen 2.507 N/A VAL 139.A N ASN 136.A OD1 no hydrogen 3.384 N/A LEU 140.A N ASN 136.A O no hydrogen 2.992 N/A GLY 141.A N ASP 137.A O no hydrogen 2.746 N/A ILE 142.A N ALA 138.A O no hydrogen 2.930 N/A LEU 143.A N VAL 139.A O no hydrogen 2.815 N/A ARG 144.A N LEU 140.A O no hydrogen 3.223 N/A ARG 144.A NH1 GLU 53.A OE2 no hydrogen 2.989 N/A ARG 144.A NH2 GLN 104.A OE1 no hydrogen 2.680 N/A LEU 145.A N GLY 141.A O no hydrogen 3.130 N/A ARG 146.A N ILE 142.A O no hydrogen 3.096 N/A ARG 146.A NH2 PHE 149.A O no hydrogen 2.954 N/A ARG 147.A N ARG 144.A O no hydrogen 3.128 N/A LYS 148.A N LEU 145.A O no hydrogen 3.263 N/A LYS 148.A NZ ILE 107.A O no hydrogen 3.563 N/A PHE 149.A N LEU 145.A O no hydrogen 2.808 N/A ILE 152.A N LYS 174.A O no hydrogen 3.258 N/A LEU 153.A N ALA 239.A O no hydrogen 3.060 N/A TYR 154.A N MET 176.A O no hydrogen 2.940 N/A TYR 154.A OH ASP 156.A OD2 no hydrogen 2.724 N/A VAL 155.A N VAL 241.A O no hydrogen 2.845 N/A ASP 156.A N VAL 178.A O no hydrogen 2.802 N/A LEU 157.A N GLN 243.A O no hydrogen 2.789 N/A ASP 158.A N ASP 156.A OD1 no hydrogen 3.153 N/A LEU 159.A N ASP 247.A OD1 no hydrogen 3.111 N/A HIS 160.A N ASP 158.A OD2 no hydrogen 3.200 N/A HIS 160.A ND1 ASP 158.A OD2 no hydrogen 3.332 N/A HIS 161.A ND1 THR 191.A OG1 no hydrogen 2.696 N/A HIS 161.A NE2 GLU 166.A OE1 no hydrogen 2.870 N/A GLY 162.A N SER 179.A OG no hydrogen 3.413 N/A ASP 163.A N HIS 161.A O no hydrogen 2.656 N/A GLU 166.A N GLY 162.A O no hydrogen 3.118 N/A ASP 167.A N ASP 163.A O no hydrogen 2.785 N/A ALA 168.A N GLY 164.A O no hydrogen 3.346 N/A PHE 169.A N VAL 165.A O no hydrogen 3.371 N/A PHE 169.A N GLU 166.A O no hydrogen 3.119 N/A SER 170.A N ASP 167.A O no hydrogen 3.452 N/A SER 170.A OG ASP 167.A O no hydrogen 3.290 N/A THR 172.A N PHE 169.A O no hydrogen 3.205 N/A LYS 174.A N THR 172.A OG1 no hydrogen 3.002 N/A MET 176.A N ILE 152.A O no hydrogen 3.057 N/A VAL 178.A N TYR 154.A O no hydrogen 2.771 N/A SER 179.A N VAL 207.A O no hydrogen 3.091 N/A SER 179.A OG HIS 181.A ND1 no hydrogen 2.873 N/A LEU 180.A N ASP 156.A O no hydrogen 3.087 N/A HIS 181.A ND1 SER 179.A OG no hydrogen 2.873 N/A HIS 181.A NE2 GLY 192.A O no hydrogen 2.724 N/A LYS 182.A N LEU 159.A O no hydrogen 2.982 N/A LYS 182.A NZ ASP 213.A OD1 no hydrogen 2.919 N/A LYS 182.A NZ SER 256.A OG no hydrogen 3.383 N/A PHE 183.A N ILE 211.A O no hydrogen 3.107 N/A PHE 187.A N SER 184.A O no hydrogen 3.009 N/A THR 191.A OG1 HIS 161.A ND1 no hydrogen 2.696 N/A VAL 194.A N ASP 193.A OD2 no hydrogen 2.668 N/A ASP 196.A N ASP 193.A O no hydrogen 2.985 N/A LEU 199.A N SER 170.A O no hydrogen 2.895 N/A GLY 202.A N LEU 199.A O no hydrogen 2.874 N/A ARG 203.A N GLY 200.A O no hydrogen 3.183 N/A TYR 204.A N VAL 197.A O no hydrogen 2.756 N/A TYR 205.A N GLY 202.A O no hydrogen 3.063 N/A VAL 207.A N THR 177.A O no hydrogen 2.753 N/A ASN 208.A ND2 GLU 166.A OE1 no hydrogen 3.144 N/A ASN 208.A ND2 ASP 193.A O no hydrogen 3.700 N/A ASN 208.A ND2 ASP 196.A O no hydrogen 2.982 N/A VAL 209.A N SER 179.A O no hydrogen 2.907 N/A ILE 211.A N HIS 181.A O no hydrogen 2.958 N/A GLN 212.A N ASN 337.A OD1 no hydrogen 2.963 N/A GLN 212.A NE2 PHE 183.A O no hydrogen 3.032 N/A GLY 214.A N SER 256.A O no hydrogen 2.994 N/A LYS 219.A NZ ASP 335.A OD2 no hydrogen 3.031 N/A LYS 219.A NZ ASN 337.A O no hydrogen 3.230 N/A TYR 220.A N GLN 216.A O no hydrogen 2.842 N/A TYR 221.A N ASP 217.A O no hydrogen 2.757 N/A GLN 222.A N GLU 218.A O no hydrogen 2.946 N/A ILE 223.A N LYS 219.A O no hydrogen 3.387 N/A CYS 224.A N TYR 220.A O no hydrogen 2.882 N/A GLU 225.A N TYR 221.A O no hydrogen 2.747 N/A SER 226.A N GLN 222.A O no hydrogen 2.882 N/A VAL 227.A N ILE 223.A O no hydrogen 3.060 N/A LEU 228.A N CYS 224.A O no hydrogen 2.758 N/A LYS 229.A N GLU 225.A O no hydrogen 2.878 N/A LYS 229.A N SER 226.A O no hydrogen 3.333 N/A GLU 230.A N SER 226.A O no hydrogen 3.316 N/A VAL 231.A N VAL 227.A O no hydrogen 3.125 N/A TYR 232.A N LEU 228.A O no hydrogen 3.281 N/A GLN 233.A N LYS 229.A O no hydrogen 3.323 N/A ALA 234.A N GLU 230.A O no hydrogen 3.307 N/A PHE 235.A N VAL 231.A O no hydrogen 2.996 N/A LYS 238.A N ARG 151.A O no hydrogen 2.684 N/A ALA 239.A N ARG 151.A O no hydrogen 3.414 N/A VAL 240.A N ALA 277.A O no hydrogen 3.247 N/A VAL 241.A N LEU 153.A O no hydrogen 2.787 N/A LEU 242.A N LEU 279.A O no hydrogen 2.978 N/A GLN 243.A N VAL 155.A O no hydrogen 2.778 N/A GLN 243.A NE2 GLY 120.A O no hydrogen 3.082 N/A GLN 243.A NE2 ASP 158.A OD1 no hydrogen 2.885 N/A LEU 244.A N LEU 281.A O no hydrogen 2.700 N/A GLY 245.A N GLN 243.A OE1 no hydrogen 2.613 N/A ALA 246.A N GLY 284.A O no hydrogen 2.855 N/A ALA 250.A N MET 259.A O no hydrogen 2.618 N/A ASP 252.A N ILE 249.A O no hydrogen 3.340 N/A MET 254.A N ASP 252.A OD2 no hydrogen 2.964 N/A CYS 255.A N ASP 252.A O no hydrogen 3.027 N/A SER 256.A OG MET 254.A O no hydrogen 3.507 N/A ASN 258.A N ILE 215.A O no hydrogen 3.050 N/A ASN 258.A ND2 SER 331.A O no hydrogen 3.399 N/A MET 259.A N THR 248.A O no hydrogen 3.473 N/A THR 260.A N ASP 217.A OD1 no hydrogen 3.073 N/A THR 260.A OG1 ASP 217.A OD1 no hydrogen 3.192 N/A THR 260.A OG1 ASP 217.A OD2 no hydrogen 2.854 N/A VAL 262.A N THR 260.A OG1 no hydrogen 3.322 N/A GLY 263.A N THR 260.A O no hydrogen 3.027 N/A GLY 265.A N PRO 261.A O no hydrogen 2.961 N/A LYS 266.A N VAL 262.A O no hydrogen 3.094 N/A CYS 267.A SG GLY 263.A O no hydrogen 3.637 N/A LEU 268.A N ILE 264.A O no hydrogen 2.834 N/A LYS 269.A N GLY 265.A O no hydrogen 2.630 N/A TYR 270.A N LYS 266.A O no hydrogen 3.090 N/A ILE 271.A N CYS 267.A O no hydrogen 3.140 N/A ILE 271.A N LEU 268.A O no hydrogen 3.044 N/A LEU 272.A N LEU 268.A O no hydrogen 2.870 N/A GLN 273.A N LYS 269.A O no hydrogen 2.882 N/A GLN 273.A NE2 TYR 270.A O no hydrogen 2.811 N/A TRP 274.A N ILE 271.A O no hydrogen 3.054 N/A GLN 275.A N LEU 272.A O no hydrogen 2.747 N/A THR 278.A OG1 LEU 276.A O no hydrogen 3.180 N/A LEU 279.A N VAL 240.A O no hydrogen 2.902 N/A ILE 280.A N ALA 114.A O no hydrogen 2.890 N/A LEU 281.A N LEU 242.A O no hydrogen 2.793 N/A GLY 284.A N ASP 158.A OD1 no hydrogen 2.955 N/A TYR 286.A N ASP 252.A OD1 no hydrogen 2.733 N/A ASN 287.A ND2 GLY 251.A O no hydrogen 3.135 N/A ASN 290.A N ASN 287.A OD1 no hydrogen 2.857 N/A THR 291.A N ASN 287.A O no hydrogen 2.935 N/A THR 291.A OG1 ASN 287.A O no hydrogen 3.216 N/A ALA 292.A N LEU 288.A O no hydrogen 3.117 N/A ARG 293.A N ALA 289.A O no hydrogen 2.938 N/A ARG 293.A NE VAL 325.A O no hydrogen 2.745 N/A ARG 293.A NH2 ASN 290.A OD1 no hydrogen 2.770 N/A CYS 294.A N ASN 290.A O no hydrogen 2.758 N/A TRP 295.A N THR 291.A O no hydrogen 2.974 N/A TRP 295.A NE1 LEU 244.A O no hydrogen 3.030 N/A THR 296.A N ALA 292.A O no hydrogen 2.896 N/A THR 296.A OG1 ALA 292.A O no hydrogen 2.501 N/A TYR 297.A N ARG 293.A O no hydrogen 3.082 N/A LEU 298.A N CYS 294.A O no hydrogen 2.898 N/A THR 299.A N TRP 295.A O no hydrogen 2.720 N/A THR 299.A OG1 TRP 295.A O no hydrogen 2.862 N/A GLY 300.A N TYR 297.A O no hydrogen 3.074 N/A VAL 301.A N TYR 297.A O no hydrogen 3.088 N/A ILE 302.A N LEU 298.A O no hydrogen 3.102 N/A LEU 303.A N GLY 300.A O no hydrogen 3.265 N/A THR 306.A OG1 THR 306.A O no hydrogen 2.643 N/A SER 309.A OG GLU 327.A OE1 no hydrogen 2.624 N/A SER 309.A OG GLU 327.A OE2 no hydrogen 2.810 N/A ILE 311.A N TYR 324.A O no hydrogen 3.112 N/A HIS 314.A ND1 PRO 312.A O no hydrogen 2.838 N/A PHE 317.A N HIS 314.A O no hydrogen 3.125 N/A ALA 319.A N PHE 316.A O no hydrogen 2.892 N/A TYR 320.A N PHE 317.A O no hydrogen 2.981 N/A TYR 324.A N TYR 320.A O no hydrogen 3.013 N/A LEU 326.A N SER 309.A O no hydrogen 3.023 N/A SER 331.A N ASN 258.A OD1 no hydrogen 2.823 N/A SER 331.A OG ASN 258.A OD1 no hydrogen 3.358 N/A ARG 333.A NH1 SER 256.A O no hydrogen 2.724 N/A ARG 333.A NH2 PHE 257.A O no hydrogen 2.751 N/A ARG 336.A N ASP 213.A O no hydrogen 2.930 N/A ASN 337.A N ASP 335.A OD1 no hydrogen 2.837 N/A ASN 337.A ND2 GLN 212.A O no hydrogen 3.153 N/A ASN 337.A ND2 ASP 335.A OD1 no hydrogen 3.098 N/A ARG 341.A N GLU 338.A O no hydrogen 2.866 N/A ARG 341.A NE GLN 344.A OE1 no hydrogen 3.513 N/A ILE 342.A N GLU 338.A O no hydrogen 3.483 N/A GLN 343.A N PRO 339.A O no hydrogen 3.369 N/A GLN 343.A NE2 ASN 347.A OD1 no hydrogen 3.291 N/A GLN 344.A N HIS 340.A O no hydrogen 3.070 N/A ILE 345.A N ARG 341.A O no hydrogen 2.983 N/A LEU 346.A N ILE 342.A O no hydrogen 2.862 N/A ASN 347.A N GLN 343.A O no hydrogen 2.799 N/A TYR 348.A N GLN 344.A O no hydrogen 2.989 N/A ILE 349.A N ILE 345.A O no hydrogen 2.961 N/A LYS 350.A N LEU 346.A O no hydrogen 2.917 N/A GLY 351.A N ASN 347.A O no hydrogen 2.798 N/A ASN 352.A N ILE 349.A O no hydrogen 2.884 N/A LEU 353.A N ILE 349.A O no hydrogen 3.047 N/A LEU 353.A N LYS 350.A O no hydrogen 3.287 N/A VAL 356.A N LEU 353.A O no hydrogen 3.002 N/A