Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4qp3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 3.A N GLN 6.A O no hydrogen 3.020 N/A PHE 8.A N GLU 1.A O no hydrogen 3.142 N/A ARG 13.A NE ASP 33.A OD1 no hydrogen 2.847 N/A ARG 13.A NH2 ASP 33.A OD1 no hydrogen 3.460 N/A ARG 13.A NH2 ASP 33.A OD2 no hydrogen 3.146 N/A TYR 14.A N VAL 10.A O no hydrogen 3.190 N/A TYR 14.A OH ASP 77.A OD2 no hydrogen 2.892 N/A THR 15.A N TYR 32.A O no hydrogen 3.061 N/A SER 18.A N SER 30.A O no hydrogen 3.266 N/A TYR 19.A OH GLU 22.A OE2 no hydrogen 2.514 N/A ILE 20.A N VAL 28.A O no hydrogen 3.337 N/A MET 27.A N LYS 44.A O no hydrogen 3.196 N/A CYS 29.A N ILE 42.A O no hydrogen 3.066 N/A CYS 29.A SG SER 30.A O no hydrogen 3.306 N/A SER 30.A N SER 18.A O no hydrogen 3.148 N/A ALA 31.A N VAL 40.A O no hydrogen 2.795 N/A TYR 32.A N THR 15.A O no hydrogen 2.697 N/A ASP 33.A N VAL 38.A O no hydrogen 2.720 N/A ASN 34.A N ARG 13.A O no hydrogen 3.079 N/A ASN 34.A ND2 PRO 12.A O no hydrogen 3.509 N/A ASN 34.A ND2 ARG 13.A O no hydrogen 3.031 N/A ASN 34.A ND2 THR 15.A OG1 no hydrogen 3.001 N/A VAL 35.A N ASP 33.A OD1 no hydrogen 3.076 N/A ASN 36.A ND2 ASP 33.A OD2 no hydrogen 3.027 N/A VAL 38.A N ASP 33.A O no hydrogen 3.414 N/A ARG 39.A NE SER 30.A OG no hydrogen 3.023 N/A ARG 39.A NH1 ASN 16.A O no hydrogen 3.200 N/A ARG 39.A NH2 ASN 16.A O no hydrogen 2.945 N/A ARG 39.A NH2 SER 30.A OG no hydrogen 2.584 N/A VAL 40.A N ALA 31.A O no hydrogen 2.583 N/A ALA 41.A N GLN 94.A O no hydrogen 2.932 N/A ILE 42.A N CYS 29.A O no hydrogen 2.824 N/A LYS 43.A N ILE 92.A O no hydrogen 2.697 N/A LYS 43.A NZ GLU 60.A OE1 no hydrogen 3.301 N/A LYS 44.A N MET 27.A O no hydrogen 2.923 N/A LYS 44.A NZ VAL 7.A O no hydrogen 2.912 N/A LYS 44.A NZ TYR 91.A OH no hydrogen 3.234 N/A ILE 45.A N VAL 90.A O no hydrogen 2.605 N/A SER 46.A N TYR 25.A O no hydrogen 3.377 N/A HIS 50.A N PRO 47.A O no hydrogen 3.419 N/A CYS 54.A N HIS 50.A O no hydrogen 3.365 N/A CYS 54.A N GLN 51.A O no hydrogen 2.987 N/A CYS 54.A SG PRO 47.A O no hydrogen 3.123 N/A CYS 54.A SG HIS 50.A O no hydrogen 3.755 N/A GLN 55.A N GLN 51.A O no hydrogen 3.097 N/A GLN 55.A NE2 GLN 51.A OE1 no hydrogen 2.847 N/A GLN 55.A NE2 ASP 315.A O no hydrogen 3.594 N/A ARG 56.A N THR 52.A O no hydrogen 2.997 N/A THR 57.A N TYR 53.A O no hydrogen 3.111 N/A THR 57.A OG1 TYR 53.A O no hydrogen 2.998 N/A LEU 58.A N CYS 54.A O no hydrogen 3.070 N/A ARG 59.A N GLN 55.A O no hydrogen 2.777 N/A ARG 59.A NH2 LEU 314.A O no hydrogen 3.565 N/A GLU 60.A N ARG 56.A O no hydrogen 3.219 N/A ILE 61.A N THR 57.A O no hydrogen 3.185 N/A LYS 62.A N LEU 58.A O no hydrogen 3.117 N/A LYS 62.A NZ ASP 311.A OD1 no hydrogen 2.865 N/A ILE 63.A N ARG 59.A O no hydrogen 3.267 N/A LEU 64.A N GLU 60.A O no hydrogen 3.037 N/A LEU 65.A N ILE 61.A O no hydrogen 3.077 N/A ARG 66.A N ILE 63.A O no hydrogen 3.193 N/A ARG 66.A NH1 LYS 62.A O no hydrogen 3.361 N/A ARG 66.A NH1 GLU 329.A OE1 no hydrogen 2.571 N/A ARG 66.A NH2 GLU 329.A OE1 no hydrogen 3.348 N/A ARG 66.A NH2 GLU 329.A OE2 no hydrogen 2.743 N/A PHE 67.A N ILE 63.A O no hydrogen 2.927 N/A ARG 68.A N TYR 127.A OH no hydrogen 3.075 N/A ASN 71.A N HIS 69.A ND1 no hydrogen 2.996 N/A ASN 71.A ND2 GLN 120.A OE1 no hydrogen 3.661 N/A ASN 71.A ND2 LEU 151.A O no hydrogen 2.822 N/A ILE 72.A N HIS 69.A O no hydrogen 3.054 N/A ILE 73.A N ILE 153.A O no hydrogen 2.988 N/A ASN 76.A N VAL 93.A O no hydrogen 2.682 N/A ASN 76.A ND2 ASP 95.A OD1 no hydrogen 2.959 N/A ILE 79.A N TYR 91.A O no hydrogen 2.748 N/A ARG 80.A NE THR 330.A OG1 no hydrogen 2.967 N/A ARG 80.A NH1 PHE 327.A O no hydrogen 2.266 N/A ARG 80.A NH1 THR 330.A OG1 no hydrogen 3.389 N/A ARG 80.A NH2 ALA 81.A O no hydrogen 3.394 N/A THR 83.A OG1 GLN 86.A OE1 no hydrogen 2.716 N/A GLN 86.A N THR 83.A O no hydrogen 3.329 N/A VAL 90.A N ILE 45.A O no hydrogen 2.569 N/A TYR 91.A N ILE 79.A O no hydrogen 2.945 N/A ILE 92.A N LYS 43.A O no hydrogen 3.021 N/A VAL 93.A N ASP 77.A O no hydrogen 2.723 N/A GLN 94.A N ALA 41.A O no hydrogen 2.784 N/A GLU 98.A N ASN 146.A OD1 no hydrogen 2.853 N/A THR 99.A N LEU 145.A O no hydrogen 2.967 N/A THR 99.A OG1 ASP 100.A O no hydrogen 3.429 N/A ASP 100.A N THR 99.A OG1 no hydrogen 2.590 N/A LEU 101.A N LEU 143.A O no hydrogen 3.031 N/A LYS 103.A N ASP 100.A OD1 no hydrogen 2.853 N/A LEU 104.A N ASP 100.A O no hydrogen 2.969 N/A LEU 105.A N LEU 101.A O no hydrogen 2.941 N/A LYS 106.A N TYR 102.A O no hydrogen 3.338 N/A LYS 106.A N LYS 103.A O no hydrogen 3.143 N/A THR 107.A N LEU 104.A O no hydrogen 3.341 N/A THR 107.A OG1 LYS 103.A O no hydrogen 3.548 N/A THR 107.A OG1 LEU 104.A O no hydrogen 3.315 N/A GLN 108.A N LEU 104.A O no hydrogen 2.939 N/A ASN 112.A ND2 ASP 262.A OD1 no hydrogen 3.332 N/A CYS 115.A N ASN 112.A O no hydrogen 2.978 N/A CYS 115.A SG TYR 291.A O no hydrogen 3.261 N/A TYR 116.A N ASP 113.A O no hydrogen 3.091 N/A LEU 118.A N ILE 114.A O no hydrogen 2.802 N/A TYR 119.A N CYS 115.A O no hydrogen 2.989 N/A TYR 119.A OH GLU 301.A OE2 no hydrogen 2.667 N/A GLN 120.A N TYR 116.A O no hydrogen 3.160 N/A GLN 120.A NE2 TYR 116.A O no hydrogen 3.290 N/A GLN 120.A NE2 THR 148.A O no hydrogen 3.126 N/A ILE 121.A N PHE 117.A O no hydrogen 3.063 N/A LEU 122.A N LEU 118.A O no hydrogen 3.114 N/A ARG 123.A N TYR 119.A O no hydrogen 2.792 N/A ARG 123.A NE ASP 300.A O no hydrogen 3.035 N/A ARG 123.A NH1 GLU 70.A OE2 no hydrogen 3.194 N/A ARG 123.A NH1 ASN 71.A OD1 no hydrogen 3.059 N/A ARG 123.A NH2 ASP 300.A O no hydrogen 2.901 N/A GLY 124.A N GLN 120.A O no hydrogen 3.137 N/A LEU 125.A N ILE 121.A O no hydrogen 2.843 N/A LYS 126.A N LEU 122.A O no hydrogen 2.819 N/A LYS 126.A NZ GLU 284.A OE1 no hydrogen 3.323 N/A LYS 126.A NZ GLU 284.A OE2 no hydrogen 3.526 N/A LYS 126.A NZ GLU 301.A OE1 no hydrogen 2.878 N/A TYR 127.A N ARG 123.A O no hydrogen 3.365 N/A ILE 128.A N GLY 124.A O no hydrogen 3.036 N/A HIS 129.A N LEU 125.A O no hydrogen 2.819 N/A HIS 129.A NE2 ASP 189.A OD2 no hydrogen 2.941 N/A SER 130.A N LYS 126.A O no hydrogen 2.965 N/A SER 130.A OG LYS 126.A O no hydrogen 3.204 N/A SER 130.A OG TYR 127.A O no hydrogen 2.587 N/A ALA 131.A N TYR 127.A O no hydrogen 3.179 N/A ALA 131.A N ILE 128.A O no hydrogen 3.214 N/A ASN 132.A N HIS 129.A O no hydrogen 2.940 N/A VAL 133.A N ILE 128.A O no hydrogen 3.095 N/A LEU 134.A N ARG 160.A O no hydrogen 2.705 N/A HIS 135.A N ASP 189.A OD2 no hydrogen 2.905 N/A HIS 135.A NE2 CYS 154.A O no hydrogen 2.868 N/A ARG 136.A N ASP 189.A OD1 no hydrogen 3.017 N/A ARG 136.A NH2 TYR 169.A O no hydrogen 3.087 N/A ASP 137.A N HIS 135.A ND1 no hydrogen 3.203 N/A LYS 139.A NZ THR 172.A OG1 no hydrogen 2.995 N/A ASN 142.A N LYS 139.A O no hydrogen 2.821 N/A ASN 142.A ND2 ASP 137.A O no hydrogen 2.842 N/A LEU 143.A N PRO 140.A O no hydrogen 2.929 N/A LEU 144.A N LYS 152.A O no hydrogen 2.790 N/A LEU 145.A N THR 99.A O no hydrogen 2.769 N/A ASN 146.A N ASP 150.A O no hydrogen 2.953 N/A ASN 146.A ND2 ASP 150.A OD2 no hydrogen 3.131 N/A CYS 149.A N THR 147.A OG1 no hydrogen 2.994 N/A ASP 150.A N THR 147.A O no hydrogen 3.323 N/A LEU 151.A N GLN 120.A OE1 no hydrogen 3.212 N/A LYS 152.A N LEU 144.A O no hydrogen 2.816 N/A LYS 152.A NZ GLU 70.A O no hydrogen 2.793 N/A ILE 153.A N ASN 71.A O no hydrogen 2.619 N/A CYS 154.A N ASN 142.A O no hydrogen 2.993 N/A CYS 154.A SG ASN 142.A O no hydrogen 3.613 N/A CYS 154.A SG ASN 142.A OD1 no hydrogen 3.974 N/A PHE 156.A N GLU 60.A OE2 no hydrogen 3.271 N/A ALA 159.A N PHE 156.A O no hydrogen 3.343 N/A ARG 160.A N LEU 134.A O no hydrogen 3.102 N/A ALA 162.A N ASN 132.A O no hydrogen 2.870 N/A ASP 163.A N TYR 184.A O no hydrogen 3.029 N/A HIS 166.A N ASP 163.A O no hydrogen 2.981 N/A THR 172.A N ASP 137.A OD1 no hydrogen 3.297 N/A THR 172.A OG1 ASP 137.A OD1 no hydrogen 2.739 N/A ARG 173.A NH1 GLY 209.A O no hydrogen 2.860 N/A TRP 174.A NE1 GLY 209.A O no hydrogen 2.992 N/A TYR 175.A N THR 172.A O no hydrogen 3.072 N/A TYR 175.A OH GLU 199.A OE1 no hydrogen 2.646 N/A ARG 176.A N ARG 173.A O no hydrogen 3.102 N/A ARG 176.A NE ALA 171.A O no hydrogen 3.239 N/A ARG 176.A NH2 ALA 171.A O no hydrogen 2.534 N/A GLU 179.A N GLU 179.A OE1 no hydrogen 2.614 N/A ILE 180.A N ALA 177.A O no hydrogen 3.160 N/A LEU 182.A N PRO 178.A O no hydrogen 3.106 N/A ASN 183.A N GLU 179.A O no hydrogen 2.843 N/A THR 185.A OG1 SER 187.A OG no hydrogen 2.967 N/A LYS 186.A NZ HIS 129.A O no hydrogen 2.802 N/A SER 187.A OG THR 185.A OG1 no hydrogen 2.967 N/A ILE 188.A N THR 185.A O no hydrogen 3.326 N/A ASP 189.A N LYS 186.A O no hydrogen 3.083 N/A TRP 191.A N SER 187.A O no hydrogen 3.195 N/A SER 192.A N ILE 188.A O no hydrogen 3.365 N/A SER 192.A OG TYR 175.A O no hydrogen 2.843 N/A SER 192.A OG ILE 188.A O no hydrogen 3.151 N/A VAL 193.A N ASP 189.A O no hydrogen 3.041 N/A GLY 194.A N ILE 190.A O no hydrogen 2.878 N/A CYS 195.A N TRP 191.A O no hydrogen 2.990 N/A CYS 195.A SG TRP 174.A O no hydrogen 3.666 N/A CYS 195.A SG TRP 191.A O no hydrogen 3.527 N/A ILE 196.A N SER 192.A O no hydrogen 2.912 N/A LEU 197.A N VAL 193.A O no hydrogen 2.732 N/A ALA 198.A N GLY 194.A O no hydrogen 2.927 N/A GLU 199.A N CYS 195.A O no hydrogen 3.006 N/A MET 200.A N ILE 196.A O no hydrogen 2.942 N/A LEU 201.A N LEU 197.A O no hydrogen 3.211 N/A LEU 201.A N ALA 198.A O no hydrogen 3.194 N/A SER 202.A N GLU 199.A O no hydrogen 3.385 N/A SER 202.A OG ALA 198.A O no hydrogen 3.489 N/A ASN 203.A N GLU 199.A O no hydrogen 2.736 N/A ASN 203.A ND2 LEU 105.A O no hydrogen 2.740 N/A ASN 203.A ND2 GLN 108.A O no hydrogen 2.580 N/A GLY 209.A N GLN 215.A OE1 no hydrogen 2.906 N/A LYS 210.A N ASP 214.A OD2 no hydrogen 2.919 N/A ASP 214.A N HIS 211.A ND1 no hydrogen 3.179 N/A GLN 215.A N HIS 211.A O no hydrogen 2.719 N/A GLN 215.A NE2 PHE 207.A O no hydrogen 2.756 N/A LEU 216.A N TYR 212.A O no hydrogen 3.037 N/A ASN 217.A N LEU 213.A O no hydrogen 3.042 N/A HIS 218.A N ASP 214.A O no hydrogen 2.989 N/A ILE 219.A N GLN 215.A O no hydrogen 3.173 N/A LEU 220.A N LEU 216.A O no hydrogen 2.933 N/A GLY 221.A N ASN 217.A O no hydrogen 2.804 N/A ILE 222.A N ILE 219.A O no hydrogen 3.201 N/A LEU 223.A N ILE 219.A O no hydrogen 2.993 N/A GLY 224.A N LEU 220.A O no hydrogen 2.762 N/A SER 225.A N LYS 249.A O no hydrogen 2.907 N/A ASP 230.A N SER 227.A OG no hydrogen 3.026 N/A LEU 231.A N SER 227.A O no hydrogen 2.744 N/A ASN 232.A N GLN 228.A O no hydrogen 2.958 N/A ILE 234.A N LEU 231.A O no hydrogen 3.004 N/A ILE 235.A N ASN 183.A OD1 no hydrogen 3.420 N/A ARG 240.A NE ILE 234.A O no hydrogen 2.704 N/A LYS 249.A N SER 225.A OG no hydrogen 2.933 N/A LYS 249.A NZ ASN 217.A O no hydrogen 3.156 N/A LYS 251.A NZ ASP 270.A OD1 no hydrogen 3.341 N/A VAL 252.A N ILE 222.A O no hydrogen 2.835 N/A TRP 254.A NE1 ASP 270.A OD1 no hydrogen 2.506 N/A ARG 256.A N PRO 253.A O no hydrogen 3.146 N/A LEU 257.A N PRO 253.A O no hydrogen 3.391 N/A PHE 258.A N TRP 254.A O no hydrogen 2.768 N/A ALA 261.A N PHE 258.A O no hydrogen 3.409 N/A LYS 264.A N ASP 262.A OD2 no hydrogen 2.773 N/A LYS 264.A NZ GLU 293.A OE2 no hydrogen 3.277 N/A LEU 266.A N ASP 262.A O no hydrogen 3.096 N/A ASP 267.A N SER 263.A O no hydrogen 2.994 N/A LEU 268.A N LYS 264.A O no hydrogen 3.003 N/A LEU 269.A N ALA 265.A O no hydrogen 2.721 N/A ASP 270.A N LEU 266.A O no hydrogen 2.908 N/A LYS 271.A N ASP 267.A O no hydrogen 3.187 N/A LYS 271.A NZ ASP 267.A OD2 no hydrogen 2.971 N/A MET 272.A N LEU 268.A O no hydrogen 3.046 N/A LEU 273.A N LEU 269.A O no hydrogen 3.041 N/A THR 274.A OG1 ASN 276.A O no hydrogen 3.183 N/A ASN 276.A ND2 ASP 230.A OD2 no hydrogen 3.447 N/A HIS 278.A N ASN 276.A OD1 no hydrogen 3.042 N/A LYS 279.A N ASN 276.A O no hydrogen 3.206 N/A LYS 279.A NZ GLU 229.A OE1 no hydrogen 3.125 N/A ARG 280.A N PRO 277.A O no hydrogen 3.320 N/A ARG 280.A NE THR 274.A O no hydrogen 3.052 N/A ARG 280.A NH1 GLU 179.A OE2 no hydrogen 2.647 N/A ARG 280.A NH1 SER 187.A O no hydrogen 2.773 N/A ARG 280.A NH2 GLU 179.A OE1 no hydrogen 2.826 N/A ARG 280.A NH2 GLU 179.A OE2 no hydrogen 3.379 N/A ARG 280.A NH2 THR 274.A O no hydrogen 3.186 N/A ARG 280.A NH2 PHE 275.A O no hydrogen 3.172 N/A ILE 281.A N LYS 271.A O no hydrogen 3.231 N/A GLU 282.A N GLN 285.A OE1 no hydrogen 3.000 N/A ALA 286.A N GLU 282.A O no hydrogen 2.836 N/A LEU 287.A N VAL 283.A O no hydrogen 3.174 N/A ALA 288.A N GLU 284.A O no hydrogen 3.226 N/A ALA 288.A N GLN 285.A O no hydrogen 3.150 N/A HIS 289.A N ALA 286.A O no hydrogen 3.092 N/A HIS 289.A NE2 ASP 267.A OD2 no hydrogen 2.735 N/A TYR 291.A N HIS 289.A ND1 no hydrogen 2.999 N/A TYR 291.A OH ASN 112.A O no hydrogen 3.405 N/A TYR 291.A OH ASN 112.A OD1 no hydrogen 3.057 N/A LEU 292.A N HIS 289.A O no hydrogen 2.941 N/A GLU 293.A N PRO 290.A O no hydrogen 3.000 N/A TYR 295.A N LEU 292.A O no hydrogen 2.977 N/A TYR 296.A N LEU 292.A O no hydrogen 2.936 N/A TYR 296.A OH GLU 284.A OE2 no hydrogen 2.593 N/A ASP 297.A N GLU 301.A OE2 no hydrogen 2.946 N/A SER 299.A N ASP 297.A OD1 no hydrogen 3.341 N/A SER 299.A OG ASP 297.A OD1 no hydrogen 2.768 N/A SER 299.A OG ASP 297.A OD2 no hydrogen 3.431 N/A ASP 300.A N ASP 297.A O no hydrogen 2.848 N/A ALA 304.A N SER 130.A OG no hydrogen 2.948 N/A PHE 308.A N ALA 131.A O no hydrogen 2.860 N/A LYS 309.A NZ GLU 313.A OE1 no hydrogen 3.032 N/A LYS 319.A NZ GLU 320.A OE2 no hydrogen 2.527 N/A LYS 321.A N PRO 318.A O no hydrogen 3.142 N/A LEU 322.A N PRO 318.A O no hydrogen 3.186 N/A LYS 323.A N LYS 319.A O no hydrogen 3.151 N/A LYS 323.A NZ ILE 84.A O no hydrogen 3.283 N/A LYS 323.A NZ MET 87.A O no hydrogen 2.840 N/A GLU 324.A N GLU 320.A O no hydrogen 3.397 N/A LEU 325.A N LYS 321.A O no hydrogen 3.185 N/A ILE 326.A N LEU 322.A O no hydrogen 2.830 N/A PHE 327.A N LYS 323.A O no hydrogen 2.807 N/A GLU 328.A N GLU 324.A O no hydrogen 2.922 N/A GLU 329.A N LEU 325.A O no hydrogen 3.119 N/A THR 330.A N ILE 326.A O no hydrogen 3.130 N/A THR 330.A OG1 ILE 326.A O no hydrogen 2.952 N/A THR 330.A OG1 PHE 327.A O no hydrogen 3.322 N/A ALA 331.A N GLU 328.A O no hydrogen 3.157 N/A PHE 333.A N THR 330.A O no hydrogen 3.378 N/A GLN 334.A N ALA 331.A O no hydrogen 2.931 N/A GLN 334.A NE2 ARG 80.A O no hydrogen 3.638 N/A