Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3pl2_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 3.A N ASP 126.A OD1 no hydrogen 2.877 N/A HIS 3.A ND1 ASP 126.A OD2 no hydrogen 2.624 N/A HIS 3.A NE2 ASP 77.A OD2 no hydrogen 2.747 N/A VAL 5.A N ASN 51.A O no hydrogen 3.217 N/A LEU 6.A N ILE 132.A O no hydrogen 2.886 N/A ALA 7.A N ALA 53.A O no hydrogen 2.943 N/A ILE 8.A N TRP 134.A O no hydrogen 2.766 N/A GLY 9.A N LEU 55.A O no hydrogen 3.091 N/A ARG 10.A NH1 ASP 167.A OD2 no hydrogen 2.763 N/A ARG 10.A NH2 ASP 167.A OD1 no hydrogen 3.114 N/A LEU 11.A N ASP 114.A OD2 no hydrogen 3.386 N/A GLY 12.A N GLY 35.A O no hydrogen 3.002 N/A VAL 13.A N PRO 90.A O no hydrogen 2.901 N/A ASP 14.A N TYR 33.A O no hydrogen 2.758 N/A ILE 15.A N THR 92.A O no hydrogen 2.866 N/A TYR 16.A N GLY 31.A O no hydrogen 3.320 N/A LEU 18.A N SER 29.A O no hydrogen 2.976 N/A GLN 19.A NE2 SER 29.A OG no hydrogen 2.968 N/A GLY 21.A N ILE 96.A O no hydrogen 2.670 N/A LEU 24.A N GLU 95.A OE2 no hydrogen 2.929 N/A ASP 26.A N GLY 23.A O no hydrogen 2.830 N/A VAL 27.A N LEU 24.A O no hydrogen 3.252 N/A GLN 28.A N GLN 19.A OE1 no hydrogen 2.753 N/A GLN 28.A NE2 ASP 26.A O no hydrogen 3.075 N/A SER 29.A N GLN 19.A OE1 no hydrogen 3.213 N/A GLY 31.A N TYR 16.A O no hydrogen 2.749 N/A TYR 33.A N ASP 14.A O no hydrogen 2.937 N/A GLY 35.A N GLY 12.A O no hydrogen 2.869 N/A SER 37.A OG ASP 256.A OD1 no hydrogen 2.650 N/A ALA 39.A N ARG 10.A O no hydrogen 3.308 N/A ASN 40.A N GLY 36.A O no hydrogen 2.850 N/A ASN 40.A ND2 ASP 256.A OD2 no hydrogen 3.003 N/A VAL 41.A N SER 37.A O no hydrogen 2.926 N/A SER 42.A N ALA 38.A O no hydrogen 2.933 N/A SER 42.A OG ALA 39.A O no hydrogen 2.685 N/A VAL 43.A N ALA 39.A O no hydrogen 2.995 N/A ALA 44.A N ASN 40.A O no hydrogen 2.920 N/A ALA 45.A N VAL 41.A O no hydrogen 2.960 N/A ALA 46.A N SER 42.A O no hydrogen 3.115 N/A ARG 47.A N VAL 43.A O no hydrogen 2.954 N/A ARG 47.A NH1 LEU 74.A O no hydrogen 2.872 N/A ARG 47.A NH2 LEU 74.A O no hydrogen 3.426 N/A HIS 48.A N ALA 44.A O no hydrogen 3.333 N/A HIS 48.A N ALA 45.A O no hydrogen 3.166 N/A HIS 48.A ND1 THR 298.A OG1 no hydrogen 2.741 N/A GLY 49.A N ALA 46.A O no hydrogen 2.867 N/A HIS 50.A N ALA 45.A O no hydrogen 3.244 N/A HIS 50.A ND1 GLU 4.A OE1 no hydrogen 2.819 N/A HIS 50.A NE2 HIS 264.A ND1 no hydrogen 2.874 N/A ASN 51.A N GLU 4.A OE2 no hydrogen 2.944 N/A SER 52.A OG HIS 50.A O no hydrogen 3.376 N/A ALA 53.A N VAL 5.A O no hydrogen 2.960 N/A LEU 55.A N ALA 7.A O no hydrogen 2.855 N/A SER 56.A N TYR 80.A O no hydrogen 3.391 N/A SER 56.A OG GLY 9.A O no hydrogen 2.699 N/A SER 56.A OG ARG 57.A O no hydrogen 3.517 N/A ARG 57.A NE ASP 121.A OD2 no hydrogen 2.901 N/A ARG 57.A NH1 ASP 84.A OD1 no hydrogen 2.833 N/A ARG 57.A NH2 ASP 121.A OD1 no hydrogen 3.083 N/A ARG 57.A NH2 ASP 121.A OD2 no hydrogen 3.258 N/A VAL 58.A N ALA 82.A O no hydrogen 3.055 N/A GLY 59.A N THR 89.A OG1 no hydrogen 2.870 N/A GLY 64.A N ASP 61.A OD1 no hydrogen 2.879 N/A GLU 65.A N ASP 61.A O no hydrogen 2.993 N/A TYR 66.A N PRO 62.A O no hydrogen 2.839 N/A LEU 67.A N PHE 63.A O no hydrogen 3.030 N/A LEU 68.A N GLY 64.A O no hydrogen 3.018 N/A ALA 69.A N GLU 65.A O no hydrogen 3.110 N/A GLU 70.A N TYR 66.A O no hydrogen 2.811 N/A LEU 71.A N LEU 67.A O no hydrogen 2.918 N/A GLU 72.A N LEU 68.A O no hydrogen 3.496 N/A ARG 73.A N ALA 69.A O no hydrogen 2.903 N/A ARG 73.A NE GLU 70.A OE1 no hydrogen 2.853 N/A ARG 73.A NH2 GLU 70.A OE2 no hydrogen 2.849 N/A LEU 74.A N GLU 70.A O no hydrogen 2.850 N/A GLY 75.A N GLU 72.A O no hydrogen 3.021 N/A VAL 76.A N LEU 71.A O no hydrogen 2.934 N/A ASP 77.A N SER 52.A O no hydrogen 2.845 N/A ASN 78.A ND2 LEU 68.A O no hydrogen 2.932 N/A GLN 79.A N ASP 77.A OD1 no hydrogen 3.059 N/A GLN 79.A NE2 ASP 77.A OD1 no hydrogen 3.424 N/A GLN 79.A NE2 ASP 77.A OD2 no hydrogen 2.663 N/A TYR 80.A OH ASP 126.A OD2 no hydrogen 2.636 N/A VAL 81.A N ASN 78.A O no hydrogen 2.933 N/A ASP 84.A N VAL 58.A O no hydrogen 2.795 N/A GLN 85.A NE2 THR 83.A O no hydrogen 3.165 N/A THR 86.A N ASP 84.A OD2 no hydrogen 3.106 N/A PHE 87.A N ASP 84.A OD2 no hydrogen 2.843 N/A THR 89.A N ASP 61.A OD2 no hydrogen 3.114 N/A THR 89.A OG1 ASP 61.A OD1 no hydrogen 2.637 N/A THR 89.A OG1 ASP 61.A OD2 no hydrogen 3.418 N/A THR 92.A N VAL 13.A O no hydrogen 2.926 N/A PHE 93.A N TYR 105.A O no hydrogen 2.928 N/A CYS 94.A SG GLU 95.A O no hydrogen 3.990 N/A GLU 95.A N PRO 103.A O no hydrogen 3.058 N/A PHE 97.A N ASP 101.A O no hydrogen 2.909 N/A ASP 101.A N PHE 97.A O no hydrogen 3.094 N/A TYR 105.A N PHE 93.A O no hydrogen 2.742 N/A TYR 105.A OH GLU 95.A OE1 no hydrogen 2.681 N/A TYR 107.A N VAL 91.A O no hydrogen 2.845 N/A ARG 108.A NH1 ASP 114.A OD2 no hydrogen 2.876 N/A ARG 108.A NH2 ASP 114.A OD1 no hydrogen 2.864 N/A LYS 111.A NZ GLU 143.A O no hydrogen 2.668 N/A LEU 115.A N ALA 112.A O no hydrogen 3.084 N/A ASN 116.A N PRO 113.A O no hydrogen 2.869 N/A ASN 116.A ND2 ASP 84.A OD1 no hydrogen 2.668 N/A GLU 118.A N ASP 121.A OD2 no hydrogen 3.136 N/A SER 119.A OG GLU 151.A OE1 no hydrogen 2.710 N/A ASP 121.A N GLU 118.A O no hydrogen 2.786 N/A VAL 122.A N SER 119.A O no hydrogen 3.110 N/A ASP 126.A N SER 123.A OG no hydrogen 3.076 N/A VAL 127.A N SER 123.A O no hydrogen 2.997 N/A ARG 128.A N LEU 124.A O no hydrogen 3.037 N/A ARG 128.A NH1.B THR 155.A OG1 no hydrogen 2.942 N/A ARG 128.A NH2.B ASP 125.A OD1 no hydrogen 2.835 N/A GLU 129.A N ASP 125.A O no hydrogen 2.846 N/A ALA 130.A N ASP 126.A O no hydrogen 2.803 N/A ILE 132.A N GLU 4.A O no hydrogen 2.854 N/A LEU 133.A N HIS 161.A O no hydrogen 3.046 N/A TRP 134.A N LEU 6.A O no hydrogen 2.821 N/A PHE 135.A N ILE 163.A O no hydrogen 3.121 N/A LEU 137.A N ASP 165.A O no hydrogen 2.993 N/A THR 138.A OG1 ASP 167.A OD2 no hydrogen 2.560 N/A GLY 139.A N THR 136.A O no hydrogen 3.265 N/A GLY 139.A N THR 136.A OG1 no hydrogen 3.252 N/A PHE 140.A N LEU 137.A O no hydrogen 2.951 N/A SER 141.A N THR 138.A O no hydrogen 2.875 N/A SER 141.A OG THR 138.A O no hydrogen 2.666 N/A SER 145.A N LEU 115.A O no hydrogen 3.290 N/A SER 145.A OG GLY 139.A O no hydrogen 2.584 N/A SER 145.A OG HIS 149.A ND1 no hydrogen 3.052 N/A ARG 146.A N GLU 142.A O no hydrogen 2.921 N/A ARG 146.A NE PHE 140.A O no hydrogen 2.765 N/A ARG 146.A NH2 PHE 140.A O no hydrogen 2.922 N/A ARG 146.A NH2 GLU 177.A OE2 no hydrogen 2.956 N/A GLY 147.A N GLU 143.A OE1 no hydrogen 2.802 N/A THR 148.A N PRO 144.A O no hydrogen 2.932 N/A THR 148.A OG1 ILE 117.A O no hydrogen 2.804 N/A THR 148.A OG1 PRO 144.A O no hydrogen 3.128 N/A HIS 149.A N SER 145.A O no hydrogen 2.796 N/A HIS 149.A ND1 SER 145.A O no hydrogen 2.671 N/A ARG 150.A N ARG 146.A O no hydrogen 2.960 N/A ARG 150.A NE GLN 181.A OE1 no hydrogen 3.406 N/A ARG 150.A NH2 GLN 181.A OE1 no hydrogen 3.137 N/A GLU 151.A N GLY 147.A O no hydrogen 2.927 N/A ILE 152.A N THR 148.A O no hydrogen 2.978 N/A LEU 153.A N HIS 149.A O no hydrogen 2.884 N/A THR 154.A N ARG 150.A O no hydrogen 2.934 N/A THR 154.A OG1 ARG 150.A O no hydrogen 2.708 N/A THR 155.A N GLU 151.A O no hydrogen 3.051 N/A ARG 156.A N ILE 152.A O no hydrogen 2.717 N/A ARG 156.A NE THR 162.A OG1 no hydrogen 2.912 N/A ARG 156.A NH1 VAL 127.A O no hydrogen 2.807 N/A ARG 156.A NH1 ALA 130.A O no hydrogen 2.678 N/A ARG 156.A NH2 ALA 130.A O no hydrogen 2.995 N/A ARG 156.A NH2 ASP 131.A O no hydrogen 3.280 N/A ARG 156.A NH2 HIS 161.A O no hydrogen 2.875 N/A ALA 157.A N LEU 153.A O no hydrogen 3.212 N/A ASN 158.A ND2 GLN 187.A O no hydrogen 3.021 N/A ARG 159.A N ARG 156.A O no hydrogen 3.358 N/A ARG 159.A NH1 THR 155.A O no hydrogen 3.234 N/A ARG 159.A NH1 ARG 156.A O no hydrogen 2.713 N/A HIS 161.A N ASP 131.A O no hydrogen 2.905 N/A THR 162.A N THR 190.A OG1 no hydrogen 2.742 N/A THR 162.A OG1 ARG 159.A O no hydrogen 2.649 N/A ILE 163.A N LEU 133.A O no hydrogen 2.831 N/A PHE 164.A N VAL 191.A O no hydrogen 2.838 N/A ASP 165.A N PHE 135.A O no hydrogen 2.772 N/A LEU 166.A N VAL 193.A O no hydrogen 2.863 N/A ASP 167.A N ASP 165.A OD1 no hydrogen 3.274 N/A TYR 168.A N GLU 198.A OE2 no hydrogen 3.272 N/A TRP 172.A N PRO 170.A O no hydrogen 3.090 N/A GLU 173.A N GLU 177.A OE1 no hydrogen 2.926 N/A GLU 177.A N SER 174.A OG no hydrogen 3.182 N/A ALA 178.A N SER 174.A O no hydrogen 3.375 N/A THR 179.A N PRO 175.A O no hydrogen 2.973 N/A THR 179.A OG1 PRO 175.A O no hydrogen 2.940 N/A THR 179.A OG1 ILE 201.A O no hydrogen 2.715 N/A LYS 180.A N GLU 176.A O no hydrogen 3.159 N/A GLN 181.A N GLU 177.A O no hydrogen 3.337 N/A ALA 182.A N ALA 178.A O no hydrogen 2.868 N/A GLU 183.A N THR 179.A O no hydrogen 2.896 N/A TRP 184.A N LYS 180.A O no hydrogen 3.370 N/A ALA 185.A N GLN 181.A O no hydrogen 3.026 N/A LEU 186.A N ALA 182.A O no hydrogen 2.903 N/A GLN 187.A N TRP 184.A O no hydrogen 3.130 N/A GLN 187.A NE2.B GLU 183.A OE2.B no hydrogen 3.499 N/A HIS 188.A N ALA 185.A O no hydrogen 3.112 N/A HIS 188.A ND1 TRP 184.A O no hydrogen 2.831 N/A SER 189.A N LEU 186.A O no hydrogen 3.290 N/A SER 189.A OG ALA 185.A O no hydrogen 2.717 N/A THR 190.A N THR 162.A O no hydrogen 2.836 N/A THR 190.A OG1 THR 162.A O no hydrogen 3.396 N/A VAL 191.A N THR 162.A O no hydrogen 2.991 N/A ALA 192.A N LEU 222.A O no hydrogen 3.045 N/A VAL 193.A N PHE 164.A O no hydrogen 3.010 N/A GLY 194.A N ILE 224.A O no hydrogen 3.056 N/A ASN 195.A N GLU 198.A OE1 no hydrogen 2.837 N/A LYS 196.A NZ GLN 227.A O no hydrogen 3.451 N/A GLU 198.A N ASN 195.A OD1 no hydrogen 2.964 N/A CYS 199.A N ASN 195.A O no hydrogen 2.847 N/A CYS 199.A SG GLY 194.A O no hydrogen 3.508 N/A CYS 199.A SG ASN 195.A O no hydrogen 3.293 N/A GLU 200.A N LYS 196.A O no hydrogen 2.967 N/A ILE 201.A N GLU 197.A O no hydrogen 2.928 N/A ALA 202.A N GLU 198.A O no hydrogen 2.906 N/A VAL 203.A N CYS 199.A O no hydrogen 2.849 N/A GLY 204.A N GLU 200.A O no hydrogen 2.885 N/A ALA 211.A N GLU 207.A O no hydrogen 2.816 N/A GLY 212.A N PRO 208.A O no hydrogen 2.945 N/A ARG 213.A N GLU 209.A O no hydrogen 3.129 N/A ALA 214.A N ARG 210.A O no hydrogen 2.970 N/A LEU 215.A N ALA 211.A O no hydrogen 2.916 N/A LEU 216.A N GLY 212.A O no hydrogen 2.853 N/A GLU 217.A N ARG 213.A O no hydrogen 3.023 N/A ARG 218.A N LEU 215.A O no hydrogen 3.108 N/A ARG 218.A NE GLU 183.A OE1.B no hydrogen 2.868 N/A ARG 218.A NH2 GLU 183.A OE1.B no hydrogen 3.180 N/A GLY 219.A N LEU 216.A O no hydrogen 2.936 N/A GLU 221.A N THR 190.A O no hydrogen 2.862 N/A LEU 222.A N THR 190.A O no hydrogen 3.208 N/A ILE 224.A N ALA 192.A O no hydrogen 2.772 N/A LYS 226.A N GLY 194.A O no hydrogen 2.918 N/A GLN 227.A N GLY 231.A O no hydrogen 2.817 N/A GLN 227.A NE2 VAL 225.A O no hydrogen 3.599 N/A LYS 230.A N GLN 227.A O no hydrogen 3.375 N/A GLY 231.A N GLY 228.A O no hydrogen 3.352 N/A VAL 232.A N VAL 241.A O no hydrogen 3.235 N/A ALA 233.A N VAL 239.A O no hydrogen 2.758 N/A THR 234.A OG1 GLU 237.A O no hydrogen 3.389 N/A LYS 235.A NZ ASP 236.A OD2 no hydrogen 3.382 N/A ASP 236.A N THR 234.A OG1 no hydrogen 3.125 N/A GLU 237.A N THR 234.A OG1 no hydrogen 3.121 N/A VAL 239.A N ALA 233.A O no hydrogen 2.755 N/A VAL 241.A N VAL 232.A O no hydrogen 2.986 N/A ILE 249.A N ALA 287.A O no hydrogen 2.863 N/A ASN 250.A N ALA 287.A O no hydrogen 3.161 N/A ASN 250.A ND2 LEU 290.A O no hydrogen 3.336 N/A LEU 252.A N ASN 250.A OD1 no hydrogen 2.992 N/A ALA 254.A N GLY 251.A O no hydrogen 3.068 N/A ASP 256.A N GLY 253.A O no hydrogen 3.056 N/A ALA 257.A N GLY 253.A O no hydrogen 3.191 N/A PHE 258.A N ALA 254.A O no hydrogen 3.006 N/A GLY 259.A N GLY 255.A O no hydrogen 2.898 N/A GLY 260.A N ASP 256.A O no hydrogen 2.911 N/A ALA 261.A N ALA 257.A O no hydrogen 2.991 N/A LEU 262.A N PHE 258.A O no hydrogen 2.750 N/A CYS 263.A N GLY 259.A O no hydrogen 3.025 N/A CYS 263.A SG GLY 259.A O no hydrogen 3.381 N/A HIS 264.A N GLY 260.A O no hydrogen 3.146 N/A HIS 264.A ND1 HIS 50.A NE2 no hydrogen 2.874 N/A GLY 265.A N ALA 261.A O no hydrogen 3.037 N/A LEU 266.A N LEU 262.A O no hydrogen 3.019 N/A LEU 267.A N CYS 263.A O no hydrogen 2.945 N/A SER 268.A N HIS 264.A O no hydrogen 2.887 N/A SER 268.A OG HIS 264.A O no hydrogen 2.761 N/A GLU 269.A N LEU 266.A O no hydrogen 3.382 N/A TRP 270.A N GLY 265.A O no hydrogen 3.309 N/A VAL 275.A N PRO 271.A O no hydrogen 2.904 N/A LEU 276.A N LEU 272.A O no hydrogen 3.015 N/A ARG 277.A N GLU 273.A O no hydrogen 2.955 N/A ARG 277.A NE GLU 273.A OE2 no hydrogen 3.313 N/A ARG 277.A NH2 GLU 273.A OE2 no hydrogen 3.358 N/A PHE 278.A N LYS 274.A O no hydrogen 2.954 N/A ALA 279.A N VAL 275.A O no hydrogen 2.861 N/A ASN 280.A N LEU 276.A O no hydrogen 2.819 N/A THR 281.A N ARG 277.A O no hydrogen 3.067 N/A THR 281.A OG1 ARG 277.A O no hydrogen 2.980 N/A ALA 282.A N PHE 278.A O no hydrogen 3.107 N/A GLY 283.A N ALA 279.A O no hydrogen 3.323 N/A ALA 284.A N ASN 280.A O no hydrogen 3.415 N/A LEU 285.A N THR 281.A O no hydrogen 3.108 N/A VAL 286.A N ALA 282.A O no hydrogen 3.294 N/A ALA 287.A N GLY 283.A O no hydrogen 3.027 N/A SER 288.A N ALA 284.A O no hydrogen 3.011 N/A SER 288.A OG ALA 284.A O no hydrogen 3.449 N/A SER 288.A OG LEU 285.A O no hydrogen 2.711 N/A ARG 289.A N VAL 286.A O no hydrogen 3.237 N/A ARG 289.A NE.A LEU 285.A O no hydrogen 3.451 N/A CYS 292.A SG LEU 252.A O no hydrogen 3.941 N/A CYS 292.A SG GLY 253.A O no hydrogen 3.868 N/A SER 293.A OG LEU 34.A O no hydrogen 2.728 N/A ALA 295.A N CYS 292.A O no hydrogen 2.807 N/A THR 298.A OG1 HIS 48.A ND1 no hydrogen 2.741 N/A VAL 301.A N THR 297.A O no hydrogen 3.108 N/A GLU 302.A N THR 298.A O no hydrogen 2.890 N/A ALA 303.A N ASP 299.A O no hydrogen 3.014 N/A SER 304.A N GLU 300.A O no hydrogen 3.345 N/A SER 304.A OG GLU 300.A O no hydrogen 3.357 N/A LEU 305.A N VAL 301.A O no hydrogen 2.997 N/A