Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4nrl_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 9.A OG ARG 337.A O no hydrogen 2.509 N/A SER 12.A OG SER 10.A O no hydrogen 3.083 N/A VAL 16.A N VAL 24.A O no hydrogen 3.110 N/A LYS 17.A NZ GLU 23.A OE2 no hydrogen 2.898 N/A THR 18.A N GLY 22.A O no hydrogen 2.931 N/A THR 18.A OG1 GLY 22.A O no hydrogen 2.915 N/A GLN 21.A N THR 18.A OG1 no hydrogen 2.814 N/A VAL 24.A N VAL 16.A O no hydrogen 2.926 N/A ASN 25.A ND2 SER 12.A O no hydrogen 2.655 N/A VAL 26.A N HIS 14.A O no hydrogen 2.878 N/A THR 27.A N THR 334.A O no hydrogen 3.120 N/A ILE 30.A N LEU 330.A O no hydrogen 2.490 N/A LEU 32.A N LEU 328.A O no hydrogen 3.181 N/A THR 35.A OG1 THR 310.A O no hydrogen 3.535 N/A THR 35.A OG1 THR 310.A OG1 no hydrogen 2.987 N/A ARG 38.A NH2 GLU 312.A OE1 no hydrogen 2.958 N/A SER 39.A N TYR 299.A O no hydrogen 2.797 N/A ASN 43.A N GLY 290.A O no hydrogen 2.942 N/A ASN 43.A ND2 GLY 290.A O no hydrogen 3.615 N/A LEU 44.A N THR 49.A OG1 no hydrogen 2.876 N/A LYS 45.A N ALA 292.A O no hydrogen 2.847 N/A THR 47.A N LEU 44.A O no hydrogen 3.012 N/A THR 47.A OG1 GLY 46.A O no hydrogen 2.748 N/A THR 49.A OG1 THR 47.A O no hydrogen 3.155 N/A ARG 50.A N VAL 81.A O no hydrogen 2.830 N/A ARG 50.A NH1 TYR 114.A O no hydrogen 2.795 N/A ARG 50.A NH2 PRO 77.A O no hydrogen 3.217 N/A ARG 50.A NH2 GLU 115.A O no hydrogen 2.791 N/A LEU 53.A N ASP 62.A OD1 no hydrogen 2.597 N/A CYS 54.A SG ASN 75.A O no hydrogen 3.661 N/A CYS 57.A N CYS 54.A O no hydrogen 3.074 N/A CYS 60.A SG PHE 58.A O no hydrogen 3.762 N/A CYS 60.A SG LYS 71.A O no hydrogen 3.855 N/A THR 61.A N ASP 64.A OD2 no hydrogen 3.105 N/A THR 61.A OG1 VAL 90.A O no hydrogen 2.684 N/A ASP 64.A N THR 61.A OG1 no hydrogen 3.005 N/A VAL 65.A N THR 61.A O no hydrogen 2.967 N/A ALA 66.A N ASP 62.A O no hydrogen 2.781 N/A LEU 67.A N LEU 63.A O no hydrogen 2.932 N/A GLY 68.A N VAL 65.A O no hydrogen 3.047 N/A ARG 69.A N ASP 64.A O no hydrogen 3.012 N/A ARG 69.A NH1 ASN 59.A O no hydrogen 3.256 N/A ARG 69.A NH1 ASP 64.A OD2 no hydrogen 3.183 N/A CYS 72.A N ARG 69.A O no hydrogen 2.924 N/A CYS 72.A SG PRO 70.A O no hydrogen 3.952 N/A SER 78.A OG ASN 116.A OD1 no hydrogen 2.385 N/A ALA 79.A N GLU 115.A O no hydrogen 3.164 N/A LYS 80.A NZ GLU 115.A OE2 no hydrogen 3.486 N/A SER 82.A N LYS 280.A O no hydrogen 2.727 N/A SER 82.A OG ARG 112.A O no hydrogen 3.225 N/A SER 82.A OG SER 279.A OG no hydrogen 2.622 N/A ILE 83.A N ARG 50.A O no hydrogen 2.935 N/A LEU 84.A N ILE 282.A O no hydrogen 2.794 N/A VAL 90.A N GLU 86.A OE2 no hydrogen 3.198 N/A THR 91.A N GLU 235.A OE1 no hydrogen 3.064 N/A THR 91.A OG1 HIS 99.A NE2 no hydrogen 3.043 N/A THR 91.A OG1 GLU 235.A O no hydrogen 2.775 N/A THR 91.A OG1 GLU 235.A OE1 no hydrogen 3.560 N/A SER 92.A N ASP 64.A OD1 no hydrogen 3.024 N/A SER 92.A N ASP 64.A OD2 no hydrogen 3.282 N/A SER 92.A OG ASP 64.A OD2 no hydrogen 2.500 N/A GLY 93.A N GLU 235.A O no hydrogen 3.288 N/A CYS 94.A N GLU 237.A OE1 no hydrogen 2.879 N/A TYR 95.A OH HIS 193.A NE2 no hydrogen 3.120 N/A MET 98.A N ILE 245.A O no hydrogen 3.039 N/A HIS 99.A NE2 THR 91.A OG1 no hydrogen 3.043 N/A ARG 101.A N MET 98.A O no hydrogen 3.347 N/A ARG 101.A NH1 GLN 226.A OE1 no hydrogen 2.582 N/A ARG 101.A NH2 GLN 226.A OE1 no hydrogen 2.912 N/A THR 102.A N HIS 99.A O no hydrogen 3.111 N/A THR 102.A OG1 HIS 99.A O no hydrogen 3.559 N/A THR 102.A OG1 VAL 247.A O no hydrogen 2.335 N/A LYS 103.A NZ ASP 248.A OD1 no hydrogen 2.959 N/A LYS 103.A NZ ASP 248.A OD2 no hydrogen 3.469 N/A LYS 103.A NZ TYR 249.A O no hydrogen 3.315 N/A ARG 105.A NH1 PRO 89.A O no hydrogen 2.678 N/A ARG 105.A NH1 GLU 235.A OE1 no hydrogen 2.952 N/A ARG 105.A NH2 GLU 235.A OE1 no hydrogen 3.358 N/A ARG 105.A NH2 GLU 235.A OE2 no hydrogen 2.611 N/A GLN 106.A N LYS 103.A O no hydrogen 3.176 N/A GLN 106.A NE2 VAL 87.A O no hydrogen 2.885 N/A LEU 107.A N ILE 104.A O no hydrogen 3.062 N/A ASN 109.A ND2 GLU 86.A O no hydrogen 2.885 N/A ASN 109.A ND2 GLN 106.A OE1 no hydrogen 2.874 N/A LEU 110.A N GLN 106.A O no hydrogen 2.795 N/A LEU 111.A N LEU 107.A O no hydrogen 3.000 N/A ARG 112.A N PRO 108.A O no hydrogen 3.106 N/A ARG 112.A NE ASN 109.A OD1 no hydrogen 3.036 N/A ARG 112.A NH1 GLY 51.A O no hydrogen 3.143 N/A ARG 112.A NH2 ASP 62.A OD2 no hydrogen 2.938 N/A ARG 112.A NH2 ASN 109.A OD1 no hydrogen 3.527 N/A GLY 113.A N LEU 110.A O no hydrogen 3.237 N/A TYR 114.A N LEU 111.A O no hydrogen 2.920 N/A TYR 114.A OH ASP 185.A OD2 no hydrogen 2.893 N/A ASN 116.A N SER 276.A O no hydrogen 2.986 N/A ASN 116.A ND2 SER 276.A O no hydrogen 3.561 N/A ASN 116.A ND2 SER 276.A OG no hydrogen 3.317 N/A ARG 118.A N CYS 274.A O no hydrogen 3.070 N/A ARG 118.A NE GLU 184.A OE2 no hydrogen 2.854 N/A ARG 118.A NH2 GLU 184.A OE1 no hydrogen 2.611 N/A ARG 118.A NH2 GLU 184.A OE2 no hydrogen 3.167 N/A SER 120.A N VAL 272.A O no hydrogen 2.564 N/A SER 120.A OG SER 122.A O no hydrogen 2.866 N/A VAL 124.A N GLN 270.A O no hydrogen 2.912 N/A GLU 128.A N ASN 126.A OD1 no hydrogen 3.507 N/A THR 129.A N ASN 126.A O no hydrogen 3.095 N/A THR 129.A OG1 ASN 126.A O no hydrogen 3.280 N/A TYR 135.A OH PRO 131.A O no hydrogen 2.820 N/A LYS 136.A N ILE 160.A O no hydrogen 2.716 N/A GLY 138.A N TRP 158.A O no hydrogen 2.734 N/A THR 139.A OG1 ASN 150.A O no hydrogen 3.399 N/A SER 140.A N GLY 151.A O no hydrogen 2.870 N/A SER 142.A N SER 140.A OG no hydrogen 2.907 N/A CYS 143.A N SER 140.A O no hydrogen 3.136 N/A ASN 145.A N GLY 149.A O no hydrogen 2.848 N/A THR 147.A N ASN 145.A OD1 no hydrogen 2.819 N/A THR 147.A OG1 ASN 145.A OD1 no hydrogen 3.162 N/A ASN 148.A N ASN 145.A O no hydrogen 2.734 N/A GLY 149.A N ASN 145.A OD1 no hydrogen 3.311 N/A GLY 151.A N SER 140.A O no hydrogen 3.230 N/A ASN 154.A N GLY 68.A O no hydrogen 2.702 N/A THR 155.A OG1 LEU 67.A O no hydrogen 2.403 N/A MET 156.A N PHE 153.A O no hydrogen 3.051 N/A ALA 157.A N LEU 268.A O no hydrogen 2.728 N/A TRP 158.A NE1 TYR 204.A OH no hydrogen 2.956 N/A ILE 160.A N LYS 136.A O no hydrogen 2.752 N/A LYS 162.A N PRO 134.A O no hydrogen 3.413 N/A ASN 165.A N LYS 162.A O no hydrogen 2.559 N/A ASN 165.A ND2 PRO 134.A O no hydrogen 3.169 N/A LYS 166.A NZ PRO 161.A O no hydrogen 2.911 N/A LYS 166.A NZ ARG 202.A O no hydrogen 3.552 N/A LYS 166.A NZ LEU 203.A O no hydrogen 2.791 N/A ILE 167.A N ASN 165.A O no hydrogen 2.721 N/A VAL 172.A N TYR 262.A O no hydrogen 2.930 N/A VAL 174.A N ILE 260.A O no hydrogen 3.024 N/A VAL 176.A N GLY 258.A O no hydrogen 2.601 N/A TYR 178.A OH SER 181.A O no hydrogen 2.877 N/A TYR 178.A OH GLU 184.A O no hydrogen 2.506 N/A ILE 179.A N GLN 186.A OE1 no hydrogen 2.877 N/A CYS 180.A SG GLN 186.A OE1 no hydrogen 3.946 N/A CYS 180.A SG TRP 273.A O no hydrogen 3.985 N/A SER 181.A N GLU 184.A OE1 no hydrogen 2.953 N/A GLU 184.A N SER 181.A O no hydrogen 3.006 N/A ASP 185.A N ALA 275.A O no hydrogen 2.643 N/A GLN 186.A N GLN 252.A O no hydrogen 2.789 N/A GLN 186.A NE2 PRO 177.A O no hydrogen 3.301 N/A GLN 186.A NE2 THR 188.A OG1 no hydrogen 3.033 N/A ILE 187.A N TRP 273.A O no hydrogen 2.895 N/A THR 188.A N MET 250.A O no hydrogen 2.704 N/A THR 188.A OG1 GLN 252.A OE1 no hydrogen 2.545 N/A TRP 190.A N ASP 248.A O no hydrogen 3.142 N/A GLY 191.A N LEU 267.A O no hydrogen 3.123 N/A PHE 192.A N VAL 246.A O no hydrogen 2.954 N/A HIS 193.A N GLY 265.A O no hydrogen 2.673 N/A HIS 193.A ND1 TYR 204.A OH no hydrogen 2.638 N/A HIS 193.A NE2 TYR 95.A OH no hydrogen 3.120 N/A SER 194.A N ARG 244.A O no hydrogen 2.806 N/A SER 194.A OG GLN 226.A O no hydrogen 2.715 N/A ASP 196.A N ASP 195.A OD1 no hydrogen 2.842 N/A LYS 197.A NZ GLU 201.A OE1 no hydrogen 3.428 N/A LYS 197.A NZ GLU 201.A OE2 no hydrogen 3.148 N/A GLN 199.A N ASP 196.A OD1 no hydrogen 2.905 N/A MET 200.A N ASP 196.A O no hydrogen 3.006 N/A GLU 201.A N LYS 197.A O no hydrogen 3.337 N/A ARG 202.A N THR 198.A O no hydrogen 3.004 N/A ARG 202.A NE GLN 199.A OE1 no hydrogen 2.786 N/A ARG 202.A NH2 GLN 199.A OE1 no hydrogen 3.237 N/A LEU 203.A N GLN 199.A O no hydrogen 2.687 N/A TYR 204.A N MET 200.A O no hydrogen 2.752 N/A TYR 204.A OH HIS 193.A ND1 no hydrogen 2.638 N/A GLY 205.A N MET 200.A O no hydrogen 3.221 N/A GLY 205.A N GLU 201.A O no hydrogen 3.005 N/A SER 207.A OG GLU 201.A OE2 no hydrogen 3.034 N/A ASN 208.A N ASP 206.A OD1 no hydrogen 2.771 N/A GLN 210.A N SER 225.A OG no hydrogen 2.621 N/A GLN 210.A NE2 ASP 206.A OD2 no hydrogen 3.191 N/A GLN 210.A NE2 ASN 208.A O no hydrogen 2.627 N/A LYS 211.A N GLN 263.A OE1 no hydrogen 2.837 N/A PHE 212.A N TYR 223.A O no hydrogen 2.892 N/A THR 213.A N VAL 261.A O no hydrogen 2.869 N/A THR 213.A OG1 HIS 222.A ND1 no hydrogen 2.847 N/A SER 214.A N THR 221.A O no hydrogen 3.070 N/A SER 214.A OG THR 221.A OG1 no hydrogen 2.696 N/A SER 215.A N THR 259.A O no hydrogen 2.955 N/A ALA 216.A N VAL 219.A O no hydrogen 3.060 N/A VAL 219.A N ALA 216.A O no hydrogen 2.870 N/A THR 221.A N SER 214.A O no hydrogen 3.175 N/A THR 221.A OG1 SER 214.A OG no hydrogen 2.696 N/A HIS 222.A ND1 THR 213.A OG1 no hydrogen 2.847 N/A TYR 223.A N PHE 212.A O no hydrogen 2.795 N/A TYR 223.A OH ASP 248.A OD2 no hydrogen 2.523 N/A SER 225.A N GLN 210.A O no hydrogen 2.746 N/A SER 225.A OG GLN 210.A O no hydrogen 3.516 N/A GLN 226.A NE2 GLY 228.A O no hydrogen 2.952 N/A GLY 228.A N ASP 195.A O no hydrogen 3.232 N/A GLN 233.A NE2 ASP 236.A OD1 no hydrogen 2.822 N/A GLN 233.A NE2 LEU 239.A O no hydrogen 3.069 N/A GLU 237.A N CYS 94.A O no hydrogen 3.012 N/A GLN 241.A N GLN 233.A OE1 no hydrogen 2.646 N/A GLN 241.A NE2 SER 142.A OG no hydrogen 2.819 N/A SER 242.A OG ASP 195.A OD1 no hydrogen 2.698 N/A SER 242.A OG ASP 195.A OD2 no hydrogen 3.416 N/A ARG 244.A N SER 194.A O no hydrogen 2.871 N/A ARG 244.A NE PRO 231.A O no hydrogen 3.281 N/A ARG 244.A NH1 GLN 241.A O no hydrogen 3.093 N/A ARG 244.A NH1 GLY 243.A O no hydrogen 2.956 N/A ARG 244.A NH2 PRO 231.A O no hydrogen 3.173 N/A ILE 245.A N PRO 96.A O no hydrogen 3.130 N/A VAL 246.A N PHE 192.A O no hydrogen 2.875 N/A ASP 248.A N TRP 190.A O no hydrogen 2.857 N/A TYR 249.A N ASP 248.A OD1 no hydrogen 2.766 N/A MET 250.A N THR 188.A O no hydrogen 2.655 N/A GLN 252.A N GLN 186.A O no hydrogen 2.674 N/A GLN 252.A NE2 VAL 176.A O no hydrogen 3.151 N/A GLN 252.A NE2 LYS 256.A O no hydrogen 2.848 N/A LYS 253.A NZ ASP 185.A OD2 no hydrogen 3.125 N/A LYS 256.A N LYS 253.A O no hydrogen 2.894 N/A LYS 256.A NZ ASN 217.A OD1 no hydrogen 2.878 N/A GLY 258.A N VAL 176.A O no hydrogen 3.081 N/A THR 259.A N SER 215.A O no hydrogen 3.084 N/A ILE 260.A N VAL 174.A O no hydrogen 3.025 N/A VAL 261.A N THR 213.A O no hydrogen 2.608 N/A TYR 262.A N VAL 172.A O no hydrogen 2.816 N/A TYR 262.A OH PRO 131.A O no hydrogen 2.749 N/A GLN 263.A NE2 ILE 169.A O no hydrogen 2.935 N/A ARG 264.A N GLN 210.A OE1 no hydrogen 3.021 N/A ARG 264.A NE ILE 167.A O no hydrogen 2.818 N/A ARG 264.A NH1 GLY 132.A O no hydrogen 3.187 N/A ARG 264.A NH2 ILE 167.A O no hydrogen 2.758 N/A LEU 267.A N GLY 191.A O no hydrogen 2.511 N/A LEU 268.A N ALA 157.A O no hydrogen 3.159 N/A GLN 270.A N THR 155.A O no hydrogen 2.676 N/A GLN 270.A NE2 ILE 125.A O no hydrogen 2.945 N/A GLN 270.A NE2 PRO 269.A O no hydrogen 2.936 N/A LYS 271.A NZ ASN 123.A OD1 no hydrogen 2.909 N/A VAL 272.A N SER 120.A OG no hydrogen 2.849 N/A TRP 273.A N ILE 187.A O no hydrogen 3.165 N/A TRP 273.A NE1 ALA 66.A O no hydrogen 2.689 N/A CYS 274.A N ARG 118.A O no hydrogen 2.699 N/A ALA 275.A N ASP 185.A O no hydrogen 2.940 N/A SER 276.A N ASN 116.A O no hydrogen 3.200 N/A SER 279.A N GLY 113.A O no hydrogen 2.763 N/A SER 279.A OG ALA 79.A O no hydrogen 2.940 N/A SER 279.A OG SER 82.A OG no hydrogen 2.622 N/A LYS 280.A N LYS 80.A O no hydrogen 2.891 N/A ILE 282.A N SER 82.A O no hydrogen 3.260 N/A LYS 283.A N GLU 297.A OE1 no hydrogen 2.728 N/A GLY 284.A N LEU 84.A O no hydrogen 2.977 N/A ILE 289.A N PHE 41.A O no hydrogen 2.826 N/A ALA 292.A N ASN 43.A O no hydrogen 3.075 N/A ASP 293.A N ASN 303.A OD1 no hydrogen 3.124 N/A CYS 294.A N LEU 302.A O no hydrogen 3.111 N/A CYS 294.A SG ILE 317.A O no hydrogen 3.797 N/A LEU 295.A N ILE 317.A O no hydrogen 2.931 N/A HIS 296.A N GLY 300.A O no hydrogen 2.826 N/A HIS 296.A NE2 TYR 309.A OH no hydrogen 2.991 N/A GLU 297.A N LYS 315.A O no hydrogen 3.109 N/A LYS 298.A N HIS 296.A ND1 no hydrogen 2.975 N/A TYR 299.A N HIS 296.A ND1 no hydrogen 3.207 N/A GLY 300.A N HIS 296.A O no hydrogen 2.660 N/A GLY 301.A N HIS 40.A O no hydrogen 3.198 N/A LEU 302.A N CYS 294.A O no hydrogen 3.007 N/A LYS 304.A N ASP 293.A OD2 no hydrogen 3.095 N/A LYS 306.A N SER 305.A OG no hydrogen 2.598 N/A TYR 308.A N LEU 32.A O no hydrogen 3.177 N/A TYR 309.A N ILE 322.A O no hydrogen 3.057 N/A THR 310.A N THR 34.A O no hydrogen 2.830 N/A THR 310.A OG1 THR 34.A O no hydrogen 3.467 N/A THR 310.A OG1 THR 35.A OG1 no hydrogen 2.987 N/A GLU 312.A N TYR 299.A OH no hydrogen 2.705 N/A ILE 317.A N LEU 295.A O no hydrogen 2.922 N/A ASN 319.A N ASP 293.A O no hydrogen 2.813 N/A CYS 320.A SG ILE 317.A O no hydrogen 3.404 N/A ILE 322.A N PRO 307.A O no hydrogen 3.043 N/A TRP 323.A NE1 GLY 311.A O no hydrogen 3.084 N/A VAL 324.A N TYR 309.A O no hydrogen 3.117 N/A LYS 329.A NZ PRO 327.A O no hydrogen 3.273 N/A LEU 330.A N ILE 30.A O no hydrogen 2.901 N/A ASN 332.A N GLY 28.A O no hydrogen 2.571 N/A THR 334.A N THR 27.A OG1 no hydrogen 3.111 N/A LYS 335.A NZ GLN 21.A OE1 no hydrogen 2.790 N/A TYR 336.A N ASN 25.A O no hydrogen 2.863 N/A