Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4k3e_H.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 2.A N SER 24.A O no hydrogen 3.175 N/A ARG 4.A N THR 22.A O no hydrogen 3.125 N/A GLU 5.A N GLU 5.A OE1 no hydrogen 2.829 N/A SER 6.A N THR 20.A O no hydrogen 2.794 N/A SER 6.A OG THR 20.A O no hydrogen 3.414 N/A VAL 11.A N.A THR 157.A O no hydrogen 3.002 N/A VAL 11.A N.B THR 157.A O no hydrogen 3.015 N/A GLN 12.A N GLN 15.A OE1 no hydrogen 3.071 N/A SER 14.A N VAL 81C.A O no hydrogen 2.801 N/A GLN 15.A N GLN 12.A O no hydrogen 3.179 N/A LEU 17.A N VAL 78.A O no hydrogen 2.832 N/A LEU 19.A N LEU 76.A O no hydrogen 2.830 N/A THR 20.A N SER 6.A O no hydrogen 2.948 N/A CYS 21.A N VAL 74.A O no hydrogen 2.744 N/A THR 22.A N ARG 4.A O no hydrogen 2.788 N/A ALA 23.A N SER 72.A O no hydrogen 3.336 N/A SER 24.A N GLN 2.A O no hydrogen 3.223 N/A SER 24.A OG GLN 2.A O no hydrogen 3.364 N/A VAL 30.A N ILE 47.A O no hydrogen 3.046 N/A GLY 31.A N THR 92.A O no hydrogen 2.775 N/A TRP 32.A N GLY 45.A O no hydrogen 2.771 N/A VAL 33.A N TYR 90.A O no hydrogen 2.957 N/A ARG 34.A N GLU 42.A O no hydrogen 2.941 N/A ARG 34.A NE GLU 42.A OE1 no hydrogen 2.705 N/A ARG 34.A NH1 ASP 85.A OD1 no hydrogen 2.718 N/A ARG 34.A NH1 TYR 89.A OH no hydrogen 3.302 N/A ARG 34.A NH2 GLU 42.A OE1 no hydrogen 2.868 N/A GLN 35.A N THR 88.A O no hydrogen 3.029 N/A GLN 35.A NE2 LYS 39.A O no hydrogen 2.932 N/A LYS 39.A N ALA 36.A O no hydrogen 3.029 N/A LYS 39.A NZ GLU 84.A OE1 no hydrogen 2.889 N/A GLU 42.A N ARG 34.A O no hydrogen 2.721 N/A LEU 44.A N TRP 32.A O no hydrogen 3.044 N/A SER 46.A N GLY 54.A O no hydrogen 2.909 N/A SER 46.A OG GLN 96.A OE1 no hydrogen 2.581 N/A ILE 47.A N VAL 30.A O no hydrogen 2.884 N/A ASP 48.A N SER 52.A O no hydrogen 3.215 N/A GLY 51.A N ASP 48.A O no hydrogen 2.913 N/A SER 52.A N ASP 48.A OD1 no hydrogen 3.093 N/A SER 52.A OG ASP 48.A OD1 no hydrogen 3.384 N/A SER 52.A OG ASP 48.A OD2 no hydrogen 2.614 N/A GLY 54.A N SER 46.A O no hydrogen 3.162 N/A ASN 56.A N LEU 44.A O no hydrogen 2.893 N/A ASN 56.A ND2 TRP 43.A O no hydrogen 2.974 N/A GLY 58.A N ASN 56.A OD1 no hydrogen 2.987 N/A LEU 59.A N ASN 56.A O no hydrogen 3.057 N/A LYS 60.A N PRO 57.A O no hydrogen 3.444 N/A ARG 62.A N LEU 59.A O no hydrogen 2.839 N/A ARG 62.A NE SER 79A.A O no hydrogen 3.302 N/A ARG 62.A NH1 ASP 85.A OD1 no hydrogen 3.337 N/A ARG 62.A NH2 ASP 85.A OD1 no hydrogen 3.371 N/A ARG 62.A NH2 ASP 85.A OD2 no hydrogen 2.790 N/A ARG 62.A NH2 SER 79A.A O no hydrogen 2.988 N/A LEU 63.A N LYS 60.A O no hydrogen 3.092 N/A SER 64.A N SER 77.A O no hydrogen 3.084 N/A ILE 65.A N TYR 55.A OH no hydrogen 2.746 N/A THR 66.A N SER 75.A O no hydrogen 3.324 N/A ASP 68.A N GLN 73.A O no hydrogen 2.874 N/A SER 70.A OG ASP 68.A OD2 no hydrogen 2.453 N/A SER 72.A N ASN 69.A O no hydrogen 3.116 N/A SER 72.A OG ASN 69.A O no hydrogen 3.441 N/A GLN 73.A N ASP 68.A O no hydrogen 3.141 N/A VAL 74.A N CYS 21.A O no hydrogen 3.113 N/A SER 75.A N THR 66.A O no hydrogen 2.858 N/A LEU 76.A N LEU 19.A O no hydrogen 2.916 N/A SER 77.A N SER 64.A O no hydrogen 2.874 N/A VAL 78.A N LEU 17.A O no hydrogen 2.827 N/A THR 82.A N ASP 85.A OD2 no hydrogen 2.865 N/A GLU 84.A N THR 82.A OG1 no hydrogen 3.162 N/A ASP 85.A N THR 82.A O no hydrogen 2.911 N/A SER 86.A N THR 83.A O no hydrogen 3.134 N/A SER 86.A OG THR 83.A O no hydrogen 3.445 N/A ALA 87.A N VAL 156.A O no hydrogen 2.965 N/A THR 88.A N GLN 35.A O no hydrogen 3.064 N/A TYR 89.A N LEU 154.A O no hydrogen 2.849 N/A TYR 89.A OH ASP 85.A O no hydrogen 2.684 N/A TYR 90.A N VAL 33.A O no hydrogen 2.633 N/A CYS 91.A N GLU 5.A OE2 no hydrogen 2.789 N/A THR 92.A N GLY 31.A O no hydrogen 2.822 N/A THR 92.A OG1 GLY 31.A O no hydrogen 2.924 N/A THR 93.A N ALA 149.A O no hydrogen 3.180 N/A VAL 94.A N ALA 29.A O no hydrogen 2.984 N/A HIS 95.A N HIS 146T.A O no hydrogen 2.695 N/A HIS 95.A NE2 GLU 144R.A OE1 no hydrogen 2.941 N/A GLU 97.A N GLU 144R.A O no hydrogen 3.166 N/A ARG 99.A N SER 142P.A O no hydrogen 2.997 N/A ARG 99.A NH2 GLU 144R.A OE2 no hydrogen 3.537 N/A SER 126.A N ASP 123X.A OD1 no hydrogen 2.996 N/A SER 126.A OG ASN 133G.A OD1 no hydrogen 2.656 N/A SER 126.A OG ASP 123X.A OD1 no hydrogen 2.777 N/A ALA 149.A N THR 93.A OG1 no hydrogen 3.015 N/A GLY 151.A N CYS 91.A O no hydrogen 2.911 N/A ARG 152.A NH1 ARG 152.A O no hydrogen 2.527 N/A GLY 153.A N GLU 5.A OE1 no hydrogen 2.853 N/A LEU 154.A N TYR 89.A O no hydrogen 2.957 N/A VAL 156.A N ALA 87.A O no hydrogen 2.868 N/A THR 157.A N SER 9.A O no hydrogen 2.818 N/A VAL 158.A N SER 86.A OG no hydrogen 2.777 N/A SER 159.A N VAL 11.A O.A no hydrogen 2.726 N/A SER 159.A N VAL 11.A O.B no hydrogen 2.743 N/A ALA 161.A N SER 159.A OG no hydrogen 2.972 N/A SER 162.A OG.A THR 163.A O no hydrogen 3.320 N/A THR 164.A N MET 193.A O no hydrogen 2.798 N/A LYS 167.A N SER 190.A O no hydrogen 2.866 N/A TYR 169.A N LEU 188.A O no hydrogen 2.880 N/A LEU 171.A N GLY 186.A O no hydrogen 2.792 N/A ASP 177.A N CYS 174.A O no hydrogen 3.207 N/A LYS 178.A N GLY 176.A O no hydrogen 2.526 N/A SER 179.A OG SER 179.A O no hydrogen 2.539 N/A SER 180.A OG THR 182.A O no hydrogen 3.565 N/A THR 182.A N SER 180.A OG no hydrogen 3.147 N/A VAL 183.A N VAL 231.A O no hydrogen 2.565 N/A LEU 185.A N VAL 229.A O no hydrogen 2.834 N/A GLY 186.A N LEU 171.A O no hydrogen 3.094 N/A CYS 187.A N SER 227.A O no hydrogen 2.805 N/A LEU 188.A N TYR 169.A O no hydrogen 2.739 N/A VAL 189.A N LEU 225.A O no hydrogen 2.701 N/A SER 190.A N LYS 167.A O no hydrogen 2.721 N/A SER 190.A OG SER 191.A OG no hydrogen 2.982 N/A SER 191.A N SER 224.A OG no hydrogen 2.960 N/A SER 191.A OG SER 190.A OG no hydrogen 2.982 N/A TYR 192.A N TYR 223.A O no hydrogen 2.830 N/A TYR 192.A OH GLU 195.A OE2 no hydrogen 2.990 N/A MET 193.A N THR 164.A O no hydrogen 3.080 N/A THR 198.A N ALA 245.A O no hydrogen 2.868 N/A THR 200.A N ASN 243.A O no hydrogen 3.000 N/A THR 200.A OG1 ASN 243.A OD1 no hydrogen 2.978 N/A TRP 201.A NE1 SER 227.A OG no hydrogen 2.927 N/A ASN 202.A N THR 241.A O no hydrogen 2.677 N/A ASN 202.A ND2 THR 239.A O.A no hydrogen 3.071 N/A ASN 202.A ND2 THR 239.A O.B no hydrogen 3.137 N/A SER 203.A N ASN 243.A OD1 no hydrogen 2.580 N/A GLY 204.A N TRP 201.A O no hydrogen 2.956 N/A ALA 205.A N ASN 202.A O no hydrogen 3.061 N/A LEU 206.A N TRP 201.A O no hydrogen 3.175 N/A LYS 207.A NZ GLY 204.A O no hydrogen 2.514 N/A HIS 211.A N MET 228.A O no hydrogen 2.736 N/A THR 212.A OG1 SER 227.A OG no hydrogen 2.805 N/A PHE 213.A N SER 226.A O no hydrogen 2.856 N/A VAL 216.A N SER 224.A O no hydrogen 2.711 N/A GLN 218.A N LEU 222.A O no hydrogen 3.101 N/A GLY 221.A N GLN 218.A O no hydrogen 2.842 N/A TYR 223.A N TYR 192.A O no hydrogen 2.634 N/A SER 224.A N VAL 216.A O no hydrogen 2.958 N/A LEU 225.A N VAL 189.A O no hydrogen 2.966 N/A SER 227.A N CYS 187.A O no hydrogen 3.117 N/A SER 227.A OG THR 212.A OG1 no hydrogen 2.805 N/A MET 228.A N HIS 211.A O no hydrogen 2.808 N/A VAL 229.A N LEU 185.A O no hydrogen 2.699 N/A THR 230.A N GLY 209.A O no hydrogen 3.055 N/A THR 230.A OG1 GLY 209.A O no hydrogen 3.547 N/A VAL 231.A N VAL 183.A O no hydrogen 2.613 N/A THR 235.A N PRO 232.A O no hydrogen 2.989 N/A THR 241.A N ASN 202.A OD1 no hydrogen 2.908 N/A CYS 242.A N LYS 255.A O no hydrogen 3.010 N/A CYS 242.A SG LYS 255.A O no hydrogen 3.807 N/A ASN 243.A N THR 200.A O no hydrogen 2.810 N/A ASN 243.A ND2 ASP 254.A OD2 no hydrogen 2.615 N/A VAL 244.A N VAL 253.A O no hydrogen 2.760 N/A ALA 245.A N THR 198.A O no hydrogen 2.827 N/A HIS 246.A N THR 251.A O no hydrogen 2.909 N/A HIS 246.A ND1 SER 249.A OG no hydrogen 2.854 N/A HIS 246.A NE2 PRO 194.A O no hydrogen 2.765 N/A SER 249.A N HIS 246.A O no hydrogen 3.086 N/A SER 249.A OG HIS 246.A ND1 no hydrogen 2.854 N/A SER 249.A OG HIS 246.A O no hydrogen 3.340 N/A SER 249.A OG THR 251.A OG1 no hydrogen 2.749 N/A SER 250.A N PRO 247.A O no hydrogen 3.042 N/A THR 251.A N HIS 246.A O no hydrogen 3.450 N/A THR 251.A OG1 SER 249.A OG no hydrogen 2.749 N/A VAL 253.A N VAL 244.A O no hydrogen 2.802 N/A LYS 255.A N CYS 242.A O no hydrogen 2.995 N/A VAL 257.A N PHE 240.A O no hydrogen 2.827 N/A CYS 262.A SG LYS 260.A O no hydrogen 3.495 N/A SER 79A.A N ARG 62.A O no hydrogen 2.980 N/A SER 79A.A OG ARG 62.A O no hydrogen 3.264 N/A CYS 127A.A N ASP 123X.A O no hydrogen 3.121 N/A CYS 127A.A SG ARG 135I.A O no hydrogen 3.585 N/A CYS 127A.A SG ASN 122W.A OD1 no hydrogen 3.331 N/A THR 101B.A N ILE 140N.A O no hydrogen 3.217 N/A THR 101B.A OG1 ARG 99.A O no hydrogen 3.221 N/A TYR 128B.A N CYS 124Y.A O no hydrogen 2.938 N/A VAL 81C.A N GLN 15.A O no hydrogen 3.111 N/A TYR 129C.A N ASN 125Z.A O no hydrogen 2.891 N/A TRP 131E.A N SER 126.A O no hydrogen 2.787 N/A ILE 107H.A N VAL 121V.A O no hydrogen 2.763 N/A CYS 134H.A N TRP 131E.A O no hydrogen 2.960 N/A ARG 135I.A N ASN 122W.A OD1 no hydrogen 2.851 N/A ARG 135I.A NH1 ARG 132F.A O no hydrogen 2.967 N/A ARG 135I.A NH1 CYS 134H.A O no hydrogen 2.469 N/A VAL 109J.A N GLY 119T.A O no hydrogen 3.007 N/A ARG 136J.A NH2 CYS 127A.A O no hydrogen 2.712 N/A GLN 137K.A N CYS 120U.A O no hydrogen 2.922 N/A SER 111L.A N ALA 108I.A O no hydrogen 2.999 N/A SER 111L.A OG ALA 108I.A O no hydrogen 2.621 N/A CYS 112M.A N VAL 109J.A O no hydrogen 3.122 N/A CYS 112M.A SG ALA 108I.A O no hydrogen 4.049 N/A GLY 113N.A N ASP 110K.A O no hydrogen 3.371 N/A ILE 140N.A N THR 101B.A O no hydrogen 3.249 N/A SER 142P.A N ARG 99.A O no hydrogen 3.045 N/A GLU 144R.A N GLU 97.A O no hydrogen 2.768 N/A HIS 146T.A N HIS 95.A O no hydrogen 3.225 N/A HIS 146T.A NE2 ASP 148V.A OD1 no hydrogen 2.754 N/A CYS 120U.A N GLN 137K.A O no hydrogen 2.802 N/A CYS 120U.A SG PRO 138L.A O no hydrogen 3.836 N/A VAL 121V.A N ILE 107H.A O no hydrogen 2.963 N/A ASP 148V.A N THR 93.A O no hydrogen 2.809 N/A ASN 122W.A N ARG 135I.A O no hydrogen 2.989 N/A ASN 122W.A ND2 ASN 133G.A O no hydrogen 3.004 N/A