Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2hkh_L.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 1.A N ASP 1.A OD1 no hydrogen 2.669 N/A VAL 3.A N SER 26.A OG no hydrogen 3.053 N/A THR 5.A N ARG 24.A O no hydrogen 2.761 N/A GLN 6.A NE2 TYR 91.A O no hydrogen 2.819 N/A GLN 6.A NE2 THR 107.A OG1 no hydrogen 3.118 N/A THR 7.A N SER 22.A O no hydrogen 3.108 N/A LEU 11.A N LYS 108.A O no hydrogen 2.969 N/A VAL 13.A N GLU 110.A O no hydrogen 2.722 N/A GLY 16.A N VAL 83.A O no hydrogen 2.901 N/A ASP 17.A N SER 14.A O no hydrogen 3.046 N/A ALA 19.A N ILE 80.A O no hydrogen 3.020 N/A SER 20.A OG GLN 18.A OE1 no hydrogen 2.652 N/A ILE 21.A N LEU 78.A O no hydrogen 2.693 N/A SER 22.A N THR 7.A O no hydrogen 3.077 N/A SER 22.A OG THR 7.A O no hydrogen 2.925 N/A CYS 23.A N PHE 76.A O no hydrogen 2.857 N/A ARG 24.A N THR 5.A O no hydrogen 2.915 N/A ARG 24.A NE ASP 75.A OD2 no hydrogen 2.618 N/A SER 25.A N THR 74.A O no hydrogen 3.055 N/A SER 25.A OG GLN 27.A O no hydrogen 2.814 N/A SER 25.A OG THR 74.A O no hydrogen 3.499 N/A SER 25.A OG THR 74.A OG1 no hydrogen 2.940 N/A SER 26.A N VAL 3.A O no hydrogen 2.935 N/A LEU 29.A N GLY 73.A O no hydrogen 2.912 N/A VAL 30.A N SER 28.A OG no hydrogen 3.297 N/A HIS 31.A N ASN 35.A O no hydrogen 2.695 N/A ASN 33.A N HIS 31.A ND1 no hydrogen 3.111 N/A ASN 33.A ND2 TYR 37.A OH no hydrogen 2.800 N/A GLY 34.A N HIS 31.A O no hydrogen 3.002 N/A ASN 35.A N ASN 33.A OD1 no hydrogen 2.943 N/A ASN 35.A ND2 TYR 37.A OH no hydrogen 3.365 N/A TYR 37.A N THR 97.A OG1 no hydrogen 3.270 N/A LEU 38.A N THR 36.A O no hydrogen 3.084 N/A HIS 39.A N SER 94.A O no hydrogen 2.925 N/A HIS 39.A NE2 SER 96.A OG no hydrogen 2.984 N/A TRP 40.A N ILE 53.A O no hydrogen 2.848 N/A TYR 41.A N PHE 92.A O no hydrogen 2.758 N/A LEU 42.A N ASN 50.A O no hydrogen 2.907 N/A GLN 43.A N VAL 90.A O no hydrogen 2.929 N/A GLN 43.A NE2 GLN 47.A O no hydrogen 3.074 N/A LYS 44.A NZ GLU 86.A O no hydrogen 3.077 N/A GLN 47.A N LYS 44.A O no hydrogen 3.141 N/A ASN 50.A N LEU 42.A O no hydrogen 2.675 N/A LEU 52.A N TRP 40.A O no hydrogen 2.895 N/A ILE 53.A N TRP 40.A O no hydrogen 3.296 N/A TYR 54.A N ASN 58.A O no hydrogen 2.735 N/A LYS 55.A N HIS 39.A ND1 no hydrogen 3.469 N/A VAL 56.A N LEU 38.A O no hydrogen 2.648 N/A SER 57.A N LYS 55.A O no hydrogen 2.824 N/A ASN 58.A N TYR 54.A O no hydrogen 2.895 N/A ASN 58.A ND2 TYR 54.A O no hydrogen 3.624 N/A ASN 58.A ND2 LYS 55.A O no hydrogen 3.621 N/A ARG 59.A NH1 VAL 63.A O no hydrogen 2.957 N/A PHE 60.A N LEU 52.A O no hydrogen 2.896 N/A VAL 63.A N PHE 60.A O no hydrogen 2.976 N/A ARG 66.A NE ASP 87.A OD1 no hydrogen 3.473 N/A ARG 66.A NE ASP 87.A OD2 no hydrogen 2.954 N/A ARG 66.A NH2 GLU 86.A OE1 no hydrogen 2.910 N/A ARG 66.A NH2 ASP 87.A OD1 no hydrogen 2.927 N/A PHE 67.A N PRO 64.A O no hydrogen 3.172 N/A SER 68.A N LYS 79.A O no hydrogen 3.037 N/A SER 70.A N THR 77.A O no hydrogen 2.852 N/A SER 70.A OG THR 77.A O no hydrogen 3.495 N/A SER 72.A N ASP 75.A O no hydrogen 2.893 N/A THR 74.A OG1 SER 25.A O no hydrogen 2.712 N/A THR 74.A OG1 SER 25.A OG no hydrogen 2.940 N/A THR 74.A OG1 GLN 27.A O no hydrogen 3.444 N/A ASP 75.A N SER 72.A O no hydrogen 2.972 N/A PHE 76.A N CYS 23.A O no hydrogen 2.916 N/A THR 77.A N SER 70.A O no hydrogen 2.993 N/A LEU 78.A N ILE 21.A O no hydrogen 2.810 N/A LYS 79.A N SER 68.A O no hydrogen 2.893 N/A LYS 79.A NZ SER 20.A OG no hydrogen 3.008 N/A ILE 80.A N ALA 19.A O no hydrogen 2.637 N/A SER 81.A N ARG 66.A O no hydrogen 2.763 N/A VAL 83.A N ASP 17.A O no hydrogen 3.011 N/A GLU 84.A N ASP 87.A OD2 no hydrogen 2.945 N/A ASP 87.A N GLU 84.A O no hydrogen 2.827 N/A LEU 88.A N ALA 85.A O no hydrogen 3.101 N/A VAL 90.A N GLN 43.A O no hydrogen 2.841 N/A TYR 91.A N THR 107.A O no hydrogen 2.799 N/A TYR 91.A OH ASP 87.A O no hydrogen 2.459 N/A PHE 92.A N TYR 41.A O no hydrogen 2.829 N/A CYS 93.A N GLN 6.A OE1 no hydrogen 3.063 N/A SER 94.A N HIS 39.A O no hydrogen 2.881 N/A SER 94.A OG THR 102.A O no hydrogen 3.317 N/A GLN 95.A N THR 102.A O no hydrogen 2.936 N/A GLN 95.A NE2 HIS 98.A O no hydrogen 2.902 N/A GLN 95.A NE2 THR 102.A OG1 no hydrogen 3.348 N/A SER 96.A N TYR 37.A O no hydrogen 3.013 N/A SER 96.A OG HIS 39.A NE2 no hydrogen 2.984 N/A THR 97.A N GLN 95.A OE1 no hydrogen 2.816 N/A THR 97.A OG1 LEU 29.A O no hydrogen 2.561 N/A HIS 98.A N GLN 95.A OE1 no hydrogen 2.961 N/A HIS 98.A NE2 SER 28.A O no hydrogen 2.737 N/A THR 102.A N GLN 95.A O no hydrogen 3.290 N/A THR 102.A OG1 VAL 2.A O no hydrogen 2.734 N/A GLY 104.A N CYS 93.A O no hydrogen 2.767 N/A GLY 106.A N GLN 6.A OE1 no hydrogen 3.194 N/A THR 107.A N TYR 91.A O no hydrogen 2.972 N/A THR 107.A OG1 PRO 8.A O no hydrogen 2.653 N/A LYS 108.A N LEU 9.A O no hydrogen 3.266 N/A LEU 109.A N GLY 89.A O no hydrogen 2.660 N/A GLU 110.A N LEU 11.A O no hydrogen 3.164 N/A ILE 111.A N GLN 171.A OE1 no hydrogen 2.869 N/A LYS 112.A N VAL 13.A O no hydrogen 2.826 N/A ARG 113.A NE ALA 114.A O no hydrogen 2.468 N/A ARG 113.A NH1 ASP 175.A O no hydrogen 2.786 N/A ARG 113.A NH2 ALA 114.A O no hydrogen 3.046 N/A ALA 116.A N TYR 145.A O no hydrogen 2.966 N/A THR 119.A N ASN 142.A O no hydrogen 2.919 N/A SER 121.A N PHE 140.A O no hydrogen 2.947 N/A PHE 123.A N VAL 138.A O no hydrogen 2.803 N/A SER 127.A OG GLU 128.A OE1 no hydrogen 3.492 N/A GLU 128.A N GLU 128.A OE1 no hydrogen 2.955 N/A GLN 129.A N SER 126.A OG no hydrogen 3.158 N/A GLN 129.A NE2 SER 136.A OG no hydrogen 2.959 N/A LEU 130.A N SER 126.A O no hydrogen 3.010 N/A THR 131.A N SER 127.A O no hydrogen 2.993 N/A THR 131.A OG1 SER 127.A O no hydrogen 2.700 N/A SER 132.A N GLN 129.A O no hydrogen 3.166 N/A SER 132.A OG GLN 129.A O no hydrogen 2.818 N/A GLY 133.A N LEU 130.A O no hydrogen 3.131 N/A GLY 134.A N GLN 129.A O no hydrogen 3.359 N/A ALA 135.A N LEU 186.A O no hydrogen 3.066 N/A SER 136.A N GLN 129.A OE1 no hydrogen 2.975 N/A SER 136.A OG THR 185.A OG1 no hydrogen 3.010 N/A VAL 137.A N LEU 184.A O no hydrogen 2.879 N/A VAL 138.A N PHE 123.A O no hydrogen 3.144 N/A CYS 139.A N SER 182.A O no hydrogen 2.693 N/A CYS 139.A SG SER 121.A O no hydrogen 3.489 N/A PHE 140.A N SER 121.A O no hydrogen 2.879 N/A LEU 141.A N MET 180.A O no hydrogen 2.820 N/A ASN 142.A N THR 119.A O no hydrogen 2.912 N/A ASN 143.A N SER 179.A OG no hydrogen 3.084 N/A ASN 143.A ND2 ASP 175.A OD2 no hydrogen 2.907 N/A PHE 144.A N TYR 178.A O no hydrogen 2.805 N/A TYR 145.A N ALA 116.A O no hydrogen 2.974 N/A TYR 145.A OH GLU 110.A OE2 no hydrogen 2.715 N/A TYR 145.A OH ILE 111.A O no hydrogen 3.125 N/A LYS 147.A NZ THR 169.A O no hydrogen 3.254 N/A ASN 150.A N THR 202.A O no hydrogen 3.359 N/A LYS 152.A N GLU 200.A O no hydrogen 2.668 N/A LYS 152.A NZ GLU 159.A OE1 no hydrogen 2.700 N/A LYS 152.A NZ GLU 159.A OE2 no hydrogen 3.339 N/A TRP 153.A NE1 SER 182.A OG no hydrogen 2.899 N/A LYS 154.A N THR 198.A O no hydrogen 2.847 N/A LYS 154.A NZ GLU 200.A OE1 no hydrogen 2.850 N/A LYS 154.A NZ GLU 200.A OE2 no hydrogen 3.443 N/A ILE 155.A N SER 158.A O no hydrogen 2.858 N/A ASP 156.A N SER 196.A O no hydrogen 2.753 N/A SER 158.A N ILE 155.A O no hydrogen 3.194 N/A ARG 160.A N TRP 153.A O no hydrogen 2.953 N/A ARG 160.A NE ASN 162.A O no hydrogen 2.929 N/A ARG 160.A NH1 GLU 190.A OE1 no hydrogen 2.473 N/A ARG 160.A NH2 GLU 190.A OE1 no hydrogen 2.897 N/A ARG 160.A NH2 GLU 190.A OE2 no hydrogen 2.883 N/A LEU 165.A N THR 183.A O no hydrogen 3.068 N/A SER 167.A N SER 181.A O no hydrogen 2.805 N/A THR 169.A N SER 179.A O no hydrogen 3.142 N/A THR 169.A OG1 ASP 170.A O no hydrogen 3.317 N/A THR 169.A OG1 SER 179.A O no hydrogen 3.169 N/A GLN 171.A NE2 ILE 111.A O no hydrogen 2.754 N/A GLN 171.A NE2 SER 176.A O no hydrogen 3.200 N/A ASP 172.A N THR 177.A O no hydrogen 2.803 N/A LYS 174.A N ASP 172.A OD1 no hydrogen 2.616 N/A LYS 174.A NZ LYS 174.A O no hydrogen 3.400 N/A ASP 175.A N ASP 172.A OD1 no hydrogen 2.904 N/A SER 176.A N ASP 172.A O no hydrogen 3.167 N/A THR 177.A N ASP 175.A OD1 no hydrogen 2.962 N/A THR 177.A OG1 ASP 175.A OD1 no hydrogen 2.511 N/A THR 177.A OG1 ASP 175.A OD2 no hydrogen 3.123 N/A TYR 178.A N PHE 144.A O no hydrogen 2.839 N/A TYR 178.A OH GLU 110.A OE1 no hydrogen 2.631 N/A SER 179.A N THR 169.A OG1 no hydrogen 3.002 N/A MET 180.A N LEU 141.A O no hydrogen 2.702 N/A SER 181.A N SER 167.A O no hydrogen 2.854 N/A SER 182.A N CYS 139.A O no hydrogen 2.898 N/A SER 182.A OG ASN 166.A OD1 no hydrogen 2.734 N/A THR 183.A N LEU 165.A O no hydrogen 3.101 N/A LEU 184.A N VAL 137.A O no hydrogen 2.666 N/A THR 185.A N GLY 163.A O no hydrogen 2.602 N/A THR 185.A OG1 SER 136.A OG no hydrogen 3.010 N/A LEU 186.A N ALA 135.A O no hydrogen 3.188 N/A LYS 188.A N GLY 133.A O no hydrogen 2.960 N/A LYS 188.A NZ GLU 192.A OE1 no hydrogen 3.463 N/A GLU 190.A N THR 187.A OG1 no hydrogen 3.054 N/A TYR 191.A N THR 187.A O no hydrogen 2.974 N/A GLU 192.A N LYS 188.A O no hydrogen 2.945 N/A ARG 193.A N GLU 190.A O no hydrogen 3.089 N/A HIS 194.A N TYR 191.A O no hydrogen 3.177 N/A HIS 194.A ND1 ASP 156.A OD2 no hydrogen 2.953 N/A ASN 195.A N ASP 156.A OD1 no hydrogen 3.174 N/A ASN 195.A ND2 ASN 217.A OD1 no hydrogen 3.193 N/A SER 196.A N ASP 156.A OD1 no hydrogen 2.891 N/A TYR 197.A N PHE 214.A O no hydrogen 3.098 N/A TYR 197.A OH TYR 191.A O no hydrogen 2.583 N/A TYR 197.A OH HIS 194.A O no hydrogen 3.111 N/A THR 198.A N LYS 154.A O no hydrogen 2.993 N/A CYS 199.A N LYS 212.A O no hydrogen 2.943 N/A GLU 200.A N LYS 152.A O no hydrogen 2.722 N/A ALA 201.A N ILE 210.A O no hydrogen 2.784 N/A THR 202.A N ASN 150.A O no hydrogen 2.950 N/A HIS 203.A ND1 THR 205.A OG1 no hydrogen 2.807 N/A HIS 203.A NE2 PRO 146.A O no hydrogen 2.885 N/A LYS 204.A NZ ASP 115.A OD2 no hydrogen 3.032 N/A THR 205.A OG1 HIS 203.A ND1 no hydrogen 2.807 N/A SER 206.A N HIS 203.A O no hydrogen 3.279 N/A ILE 210.A N ALA 201.A O no hydrogen 2.766 N/A LYS 212.A N CYS 199.A O no hydrogen 3.073 N/A LYS 212.A NZ VAL 211.A O no hydrogen 3.060 N/A PHE 214.A N TYR 197.A O no hydrogen 3.093 N/A ASN 215.A ND2 GLU 218.A OE2 no hydrogen 3.519 N/A ARG 216.A N ASN 195.A O no hydrogen 2.729 N/A ARG 216.A NE TYR 191.A O no hydrogen 3.300 N/A ARG 216.A NE HIS 194.A O no hydrogen 2.727 N/A ARG 216.A NH2 HIS 194.A O no hydrogen 3.497 N/A ASN 217.A N ASN 195.A OD1 no hydrogen 2.648 N/A GLU 218.A N ASN 215.A O no hydrogen 3.362 N/A CYS 219.A N ARG 216.A O no hydrogen 2.889 N/A CYS 219.A SG ASN 215.A O no hydrogen 3.540 N/A