Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4kn8_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A NH1 PHE 254.A O no hydrogen 3.309 N/A LYS 3.A N LEU 255.A O no hydrogen 2.738 N/A TYR 4.A N LEU 255.A OXT no hydrogen 3.054 N/A TYR 4.A OH ASP 221.A OD2 no hydrogen 2.528 N/A TYR 4.A OH TYR 244.A OH no hydrogen 2.826 N/A ASN 5.A N GLU 200.A O no hydrogen 2.801 N/A ASN 5.A ND2 GLU 200.A OE1 no hydrogen 3.065 N/A GLY 6.A N GLU 200.A O no hydrogen 3.324 N/A TYR 7.A N PRO 38.A O no hydrogen 3.063 N/A LEU 8.A N ILE 202.A O no hydrogen 2.875 N/A ILE 9.A N LEU 40.A O no hydrogen 2.833 N/A ASP 10.A N VAL 204.A O no hydrogen 2.810 N/A LEU 11.A N VAL 42.A O no hydrogen 2.902 N/A ASP 12.A N ASP 10.A OD2 no hydrogen 2.927 N/A THR 14.A N ASP 206.A OD1 no hydrogen 2.855 N/A THR 14.A OG1 ASP 206.A OD2 no hydrogen 2.709 N/A MET 15.A N ASP 12.A O no hydrogen 3.382 N/A TYR 16.A OH ASP 10.A O no hydrogen 2.830 N/A ARG 17.A N THR 14.A O no hydrogen 3.257 N/A ARG 21.A NH1 THR 14.A O no hydrogen 2.824 N/A ILE 22.A N GLY 18.A O no hydrogen 3.025 N/A ASP 23.A N THR 19.A O.A no hydrogen 2.962 N/A ASP 23.A N THR 19.A O.B no hydrogen 2.903 N/A ALA 24.A N GLU 20.A O no hydrogen 2.965 N/A ALA 25.A N ARG 21.A O no hydrogen 2.955 N/A SER 26.A N ILE 22.A O no hydrogen 2.814 N/A SER 26.A OG ASP 61.A O no hydrogen 2.672 N/A SER 26.A OG ASP 61.A OD2 no hydrogen 3.535 N/A GLY 27.A N ASP 23.A O no hydrogen 3.006 N/A PHE 28.A N ALA 24.A O no hydrogen 2.960 N/A ILE 29.A N ALA 25.A O no hydrogen 2.927 N/A LYS 30.A N SER 26.A O no hydrogen 2.856 N/A LYS 30.A NZ ASP 61.A OD1 no hydrogen 3.334 N/A LYS 30.A NZ ASP 61.A OD2 no hydrogen 2.597 N/A GLU 31.A N GLY 27.A O no hydrogen 3.028 N/A LEU 32.A N PHE 28.A O no hydrogen 3.085 N/A ASN 33.A N ILE 29.A O no hydrogen 2.952 N/A ARG 34.A N LYS 30.A O no hydrogen 2.932 N/A LEU 35.A N GLU 31.A O no hydrogen 2.901 N/A HIS 36.A N ASN 33.A O no hydrogen 3.099 N/A ILE 37.A N LEU 32.A O no hydrogen 2.997 N/A TYR 39.A OH PRO 63.A O no hydrogen 2.820 N/A LEU 40.A N TYR 7.A O no hydrogen 3.035 N/A PHE 41.A N GLN 68.A O no hydrogen 2.765 N/A VAL 42.A N ILE 9.A O no hydrogen 2.886 N/A THR 43.A N PHE 70.A O no hydrogen 2.980 N/A THR 43.A OG1 ASP 12.A OD1 no hydrogen 2.648 N/A THR 43.A OG1 ASP 12.A OD2 no hydrogen 3.322 N/A ASN 44.A N ASP 12.A OD2 no hydrogen 2.892 N/A ASN 44.A ND2 LYS 181.A O no hydrogen 2.884 N/A ASN 45.A N THR 43.A OG1 no hydrogen 2.867 N/A ASN 45.A ND2 THR 47.A OG1 no hydrogen 2.762 N/A ARG 48.A N ASN 45.A OD1 no hydrogen 2.710 N/A ARG 48.A NH1 THR 47.A O no hydrogen 2.972 N/A THR 49.A N GLN 52.A OE1 no hydrogen 2.861 N/A GLN 52.A N THR 49.A OG1 no hydrogen 3.049 N/A VAL 53.A N THR 49.A O no hydrogen 2.958 N/A ALA 54.A N PRO 50.A O no hydrogen 2.935 N/A ASP 55.A N GLU 51.A O no hydrogen 2.960 N/A LYS 56.A N GLN 52.A O no hydrogen 2.978 N/A LEU 57.A N VAL 53.A O no hydrogen 2.878 N/A VAL 58.A N ALA 54.A O no hydrogen 2.893 N/A SER 59.A N ASP 55.A O no hydrogen 3.070 N/A SER 59.A OG LYS 56.A O no hydrogen 2.668 N/A LEU 60.A N LYS 56.A O no hydrogen 3.254 N/A LEU 60.A N LEU 57.A O no hydrogen 2.895 N/A ASP 61.A N VAL 58.A O no hydrogen 2.887 N/A ILE 62.A N LEU 57.A O no hydrogen 2.896 N/A THR 65.A N GLN 68.A OE1 no hydrogen 2.971 N/A THR 65.A OG1 GLU 67.A OE1 no hydrogen 3.440 N/A THR 65.A OG1 GLN 68.A OE1 no hydrogen 3.417 N/A GLN 68.A N THR 65.A O no hydrogen 2.917 N/A GLN 68.A NE2 TYR 39.A O no hydrogen 3.570 N/A ILE 69.A N PRO 66.A O no hydrogen 3.014 N/A PHE 70.A N PHE 41.A O no hydrogen 2.830 N/A SER 72.A N THR 43.A O no hydrogen 2.882 N/A SER 72.A OG ASN 44.A O no hydrogen 3.349 N/A SER 72.A OG THR 145.A OG1.B no hydrogen 3.137 N/A SER 72.A OG ASN 146.A OD1 no hydrogen 2.670 N/A MET 74.A N THR 71.A OG1 no hydrogen 3.026 N/A ALA 75.A N THR 71.A O no hydrogen 2.950 N/A THR 76.A N SER 72.A O no hydrogen 2.932 N/A THR 76.A OG1 SER 72.A O no hydrogen 2.767 N/A ALA 77.A N SER 73.A O no hydrogen 2.979 N/A ASN 78.A N MET 74.A O no hydrogen 2.922 N/A TYR 79.A N ALA 75.A O no hydrogen 2.870 N/A VAL 80.A N THR 76.A O no hydrogen 3.021 N/A TYR 81.A N ALA 77.A O no hydrogen 2.923 N/A ASP 82.A N ASN 78.A O no hydrogen 3.063 N/A LEU 83.A N TYR 79.A O no hydrogen 3.303 N/A ASP 84.A N VAL 80.A O no hydrogen 2.878 N/A ASN 86.A N ASP 84.A OD1 no hydrogen 3.003 N/A ALA 87.A N ASP 84.A O no hydrogen 3.255 N/A MET 88.A N ASP 114.A OD2 no hydrogen 2.827 N/A ILE 89.A N SER 107.A O no hydrogen 2.953 N/A TYR 90.A N VAL 115.A O no hydrogen 2.928 N/A TYR 90.A OH LYS 128.A O no hydrogen 2.740 N/A ILE 92.A N ILE 117.A O no hydrogen 2.880 N/A TYR 98.A N GLU 94.A O no hydrogen 2.988 N/A LYS 99.A N GLU 95.A O no hydrogen 2.841 N/A LYS 99.A NZ GLU 103.A OE2 no hydrogen 2.359 N/A ALA 100.A N GLY 96.A O no hydrogen 2.996 N/A LEU 101.A N LEU 97.A O no hydrogen 3.034 N/A LYS 102.A N TYR 98.A O no hydrogen 2.778 N/A GLU 103.A N LYS 99.A O no hydrogen 2.915 N/A LYS 104.A N LEU 101.A O no hydrogen 3.047 N/A LYS 104.A NZ ASN 78.A OD1 no hydrogen 3.277 N/A GLY 105.A N LYS 102.A O no hydrogen 2.927 N/A ALA 109.A N ILE 89.A O no hydrogen 2.953 N/A GLU 111.A N GLU 111.A OE1 no hydrogen 2.859 N/A ALA 113.A N ASP 110.A O no hydrogen 3.019 N/A ASP 114.A N MET 88.A O no hydrogen 2.827 N/A VAL 115.A N MET 88.A O no hydrogen 3.291 N/A VAL 116.A N LYS 141.A O no hydrogen 2.743 N/A ILE 117.A N TYR 90.A O no hydrogen 2.869 N/A VAL 118.A N ILE 143.A O no hydrogen 2.776 N/A GLY 119.A N ILE 92.A O no hydrogen 2.726 N/A ARG 122.A N GLU 94.A OE2 no hydrogen 2.783 N/A ARG 122.A NE GLU 94.A OE2 no hydrogen 2.915 N/A ARG 122.A NH2 GLU 94.A OE1 no hydrogen 2.676 N/A GLU 123.A N ASP 121.A OD1 no hydrogen 2.845 N/A VAL 124.A N ASP 121.A O no hydrogen 3.001 N/A LYS 128.A N THR 125.A OG1 no hydrogen 3.128 N/A LYS 128.A NZ ASP 121.A OD2 no hydrogen 2.775 N/A LYS 128.A NZ GLU 123.A O no hydrogen 3.307 N/A LEU 129.A N THR 125.A O no hydrogen 3.075 N/A ALA 130.A N TYR 126.A O no hydrogen 2.779 N/A VAL 131.A N GLU 127.A O no hydrogen 2.934 N/A ALA 132.A N LYS 128.A O no hydrogen 3.360 N/A CYS 133.A N LEU 129.A O no hydrogen 3.116 N/A CYS 133.A SG LEU 129.A O no hydrogen 3.539 N/A LEU 134.A N ALA 130.A O no hydrogen 2.872 N/A ALA 135.A N VAL 131.A O no hydrogen 2.883 N/A VAL 136.A N ALA 132.A O no hydrogen 3.013 N/A ARG 137.A N CYS 133.A O no hydrogen 2.939 N/A ARG 137.A NH2 SER 171.A O no hydrogen 2.817 N/A ASN 138.A N LEU 134.A O no hydrogen 2.928 N/A ASN 138.A ND2 GLU 111.A O no hydrogen 2.935 N/A GLY 139.A N VAL 136.A O no hydrogen 2.877 N/A ALA 140.A N ALA 135.A O no hydrogen 2.955 N/A LYS 141.A N ASP 114.A O no hydrogen 2.989 N/A ILE 143.A N VAL 116.A O no hydrogen 2.809 N/A SER 144.A N THR 177.A O no hydrogen 2.819 N/A SER 144.A OG ASN 146.A O no hydrogen 2.740 N/A SER 144.A OG ASN 161.A OD1 no hydrogen 3.457 N/A SER 144.A OG THR 165.A OG1 no hydrogen 2.736 N/A THR 145.A N.A VAL 118.A O no hydrogen 2.940 N/A THR 145.A N.B VAL 118.A O no hydrogen 2.982 N/A ASN 146.A ND2 ASN 44.A O no hydrogen 2.911 N/A LEU 151.A N MET 158.A O no hydrogen 2.795 N/A THR 153.A N GLY 156.A O no hydrogen 2.910 N/A THR 153.A OG1 GLY 156.A O no hydrogen 2.887 N/A ARG 155.A N THR 153.A OG1 no hydrogen 3.115 N/A GLY 156.A N THR 153.A O no hydrogen 3.070 N/A MET 158.A N LEU 151.A O no hydrogen 2.933 N/A GLY 160.A N LEU 149.A O no hydrogen 2.992 N/A ASN 161.A N ASP 148.A OD2 no hydrogen 3.214 N/A ASN 161.A ND2 VAL 118.A O no hydrogen 3.540 N/A GLY 162.A N ASP 148.A O no hydrogen 2.653 N/A ALA 163.A N GLY 160.A O no hydrogen 2.919 N/A PHE 164.A N GLY 160.A O no hydrogen 3.462 N/A THR 165.A N ASN 161.A O no hydrogen 3.048 N/A THR 165.A OG1 SER 144.A OG no hydrogen 2.736 N/A THR 165.A OG1 ASN 161.A O no hydrogen 3.269 N/A ALA 166.A N GLY 162.A O no hydrogen 2.912 N/A LEU 167.A N ALA 163.A O no hydrogen 3.081 N/A ILE 168.A N PHE 164.A O no hydrogen 3.122 N/A SER 169.A N.A THR 165.A O no hydrogen 2.842 N/A SER 169.A N.B THR 165.A O no hydrogen 2.861 N/A SER 169.A OG.A VAL 174.A O no hydrogen 2.742 N/A SER 169.A OG.B VAL 174.A O no hydrogen 2.771 N/A HIS 170.A N ALA 166.A O no hydrogen 2.841 N/A SER 171.A N LEU 167.A O no hydrogen 2.938 N/A THR 172.A N ILE 168.A O no hydrogen 2.973 N/A THR 172.A OG1 ILE 168.A O no hydrogen 2.777 N/A GLN 173.A NE2 HIS 170.A O no hydrogen 2.788 N/A VAL 174.A N THR 172.A OG1 no hydrogen 3.267 N/A THR 177.A N LEU 142.A O no hydrogen 2.967 N/A VAL 179.A N SER 144.A O no hydrogen 2.997 N/A GLY 180.A N THR 145.A O.A no hydrogen 2.660 N/A GLY 180.A N THR 145.A O.B no hydrogen 2.699 N/A LYS 181.A N ASN 44.A OD1 no hydrogen 2.932 N/A LYS 181.A NZ ASP 10.A OD1 no hydrogen 2.557 N/A LYS 181.A NZ ASP 12.A OD2 no hydrogen 2.837 N/A LYS 181.A NZ ASP 211.A OD1 no hydrogen 2.757 N/A GLU 183.A N GLY 180.A O no hydrogen 2.917 N/A ILE 186.A N VAL 179.A O no hydrogen 2.997 N/A MET 187.A N PRO 184.A O no hydrogen 2.917 N/A GLU 188.A N.A PRO 184.A O no hydrogen 3.102 N/A GLU 188.A N.B PRO 184.A O no hydrogen 3.076 N/A GLN 189.A N ILE 185.A O no hydrogen 2.930 N/A ALA 190.A N ILE 186.A O no hydrogen 2.841 N/A LEU 191.A N MET 187.A O no hydrogen 2.927 N/A LYS 192.A N GLU 188.A O.A no hydrogen 3.095 N/A LYS 192.A N GLU 188.A O.B no hydrogen 3.112 N/A LYS 192.A NZ ASP 82.A OD2 no hydrogen 2.816 N/A VAL 193.A N GLN 189.A O no hydrogen 3.377 N/A LEU 194.A N ALA 190.A O no hydrogen 2.859 N/A GLY 195.A N LEU 191.A O no hydrogen 2.842 N/A THR 196.A OG1 THR 201.A OG1 no hydrogen 2.724 N/A ASN 197.A ND2 GLU 200.A OE2 no hydrogen 3.014 N/A LYS 198.A NZ GLU 188.A OE1.A no hydrogen 2.759 N/A LYS 198.A NZ ALA 218.A O no hydrogen 3.125 N/A GLU 200.A N ASN 197.A O no hydrogen 2.931 N/A THR 201.A N LYS 198.A O no hydrogen 3.309 N/A THR 201.A OG1 THR 196.A OG1 no hydrogen 2.724 N/A THR 201.A OG1 ASN 197.A O no hydrogen 2.767 N/A ILE 202.A N GLY 6.A O no hydrogen 3.036 N/A MET 203.A N ASP 221.A O no hydrogen 3.028 N/A VAL 204.A N LEU 8.A O no hydrogen 2.858 N/A GLY 205.A N LEU 223.A O no hydrogen 2.984 N/A TYR 208.A OH GLN 240.A O no hydrogen 2.633 N/A THR 210.A N.A ASN 207.A OD1 no hydrogen 2.737 N/A THR 210.A N.B ASN 207.A OD1 no hydrogen 2.745 N/A THR 210.A OG1.A ASN 207.A OD1 no hydrogen 2.490 N/A THR 210.A OG1.A ASP 211.A OD2 no hydrogen 3.396 N/A ASP 211.A N ASN 207.A OD1 no hydrogen 3.011 N/A ILE 212.A N ASN 207.A O no hydrogen 2.850 N/A LEU 213.A N TYR 208.A O no hydrogen 2.997 N/A ALA 214.A N ASP 211.A O no hydrogen 2.991 N/A ILE 216.A N ILE 212.A O no hydrogen 3.018 N/A ARG 217.A N LEU 213.A O no hydrogen 2.915 N/A ARG 217.A NH1 PRO 182.A O no hydrogen 3.037 N/A ALA 218.A N ALA 214.A O no hydrogen 3.002 N/A GLY 219.A N ILE 216.A O no hydrogen 3.040 N/A LEU 220.A N GLY 215.A O no hydrogen 2.999 N/A THR 222.A N THR 243.A OG1 no hydrogen 2.900 N/A LEU 223.A N MET 203.A O no hydrogen 2.785 N/A LEU 224.A N TYR 244.A O no hydrogen 2.893 N/A VAL 225.A N GLY 205.A O no hydrogen 2.882 N/A HIS 226.A N LYS 247.A O no hydrogen 3.086 N/A HIS 226.A ND1 ASP 206.A OD2 no hydrogen 2.728 N/A THR 227.A N MET 246.A O no hydrogen 3.171 N/A THR 227.A OG1 MET 246.A O no hydrogen 2.963 N/A GLY 228.A N THR 231.A OG1 no hydrogen 2.910 N/A THR 231.A OG1 GLY 228.A O no hydrogen 3.160 N/A VAL 232.A N GLY 228.A O no hydrogen 2.974 N/A GLU 233.A N VAL 229.A O no hydrogen 3.033 N/A LYS 234.A N THR 230.A O no hydrogen 2.957 N/A LEU 235.A N THR 231.A O no hydrogen 2.998 N/A LYS 236.A N VAL 232.A O no hydrogen 3.178 N/A GLU 237.A N LYS 234.A O no hydrogen 2.956 N/A TYR 238.A N LEU 235.A O no hydrogen 3.070 N/A GLN 241.A NE2 LEU 235.A O no hydrogen 3.023 N/A GLN 241.A NE2 TYR 238.A O no hydrogen 2.798 N/A THR 243.A N THR 222.A OG1 no hydrogen 3.074 N/A TYR 244.A N THR 222.A O no hydrogen 2.956 N/A TYR 244.A OH TYR 4.A OH no hydrogen 2.826 N/A MET 246.A N LEU 224.A O no hydrogen 2.964 N/A ASP 250.A N SER 248.A OG no hydrogen 2.919 N/A ASP 251.A N SER 248.A O no hydrogen 3.015 N/A TRP 252.A N LEU 249.A O no hydrogen 3.200 N/A TRP 252.A NE1 TYR 7.A OH no hydrogen 2.889 N/A LEU 255.A N LYS 253.A O no hydrogen 2.744 N/A