Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4k8y_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 1.A N LEU 125.A O no hydrogen 2.801 N/A ILE 1.A N ASP 176.A OD2 no hydrogen 2.721 N/A ILE 2.A N ASP 171.A O no hydrogen 2.782 N/A ASN 3.A ND2 GLN 169.A O no hydrogen 3.419 N/A ASN 3.A ND2 ASP 168B.A O no hydrogen 3.164 N/A GLU 5.A N.A CYS 137.A O no hydrogen 3.006 N/A GLU 5.A N.B CYS 137.A O no hydrogen 3.020 N/A CYS 7.A N LEU 135.A O no hydrogen 2.858 N/A CYS 7.A SG LEU 135.A O no hydrogen 3.561 N/A SER 11.A N SER 8.A O no hydrogen 3.033 N/A SER 11.A OG SER 8.A O no hydrogen 2.639 N/A GLN 12.A NE2 SER 11.A OG no hydrogen 2.933 N/A GLN 15.A N GLN 12.A O no hydrogen 2.933 N/A GLN 15.A NE2 SER 27.A OG no hydrogen 3.023 N/A GLN 15.A NE2 SER 121.A O no hydrogen 3.483 N/A ALA 16.A N GLY 28.A O no hydrogen 2.881 N/A ALA 17.A N GLY 50.A O no hydrogen 2.883 N/A LEU 18.A N CYS 26.A O no hydrogen 2.870 N/A VAL 19.A N.A THR 48.A O no hydrogen 3.054 N/A VAL 19.A N.B THR 48.A O no hydrogen 3.077 N/A MET 20.A N.A GLU 23.A O no hydrogen 3.149 N/A MET 20.A N.B GLU 23.A O no hydrogen 3.078 N/A GLU 23.A N MET 20.A O.A no hydrogen 2.984 N/A GLU 23.A N MET 20.A O.B no hydrogen 3.268 N/A PHE 25.A N LEU 18.A O no hydrogen 3.005 N/A CYS 26.A SG PHE 25.A O no hydrogen 3.014 N/A SER 27.A N SER 177.A O no hydrogen 2.769 N/A SER 27.A OG ALA 16.A O no hydrogen 3.082 N/A GLY 28.A N ALA 16.A O no hydrogen 2.806 N/A VAL 29.A N LEU 37.A O no hydrogen 2.741 N/A LEU 30.A N TRP 14.A O no hydrogen 2.822 N/A VAL 31.A N TRP 35.A O no hydrogen 2.969 N/A HIS 32.A N TRP 35.A O no hydrogen 3.356 N/A HIS 32.A NE2 GLU 218.A OE1 no hydrogen 3.063 N/A HIS 32.A NE2 GLU 218.A OE2 no hydrogen 2.876 N/A GLN 34.A NE2 LEU 92.A O no hydrogen 2.957 N/A TRP 35.A N HIS 32.A O no hydrogen 3.007 N/A VAL 36.A N ILE 90.A O no hydrogen 2.968 N/A LEU 37.A N VAL 29.A O no hydrogen 2.805 N/A SER 38.A N MET 88.A O no hydrogen 2.976 N/A SER 38.A OG SER 27.A O no hydrogen 2.751 N/A HIS 41.A N ASP 86.A OD1 no hydrogen 2.992 N/A HIS 41.A ND1 ASP 86.A OD2 no hydrogen 2.749 N/A HIS 41.A NE2 SER 177.A OG no hydrogen 2.694 N/A CYS 42.A N ALA 39.A O no hydrogen 2.988 N/A PHE 43.A N ALA 40.A O no hydrogen 3.023 N/A GLN 44.A N TYR 47.A OH no hydrogen 2.991 N/A TYR 47.A N ALA 69.A O no hydrogen 2.691 N/A TYR 47.A OH SER 72.A OG no hydrogen 2.849 N/A THR 48.A OG1 GLU 68.A OE1.A no hydrogen 3.208 N/A ILE 49.A N VAL 67.A O.A no hydrogen 2.783 N/A ILE 49.A N VAL 67.A O.B no hydrogen 2.773 N/A GLY 50.A N ALA 17.A O no hydrogen 2.854 N/A LEU 51.A N GLN 65.A O no hydrogen 2.814 N/A SER 55.A N GLU 61.A OE1 no hydrogen 2.811 N/A SER 55.A OG.A GLU 61.A OE1 no hydrogen 2.765 N/A SER 55.A OG.B GLU 61.A OE1 no hydrogen 3.177 N/A GLN 60.A N GLU 57.A O no hydrogen 2.875 N/A GLN 60.A NE2 ASP 59.A OD2 no hydrogen 3.476 N/A GLU 61.A N ALA 58A.A O no hydrogen 2.978 N/A SER 64.A N GLU 61.A O no hydrogen 3.036 N/A SER 64.A OG GLU 61.A O no hydrogen 2.717 N/A SER 64.A OG ALA 58A.A O no hydrogen 3.121 N/A GLN 65.A N LEU 51.A O no hydrogen 2.889 N/A GLN 65.A NE2 SER 64.A O no hydrogen 3.032 N/A VAL 67.A N.A ILE 49.A O no hydrogen 2.811 N/A VAL 67.A N.B ILE 49.A O no hydrogen 2.687 N/A ALA 69.A N TYR 47.A O no hydrogen 3.003 N/A SER 72.A OG TYR 47.A OH no hydrogen 2.849 N/A VAL 73.A N LEU 89.A O no hydrogen 2.746 N/A HIS 75.A N LEU 87.A O no hydrogen 2.954 N/A GLU 77.A N.A HIS 75.A ND1 no hydrogen 3.014 N/A GLU 77.A N.B HIS 75.A ND1 no hydrogen 3.053 N/A TYR 78.A N HIS 75.A O no hydrogen 3.028 N/A ASN 79.A N ALA 84.A O no hydrogen 2.927 N/A ARG 80.A N.A GLU 77.A O.A no hydrogen 2.956 N/A ARG 80.A N.A GLU 77.A O.B no hydrogen 3.203 N/A ARG 80.A N.B GLU 77.A O.A no hydrogen 2.903 N/A ARG 80.A N.B GLU 77.A O.B no hydrogen 3.149 N/A LEU 83.A N ASN 79.A OD1 no hydrogen 2.693 N/A ALA 84.A N PRO 81.A O no hydrogen 2.997 N/A ASN 85.A N SER 159.A OG no hydrogen 2.933 N/A ASN 85.A ND2 GLU 77.A O.A no hydrogen 3.076 N/A ASN 85.A ND2 GLU 77.A O.B no hydrogen 2.766 N/A LEU 87.A N ASN 85.A O no hydrogen 2.988 N/A MET 88.A N SER 38.A O no hydrogen 2.846 N/A LEU 89.A N VAL 73.A O no hydrogen 2.922 N/A ILE 90.A N VAL 36.A O no hydrogen 2.747 N/A LYS 91.A N LEU 71.A O no hydrogen 2.935 N/A LEU 92.A N GLN 34.A O no hydrogen 2.863 N/A ASP 93.A N GLU 68.A O.A no hydrogen 2.941 N/A ASP 93.A N GLU 68.A O.B no hydrogen 2.961 N/A VAL 96.A N.A PRO 33.A O no hydrogen 2.893 N/A VAL 96.A N.B PRO 33.A O no hydrogen 2.899 N/A SER 99.A N ILE 102.A O no hydrogen 2.816 N/A SER 99.A OG THR 101.A OG1 no hydrogen 3.376 N/A THR 101.A N SER 99.A OG no hydrogen 3.082 N/A THR 101.A OG1 SER 99.A OG no hydrogen 3.376 N/A ILE 102.A N SER 99.A OG no hydrogen 3.044 N/A ARG 103.A N PRO 13.A O no hydrogen 3.110 N/A SER 104.A N GLU 98.A OE1.A no hydrogen 3.140 N/A SER 104.A N GLU 98.A OE2.B no hydrogen 2.836 N/A SER 104.A OG.A GLU 98.A OE2.A no hydrogen 3.041 N/A SER 104.A OG.A GLU 98.A OE2.B no hydrogen 2.893 N/A SER 104.A OG.B GLU 98.A OE2.A no hydrogen 2.614 N/A SER 104.A OG.B GLU 98.A OE2.B no hydrogen 3.025 N/A ILE 105.A N LEU 30.A O no hydrogen 3.095 N/A ALA 108.A N LEU 187.A O no hydrogen 2.829 N/A GLY 115.A N VAL 142.A O no hydrogen 2.818 N/A ASN 116.A N THR 113.A O no hydrogen 3.020 N/A ASN 116.A ND2 ASN 184.A OD1 no hydrogen 2.916 N/A CYS 118.A N VAL 140.A O no hydrogen 2.859 N/A LEU 119.A N ILE 182.A O no hydrogen 2.915 N/A VAL 120.A N.A VAL 138.A O no hydrogen 2.790 N/A VAL 120.A N.B VAL 138.A O no hydrogen 2.805 N/A SER 121.A OG GLN 15.A OE1 no hydrogen 2.709 N/A GLY 122.A N GLN 136.A O no hydrogen 2.971 N/A TRP 123.A NE1 HIS 54.A O no hydrogen 2.876 N/A GLY 124.A N ASP 176.A OD1 no hydrogen 2.769 N/A LEU 125.A N ASN 174.A O no hydrogen 2.836 N/A LEU 126.A N ARG 130.A O.A no hydrogen 2.856 N/A LEU 126.A N ARG 130.A O.B no hydrogen 2.885 N/A GLY 129.A N LEU 126.A O no hydrogen 3.008 N/A ARG 130.A N.A ASN 128.A OD1 no hydrogen 2.891 N/A ARG 130.A N.B ASN 128.A OD1 no hydrogen 2.872 N/A LEU 135.A N HIS 54.A O no hydrogen 2.947 N/A GLN 136.A N GLY 122.A O no hydrogen 3.004 N/A GLN 136.A NE2 ASP 6.A OD1 no hydrogen 2.901 N/A GLN 136.A NE2 VAL 134.A O no hydrogen 3.069 N/A CYS 137.A N GLU 5.A O.A no hydrogen 2.792 N/A CYS 137.A N GLU 5.A O.B no hydrogen 2.808 N/A VAL 138.A N VAL 120.A O.A no hydrogen 2.925 N/A VAL 138.A N VAL 120.A O.B no hydrogen 3.024 N/A ASN 139.A ND2 SER 117.A OG no hydrogen 3.047 N/A VAL 140.A N CYS 118.A O no hydrogen 2.849 N/A SER 141.A OG.A VAL 142.A O no hydrogen 3.467 N/A VAL 142.A N ASN 116.A O no hydrogen 2.838 N/A VAL 143.A N CYS 162.A O no hydrogen 2.932 N/A VAL 147.A N SER 144.A OG no hydrogen 3.242 N/A CYS 148.A N SER 144.A O no hydrogen 3.097 N/A SER 149.A N.A GLU 145.A O no hydrogen 2.877 N/A SER 149.A N.B GLU 145.A O no hydrogen 2.887 N/A SER 149.A OG.A GLU 145.A O no hydrogen 2.692 N/A SER 149.A OG.B ASP 153.A OD1.B no hydrogen 2.790 N/A SER 149.A OG.B ASP 153.A OD2.B no hydrogen 2.977 N/A LYS 150.A N GLU 146.A O no hydrogen 3.158 N/A LEU 151.A N VAL 147.A O no hydrogen 3.119 N/A TYR 152.A N CYS 148.A O no hydrogen 2.984 N/A TYR 152.A N SER 149.A O.A no hydrogen 3.234 N/A TYR 152.A OH PRO 204.A O no hydrogen 2.698 N/A ASP 153.A N.A SER 149.A O.A no hydrogen 2.791 N/A ASP 153.A N.A SER 149.A O.B no hydrogen 2.825 N/A ASP 153.A N.B SER 149.A O.A no hydrogen 2.793 N/A ASP 153.A N.B SER 149.A O.B no hydrogen 2.827 N/A LEU 155.A N TYR 152.A O no hydrogen 2.846 N/A TYR 156.A N.A TYR 152.A O no hydrogen 3.154 N/A TYR 156.A N.B TYR 152.A O no hydrogen 3.150 N/A TYR 156.A OH.A GLU 145.A OE2 no hydrogen 2.566 N/A TYR 156.A OH.B GLU 145.A OE2 no hydrogen 3.362 N/A TYR 156.A OH.B MET 160.A O no hydrogen 2.980 N/A HIS 157.A ND1 SER 159.A OG no hydrogen 2.805 N/A SER 159.A N HIS 157.A ND1 no hydrogen 3.102 N/A SER 159.A OG HIS 157.A ND1 no hydrogen 2.805 N/A MET 160.A N HIS 157.A O no hydrogen 2.865 N/A PHE 161.A N TYR 207.A O no hydrogen 2.906 N/A ALA 163.A N GLY 205.A O no hydrogen 2.935 N/A GLY 164.A N SER 141.A O.A no hydrogen 2.842 N/A GLY 164.A N SER 141.A O.B no hydrogen 2.793 N/A GLN 169.A N GLY 166.A O no hydrogen 2.989 N/A GLN 169.A NE2 GLY 199A.A O no hydrogen 2.884 N/A LYS 170.A N ASP 168B.A OD1 no hydrogen 3.038 N/A LYS 170.A NZ.B ASN 3.A O no hydrogen 2.972 N/A ASP 171.A N ILE 2.A O no hydrogen 3.249 N/A SER 172.A N ASP 171.A OD1 no hydrogen 2.795 N/A SER 172.A OG TYR 207.A OH no hydrogen 2.869 N/A CYS 173.A N ASP 176.A OD2 no hydrogen 2.797 N/A ASP 176.A N CYS 173.A O no hydrogen 2.820 N/A SER 177.A OG HIS 41.A NE2 no hydrogen 2.694 N/A SER 177.A OG SER 192.A O no hydrogen 3.555 N/A GLY 178.A N VAL 191.A O no hydrogen 2.880 N/A GLY 179.A N ASP 176.A O no hydrogen 3.084 N/A LEU 181.A N.A GLY 189.A O no hydrogen 2.947 N/A LEU 181.A N.B GLY 189.A O no hydrogen 2.958 N/A ILE 182.A N LEU 119.A O no hydrogen 2.739 N/A CYS 183.A N TYR 186.A O no hydrogen 2.965 N/A TYR 186.A N CYS 183.A O no hydrogen 2.931 N/A LEU 187.A N SER 106.A O no hydrogen 2.905 N/A GLN 188.A N LEU 181.A O.A no hydrogen 2.825 N/A GLN 188.A N LEU 181.A O.B no hydrogen 2.850 N/A GLN 188.A NE2 GLN 110.A O no hydrogen 2.872 N/A GLY 189.A N LEU 181.A O.A no hydrogen 3.103 N/A GLY 189.A N LEU 181.A O.B no hydrogen 3.055 N/A LEU 190.A N THR 208.A O no hydrogen 3.431 N/A VAL 191.A N GLY 179.A O no hydrogen 2.907 N/A SER 192.A N VAL 206.A O no hydrogen 3.138 N/A SER 192.A OG ASP 86.A OD2 no hydrogen 2.678 N/A PHE 193.A N VAL 206.A O no hydrogen 3.144 N/A LYS 195.A NZ LEU 151.A O no hydrogen 2.908 N/A CYS 198.A SG SER 172.A O no hydrogen 3.690 N/A GLN 200.A NE2 LYS 195.A O no hydrogen 3.313 N/A GLN 200.A NE2 PRO 197.A O no hydrogen 3.012 N/A GLY 202.A N GLY 165.A O no hydrogen 2.723 N/A VAL 203.A N GLN 200.A O no hydrogen 3.204 N/A GLY 205.A N ALA 163.A O no hydrogen 3.042 N/A VAL 206.A N PHE 193.A O no hydrogen 2.795 N/A TYR 207.A N PHE 161.A O no hydrogen 2.789 N/A THR 208.A N LEU 190.A O no hydrogen 2.873 N/A THR 208.A OG1 ASP 86.A O no hydrogen 2.788 N/A ASN 209.A N SER 159.A O no hydrogen 2.806 N/A ASN 209.A ND2 PRO 158.A O no hydrogen 2.989 N/A LEU 210.A N GLN 188.A O no hydrogen 3.290 N/A CYS 211.A SG ASN 209.A OD1 no hydrogen 3.394 N/A LYS 212.A N ASN 209.A O no hydrogen 3.029 N/A PHE 213.A N LEU 210.A O no hydrogen 2.905 N/A ILE 217.A N PHE 213.A O no hydrogen 2.878 N/A GLU 218.A N THR 214.A O no hydrogen 3.139 N/A LYS 219.A N GLU 215.A O no hydrogen 2.856 N/A THR 220.A N TRP 216.A O no hydrogen 3.002 N/A THR 220.A OG1 TRP 216.A O no hydrogen 2.856 N/A VAL 221.A N ILE 217.A O no hydrogen 2.953 N/A GLN 222.A N GLU 218.A O no hydrogen 2.908 N/A ALA 223.A N LYS 219.A O no hydrogen 3.054 N/A ALA 223.A N THR 220.A O no hydrogen 3.363 N/A GLY 199A.A N ASP 171.A OD2 no hydrogen 2.842 N/A