Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4gnj_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 1.A NZ TYR 220.A O no hydrogen 2.507 N/A LYS 1.A NZ LYS 222.A O no hydrogen 2.790 N/A LYS 1.A NZ ILE 225.A O no hydrogen 2.706 N/A GLN 3.A NE2 ASP 34.A OD1 no hydrogen 2.873 N/A ILE 5.A N ASN 226.A O no hydrogen 3.106 N/A VAL 6.A N GLN 36.A O no hydrogen 3.058 N/A ALA 7.A N PHE 228.A O no hydrogen 2.806 N/A ALA 8.A N VAL 38.A O no hydrogen 2.704 N/A ASN 9.A N VAL 230.A O no hydrogen 2.920 N/A TRP 10.A N ALA 40.A O no hydrogen 3.096 N/A TRP 10.A NE1 SER 234.A O no hydrogen 3.039 N/A LYS 11.A N ASN 9.A OD1 no hydrogen 2.954 N/A LYS 11.A NZ GLU 95.A OE2 no hydrogen 2.623 N/A ASN 13.A ND2 TRP 10.A O no hydrogen 2.864 N/A THR 15.A N SER 18.A OG no hydrogen 3.122 N/A SER 18.A N THR 15.A OG1 no hydrogen 3.033 N/A SER 18.A OG THR 15.A O no hydrogen 3.292 N/A SER 18.A OG THR 15.A OG1 no hydrogen 3.399 N/A ILE 19.A N.A THR 15.A O no hydrogen 2.936 N/A ILE 19.A N.B THR 15.A O no hydrogen 2.954 N/A GLU 20.A N THR 16.A O no hydrogen 3.002 N/A LYS 21.A N ALA 17.A O no hydrogen 3.219 N/A LEU 22.A N SER 18.A O no hydrogen 2.982 N/A VAL 23.A N ILE 19.A O.A no hydrogen 2.809 N/A VAL 23.A N ILE 19.A O.B no hydrogen 2.935 N/A GLN 24.A N GLU 20.A O no hydrogen 3.070 N/A VAL 25.A N LYS 21.A O no hydrogen 3.269 N/A LEU 26.A N LEU 22.A O no hydrogen 2.921 N/A ASN 27.A N VAL 23.A O no hydrogen 2.796 N/A ASN 27.A ND2 LYS 52.A O no hydrogen 2.808 N/A GLU 28.A N GLN 24.A O no hydrogen 3.018 N/A GLU 28.A N VAL 25.A O no hydrogen 3.217 N/A HIS 29.A N LEU 26.A O no hydrogen 3.428 N/A HIS 29.A NE2 ASP 244.A OD1 no hydrogen 2.789 N/A HIS 33.A NE2 THR 246.A OG1 no hydrogen 2.805 N/A GLN 36.A N PRO 4.A O no hydrogen 2.973 N/A CYS 37.A N LYS 57.A O no hydrogen 2.859 N/A VAL 38.A N VAL 6.A O no hydrogen 3.044 N/A VAL 39.A N ALA 59.A O no hydrogen 3.080 N/A ALA 40.A N ALA 8.A O no hydrogen 2.801 N/A SER 42.A OG HIS 45.A ND1 no hydrogen 2.929 N/A HIS 45.A N SER 42.A O no hydrogen 2.927 N/A ILE 46.A N PHE 43.A O no hydrogen 3.153 N/A VAL 49.A N HIS 45.A O no hydrogen 2.979 N/A GLN 50.A N ILE 46.A O no hydrogen 2.792 N/A GLN 50.A NE2 LEU 84.A O no hydrogen 2.909 N/A ALA 51.A N PRO 47.A O no hydrogen 2.965 N/A LYS 52.A N MET 48.A O no hydrogen 2.916 N/A LYS 52.A NZ GLU 20.A OE2 no hydrogen 3.153 N/A LEU 53.A N VAL 49.A O no hydrogen 2.940 N/A CYS 54.A N ASN 27.A OD1 no hydrogen 2.856 N/A ASN 55.A N ASN 27.A OD1 no hydrogen 3.158 N/A ASN 55.A ND2 LEU 26.A O no hydrogen 2.998 N/A ASN 55.A ND2 HIS 29.A O no hydrogen 3.113 N/A LYS 57.A N ASN 55.A OD1 no hydrogen 3.021 N/A LYS 57.A NZ HIS 33.A O no hydrogen 3.098 N/A TYR 58.A N ASN 55.A O no hydrogen 3.077 N/A ALA 59.A N CYS 37.A O no hydrogen 2.935 N/A SER 61.A N VAL 39.A O no hydrogen 2.795 N/A SER 61.A OG ALA 62.A O no hydrogen 2.813 N/A ALA 62.A N TRP 88.A O no hydrogen 2.970 N/A ILE 66.A N VAL 76.A O no hydrogen 2.902 N/A SER 69.A OG SER 77.A OG no hydrogen 2.667 N/A PHE 72.A N GLY 70.A O no hydrogen 2.883 N/A GLU 75.A N PHE 72.A O no hydrogen 3.025 N/A SER 77.A OG SER 69.A OG no hydrogen 2.667 N/A MET 78.A N ILE 66.A O no hydrogen 2.892 N/A ILE 80.A N SER 77.A OG no hydrogen 3.318 N/A LEU 81.A N SER 77.A O no hydrogen 2.997 N/A LYS 82.A N MET 78.A O no hydrogen 2.850 N/A LYS 82.A NZ SER 87.A OG no hydrogen 3.036 N/A LYS 82.A NZ GLY 118.A O no hydrogen 2.986 N/A ASP 83.A N PRO 79.A O no hydrogen 2.963 N/A LEU 84.A N ILE 80.A O no hydrogen 3.069 N/A GLY 85.A N LYS 82.A O no hydrogen 2.963 N/A VAL 86.A N LEU 81.A O no hydrogen 2.964 N/A VAL 89.A N MET 120.A O no hydrogen 3.086 N/A ILE 90.A N ALA 62.A O no hydrogen 2.925 N/A LEU 91.A N ILE 122.A O no hydrogen 2.945 N/A SER 94.A N GLU 165.A OE2 no hydrogen 2.814 N/A SER 94.A OG GLU 165.A OE1 no hydrogen 2.571 N/A GLU 95.A N HIS 93.A ND1 no hydrogen 3.103 N/A ARG 96.A N HIS 93.A O no hydrogen 2.758 N/A ARG 96.A NE GLU 102.A OE2 no hydrogen 2.934 N/A ARG 97.A N HIS 93.A O no hydrogen 2.950 N/A ARG 97.A NE GLY 92.A O no hydrogen 2.864 N/A ARG 97.A NE CYS 124.A O no hydrogen 3.288 N/A ARG 97.A NH2 CYS 124.A O no hydrogen 2.920 N/A THR 98.A N SER 94.A O no hydrogen 2.685 N/A THR 98.A OG1 SER 94.A O no hydrogen 2.738 N/A TYR 99.A N GLU 95.A O no hydrogen 2.845 N/A TYR 100.A N ARG 96.A O no hydrogen 3.074 N/A GLU 102.A N ARG 96.A O no hydrogen 3.246 N/A THR 103.A N GLY 101.A O no hydrogen 3.186 N/A VAL 106.A N THR 103.A OG1 no hydrogen 3.208 N/A VAL 107.A N THR 103.A O no hydrogen 2.960 N/A ALA 108.A N ASP 104.A O no hydrogen 2.886 N/A GLN 109.A N GLY 105.A O no hydrogen 3.008 N/A LYS 110.A N VAL 106.A O no hydrogen 3.028 N/A LYS 110.A NZ ASN 64.A OD1 no hydrogen 2.934 N/A LYS 110.A NZ ALA 65.A O no hydrogen 2.897 N/A LYS 110.A NZ GLU 102.A OE2 no hydrogen 2.932 N/A VAL 111.A N VAL 107.A O no hydrogen 2.895 N/A ALA 112.A N ALA 108.A O no hydrogen 3.084 N/A ASP 113.A N GLN 109.A O no hydrogen 2.864 N/A ALA 114.A N LYS 110.A O no hydrogen 2.847 N/A TYR 115.A N VAL 111.A O no hydrogen 2.860 N/A ASN 116.A N ALA 112.A O no hydrogen 2.854 N/A GLN 117.A N ASP 113.A O no hydrogen 2.965 N/A GLN 117.A N ALA 114.A O no hydrogen 3.196 N/A GLY 118.A N TYR 115.A O no hydrogen 2.970 N/A PHE 119.A N ALA 114.A O no hydrogen 2.978 N/A MET 120.A N SER 87.A O no hydrogen 2.817 N/A VAL 121.A N GLN 159.A O no hydrogen 2.841 N/A ILE 122.A N VAL 89.A O no hydrogen 2.947 N/A ALA 123.A N VAL 161.A O no hydrogen 2.796 N/A CYS 124.A N LEU 91.A O no hydrogen 2.928 N/A CYS 124.A SG LEU 91.A O no hydrogen 3.885 N/A CYS 124.A SG ILE 122.A O no hydrogen 4.019 N/A ILE 125.A N ALA 163.A O no hydrogen 3.015 N/A GLY 126.A N GLN 144.A OE1 no hydrogen 2.737 N/A GLU 127.A N GLU 127.A OE1 no hydrogen 2.751 N/A THR 128.A N GLN 131.A OE1 no hydrogen 2.906 N/A GLN 131.A N THR 128.A OG1 no hydrogen 3.095 N/A ARG 132.A N THR 128.A O no hydrogen 2.897 N/A ARG 132.A NH1 GLU 127.A OE2 no hydrogen 2.861 N/A GLU 133.A N LEU 129.A O no hydrogen 2.993 N/A ALA 134.A N GLN 130.A O no hydrogen 3.065 N/A ASN 135.A N ARG 132.A O no hydrogen 3.059 N/A GLN 136.A N.A GLN 131.A O no hydrogen 2.884 N/A GLN 136.A N.B GLN 131.A O no hydrogen 2.886 N/A THR 137.A OG1 GLU 127.A OE2 no hydrogen 2.619 N/A VAL 140.A N GLN 136.A O.A no hydrogen 2.984 N/A VAL 140.A N GLN 136.A O.B no hydrogen 2.963 N/A VAL 141.A N THR 137.A O no hydrogen 3.057 N/A LEU 142.A N ALA 138.A O no hydrogen 3.007 N/A SER 143.A N LYS 139.A O no hydrogen 2.857 N/A SER 143.A OG LYS 139.A O no hydrogen 2.785 N/A GLN 144.A N VAL 140.A O no hydrogen 2.925 N/A GLN 144.A NE2 GLY 126.A O no hydrogen 3.265 N/A THR 145.A N VAL 141.A O no hydrogen 2.976 N/A THR 145.A OG1 VAL 141.A O no hydrogen 2.700 N/A ALA 146.A N LEU 142.A O no hydrogen 2.671 N/A ALA 147.A N SER 143.A O no hydrogen 2.995 N/A ILE 148.A N GLN 144.A O no hydrogen 3.459 N/A ALA 149.A N THR 145.A O no hydrogen 2.871 N/A ALA 150.A N ALA 146.A O no hydrogen 2.903 N/A LYS 151.A N ILE 148.A O no hydrogen 2.998 N/A LEU 152.A N ALA 149.A O no hydrogen 3.088 N/A GLU 155.A N GLU 155.A OE1 no hydrogen 2.831 N/A ALA 156.A N PRO 153.A O no hydrogen 3.083 N/A TRP 157.A N LYS 154.A O no hydrogen 3.360 N/A SER 158.A OG GLU 155.A O no hydrogen 3.303 N/A GLN 159.A N ALA 156.A O no hydrogen 2.786 N/A ILE 160.A N TRP 157.A O no hydrogen 3.138 N/A VAL 161.A N VAL 121.A O no hydrogen 2.746 N/A LEU 162.A N ARG 204.A O no hydrogen 2.968 N/A ALA 163.A N ALA 123.A O no hydrogen 2.885 N/A TYR 164.A N LEU 206.A O no hydrogen 2.797 N/A TYR 164.A OH GLU 127.A OE1 no hydrogen 2.740 N/A TYR 164.A OH GLU 127.A OE2 no hydrogen 3.370 N/A GLU 165.A N ILE 125.A O no hydrogen 2.759 N/A TRP 168.A N GLU 127.A O no hydrogen 3.119 N/A TRP 168.A NE1 TYR 164.A OH no hydrogen 2.967 N/A ALA 169.A N PRO 166.A O no hydrogen 2.854 N/A ILE 170.A N VAL 167.A O no hydrogen 3.226 N/A THR 172.A OG1 TRP 168.A O no hydrogen 2.669 N/A THR 176.A N GLN 179.A OE1 no hydrogen 2.920 N/A THR 176.A OG1 GLN 179.A OE1 no hydrogen 3.191 N/A GLN 179.A N THR 176.A OG1 no hydrogen 3.088 N/A ALA 180.A N THR 176.A O no hydrogen 2.984 N/A GLN 181.A N PRO 177.A O no hydrogen 2.966 N/A GLU 182.A N GLU 178.A O no hydrogen 2.974 N/A VAL 183.A N GLN 179.A O no hydrogen 3.324 N/A HIS 184.A N ALA 180.A O no hydrogen 2.970 N/A HIS 184.A ND1 ASP 224.A O no hydrogen 3.075 N/A ALA 185.A N GLN 181.A O no hydrogen 2.777 N/A LEU 186.A N GLU 182.A O no hydrogen 3.177 N/A LEU 187.A N VAL 183.A O no hydrogen 2.966 N/A ARG 188.A N HIS 184.A O no hydrogen 2.931 N/A ARG 188.A NE ASP 224.A OD1 no hydrogen 2.790 N/A ARG 188.A NH1 ALA 200.A O no hydrogen 2.826 N/A ARG 188.A NH1 LEU 203.A O no hydrogen 2.656 N/A ARG 188.A NH2 ASP 224.A O no hydrogen 2.895 N/A ARG 188.A NH2 ASN 226.A OD1 no hydrogen 2.721 N/A GLN 189.A N ALA 185.A O no hydrogen 2.867 N/A TRP 190.A N LEU 186.A O no hydrogen 3.037 N/A VAL 191.A N LEU 187.A O no hydrogen 2.999 N/A SER 192.A N ARG 188.A O no hydrogen 2.817 N/A SER 192.A OG ASN 197.A OD1 no hydrogen 2.733 N/A GLU 193.A N GLN 189.A O no hydrogen 2.919 N/A LYS 194.A N TRP 190.A O no hydrogen 2.901 N/A ILE 195.A N VAL 191.A O no hydrogen 2.858 N/A GLY 196.A N VAL 191.A O no hydrogen 2.949 N/A ALA 200.A N GLY 196.A O no hydrogen 2.968 N/A THR 201.A N ASN 197.A O no hydrogen 2.969 N/A THR 201.A OG1 ASN 197.A O no hydrogen 2.878 N/A LYS 202.A N GLY 198.A O no hydrogen 3.259 N/A ARG 204.A NH1 GLN 3.A O no hydrogen 2.960 N/A ARG 204.A NH1 GLN 3.A OE1 no hydrogen 2.928 N/A ILE 205.A N ASN 226.A OD1 no hydrogen 2.922 N/A LEU 206.A N LEU 162.A O no hydrogen 2.640 N/A TYR 207.A N GLY 227.A O no hydrogen 2.890 N/A GLY 208.A N TYR 164.A O no hydrogen 2.723 N/A THR 212.A N ASN 215.A OD1 no hydrogen 2.882 N/A ALA 213.A N GLU 238.A OE2 no hydrogen 2.789 N/A ASN 215.A N THR 212.A O no hydrogen 3.114 N/A ASN 215.A N THR 212.A OG1 no hydrogen 3.203 N/A ASN 215.A ND2 SER 210.A O no hydrogen 2.992 N/A ALA 216.A N THR 212.A O no hydrogen 2.943 N/A LEU 219.A N ASN 215.A O no hydrogen 2.939 N/A TYR 220.A N ALA 216.A O no hydrogen 2.853 N/A MET 221.A N LYS 217.A O no hydrogen 2.966 N/A LYS 222.A N LEU 219.A O no hydrogen 3.036 N/A LYS 222.A NZ GLU 178.A OE2 no hydrogen 2.917 N/A ILE 225.A N LYS 222.A O no hydrogen 3.244 N/A ASN 226.A N ILE 205.A O no hydrogen 3.016 N/A PHE 228.A N ILE 5.A O no hydrogen 2.903 N/A LEU 229.A N TYR 207.A O no hydrogen 3.034 N/A VAL 230.A N ALA 7.A O no hydrogen 2.778 N/A SER 234.A N GLY 231.A O no hydrogen 3.006 N/A SER 234.A OG ASN 9.A O no hydrogen 3.532 N/A SER 234.A OG VAL 230.A O no hydrogen 3.242 N/A SER 234.A OG GLY 231.A O no hydrogen 2.686 N/A LEU 235.A N GLY 232.A O no hydrogen 3.145 N/A LYS 236.A N ALA 233.A O no hydrogen 3.221 N/A PHE 239.A N LYS 236.A O no hydrogen 3.072 N/A ARG 240.A N PRO 237.A O no hydrogen 3.024 N/A ARG 240.A NE PRO 237.A O no hydrogen 2.858 N/A ILE 242.A N GLU 238.A O no hydrogen 3.244 N/A ILE 243.A N PHE 239.A O no hydrogen 3.043 N/A ASP 244.A N ARG 240.A O no hydrogen 2.915 N/A ALA 245.A N ASP 241.A O no hydrogen 3.007 N/A ALA 245.A N ILE 242.A O no hydrogen 3.166 N/A THR 246.A N ILE 243.A O no hydrogen 2.985 N/A THR 246.A OG1 HIS 33.A NE2 no hydrogen 2.805 N/A THR 246.A OG1 ILE 243.A O no hydrogen 2.735 N/A ARG 247.A N ASP 244.A O no hydrogen 3.292 N/A