Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4k0g_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 3.A NE2.B GLY 66.A O no hydrogen 2.867 N/A GLU 5.A N LEU 64.A O no hydrogen 2.913 N/A LEU 6.A N ASN 38.A O no hydrogen 2.958 N/A PHE 7.A N PHE 62.A O no hydrogen 2.842 N/A VAL 8.A N THR 40.A O no hydrogen 3.035 N/A LYS 9.A NZ ASN 19.A O no hydrogen 2.890 N/A ALA 10.A N VAL 42.A O no hydrogen 2.866 N/A GLY 11.A N LYS 16.A O no hydrogen 2.746 N/A SER 12.A N GLU 224.A OE1 no hydrogen 2.864 N/A SER 12.A OG GLU 224.A OE1 no hydrogen 3.474 N/A SER 12.A OG GLU 224.A OE2 no hydrogen 2.399 N/A GLY 14.A N GLY 11.A O no hydrogen 2.901 N/A ALA 15.A N ASP 13.A OD1 no hydrogen 2.862 N/A LYS 16.A N ASP 13.A OD1 no hydrogen 2.910 N/A GLY 18.A N LYS 9.A O no hydrogen 2.901 N/A SER 20.A OG SER 23.A OG no hydrogen 3.315 N/A PHE 22.A N SER 20.A OG no hydrogen 3.101 N/A SER 23.A N SER 20.A OG no hydrogen 3.030 N/A GLN 24.A N SER 20.A O no hydrogen 3.283 N/A GLN 24.A NE2 THR 218.A OG1 no hydrogen 3.027 N/A ARG 25.A N PRO 21.A O no hydrogen 2.997 N/A ARG 25.A NE GLU 77.A OE1.B no hydrogen 2.669 N/A ARG 25.A NH1 ASN 74.A OD1 no hydrogen 2.858 N/A ARG 25.A NH2 ASN 74.A OD1 no hydrogen 3.192 N/A ARG 25.A NH2 GLU 77.A OE2.A no hydrogen 3.015 N/A ARG 25.A NH2 GLU 77.A OE2.B no hydrogen 3.027 N/A LEU 26.A N PHE 22.A O no hydrogen 3.261 N/A PHE 27.A N SER 23.A O no hydrogen 2.985 N/A MET 28.A N GLN 24.A O no hydrogen 2.838 N/A VAL 29.A N ARG 25.A O no hydrogen 3.014 N/A LEU 30.A N LEU 26.A O no hydrogen 2.973 N/A TRP 31.A N PHE 27.A O no hydrogen 2.961 N/A LEU 32.A N MET 28.A O no hydrogen 2.883 N/A LYS 33.A N VAL 29.A O no hydrogen 2.980 N/A LYS 33.A NZ GLU 81.A OE1 no hydrogen 2.739 N/A LYS 33.A NZ LEU 84.A O no hydrogen 2.733 N/A LYS 33.A NZ PRO 90.A O no hydrogen 2.794 N/A GLY 34.A N TRP 31.A O no hydrogen 3.111 N/A ASN 38.A N VAL 4.A O no hydrogen 3.126 N/A VAL 39.A N ASN 38.A OD1 no hydrogen 2.794 N/A THR 40.A N LEU 6.A O no hydrogen 2.848 N/A THR 40.A OG1 GLU 5.A OE2.A no hydrogen 2.544 N/A THR 40.A OG1 GLU 5.A OE2.B no hydrogen 2.590 N/A THR 41.A OG1 ALA 15.A O no hydrogen 2.662 N/A VAL 42.A N VAL 8.A O no hydrogen 2.764 N/A LYS 45.A N ASP 43.A OD1 no hydrogen 2.957 N/A ARG 46.A N ASP 43.A O no hydrogen 2.846 N/A ARG 47.A NH2 GLY 58.A O no hydrogen 2.841 N/A VAL 51.A N THR 48.A OG1 no hydrogen 3.216 N/A GLN 52.A N THR 48.A O no hydrogen 3.101 N/A LYS 53.A N GLU 49.A O no hydrogen 2.990 N/A LEU 54.A N THR 50.A O no hydrogen 3.093 N/A CYS 55.A N VAL 51.A O no hydrogen 2.943 N/A CYS 55.A SG GLN 59.A O no hydrogen 3.848 N/A CYS 55.A SG GLN 59.A OE1 no hydrogen 3.585 N/A GLY 58.A N CYS 55.A O no hydrogen 2.965 N/A GLN 59.A N GLN 59.A OE1 no hydrogen 2.906 N/A PHE 62.A N PHE 7.A O no hydrogen 3.048 N/A LEU 63.A N HIS 70.A O no hydrogen 2.864 N/A LEU 64.A N GLU 5.A O no hydrogen 2.799 N/A TYR 65.A N GLU 68.A O no hydrogen 2.858 N/A TYR 65.A OH GLN 1.A OE1 no hydrogen 3.081 N/A GLY 66.A N GLN 3.A O no hydrogen 2.841 N/A GLU 68.A N TYR 65.A O no hydrogen 3.111 N/A HIS 70.A N LEU 63.A O no hydrogen 2.799 N/A HIS 70.A NE2 GLU 68.A OE1.A no hydrogen 2.842 N/A LYS 75.A N ASP 72.A OD2 no hydrogen 3.158 N/A ILE 76.A N ASP 72.A O no hydrogen 2.842 N/A GLU 77.A N THR 73.A O no hydrogen 3.039 N/A GLU 78.A N ASN 74.A O no hydrogen 3.092 N/A PHE 79.A N LYS 75.A O no hydrogen 2.935 N/A LEU 80.A N ILE 76.A O no hydrogen 2.880 N/A GLU 81.A N GLU 77.A O no hydrogen 2.909 N/A ALA 82.A N GLU 78.A O no hydrogen 3.052 N/A VAL 83.A N PHE 79.A O no hydrogen 2.868 N/A LEU 84.A N LEU 80.A O no hydrogen 2.947 N/A CYS 85.A SG ALA 82.A O no hydrogen 3.454 N/A CYS 85.A SG VAL 83.A O no hydrogen 3.873 N/A CYS 85.A SG PRO 86.A O no hydrogen 3.796 N/A TYR 89.A N CYS 85.A O no hydrogen 3.061 N/A LEU 92.A N GLU 81.A OE1 no hydrogen 3.006 N/A LEU 92.A N GLU 81.A OE2 no hydrogen 3.170 N/A ALA 93.A N GLU 81.A OE2 no hydrogen 2.941 N/A LEU 95.A N ASP 165.A OD2 no hydrogen 2.701 N/A ASN 96.A N ASP 165.A OD1 no hydrogen 3.074 N/A ASN 96.A ND2 ASP 165.A OD1 no hydrogen 2.951 N/A SER 99.A N ASN 96.A O no hydrogen 2.911 N/A SER 99.A OG TYR 139.A OH no hydrogen 2.737 N/A SER 99.A OG LEU 164.A O no hydrogen 3.491 N/A SER 99.A OG ASP 165.A OD1 no hydrogen 2.717 N/A ASN 100.A N PRO 97.A O no hydrogen 2.960 N/A THR 101.A N GLU 98.A O no hydrogen 3.091 N/A THR 101.A OG1 GLU 98.A O no hydrogen 3.293 N/A ALA 102.A N GLU 98.A O no hydrogen 2.971 N/A LEU 104.A N THR 101.A O no hydrogen 3.173 N/A ILE 106.A N GLY 103.A O no hydrogen 3.020 N/A PHE 107.A N LEU 104.A O no hydrogen 3.322 N/A LYS 109.A N ASP 105.A O no hydrogen 3.087 N/A PHE 110.A N ILE 106.A O no hydrogen 2.848 N/A SER 111.A N PHE 107.A O no hydrogen 2.833 N/A SER 111.A OG PHE 107.A O no hydrogen 2.944 N/A ALA 112.A N ALA 108.A O no hydrogen 3.092 N/A TYR 113.A N LYS 109.A O no hydrogen 3.084 N/A TYR 113.A OH GLU 126.A OE1.A no hydrogen 2.699 N/A ILE 114.A N PHE 110.A O no hydrogen 2.842 N/A LYS 115.A N SER 111.A O no hydrogen 2.996 N/A ASN 116.A N ALA 112.A O no hydrogen 3.059 N/A ASN 116.A ND2 ASN 118.A O no hydrogen 2.907 N/A ASN 118.A N ASN 116.A OD1 no hydrogen 2.935 N/A ALA 120.A N ASN 118.A OD1 no hydrogen 2.893 N/A LEU 121.A N ASN 118.A O no hydrogen 2.955 N/A ASN 122.A N PRO 119.A O no hydrogen 3.403 N/A LEU 125.A N LEU 121.A O no hydrogen 2.897 N/A GLU 126.A N.A ASN 122.A O no hydrogen 2.880 N/A GLU 126.A N.B ASN 122.A O no hydrogen 2.878 N/A LYS 127.A N ASP 123.A O no hydrogen 2.975 N/A GLY 128.A N ASN 124.A O no hydrogen 2.991 N/A LEU 129.A N LEU 125.A O no hydrogen 3.078 N/A LEU 130.A N GLU 126.A O.A no hydrogen 2.870 N/A LEU 130.A N GLU 126.A O.B no hydrogen 2.872 N/A LYS 131.A N LYS 127.A O no hydrogen 2.837 N/A ALA 132.A N GLY 128.A O no hydrogen 3.141 N/A LEU 133.A N LEU 129.A O no hydrogen 2.967 N/A LYS 134.A N LEU 130.A O no hydrogen 2.865 N/A LYS 134.A NZ ASN 138.A OD1 no hydrogen 2.871 N/A VAL 135.A N LYS 131.A O no hydrogen 2.943 N/A LEU 136.A N ALA 132.A O no hydrogen 3.113 N/A ASP 137.A N LEU 133.A O no hydrogen 2.888 N/A ASN 138.A N LYS 134.A O no hydrogen 2.849 N/A TYR 139.A N VAL 135.A O no hydrogen 3.050 N/A TYR 139.A OH SER 99.A OG no hydrogen 2.737 N/A LEU 140.A N LEU 136.A O no hydrogen 2.977 N/A THR 141.A N ASP 137.A O no hydrogen 2.967 N/A THR 141.A OG1 ASP 137.A O no hydrogen 3.199 N/A THR 141.A OG1 ASN 138.A O no hydrogen 3.314 N/A SER 142.A N TYR 139.A O no hydrogen 3.220 N/A SER 142.A OG ASN 138.A O no hydrogen 2.647 N/A LEU 144.A N GLU 147.A OE2 no hydrogen 2.833 N/A GLU 147.A N LEU 144.A O no hydrogen 2.903 N/A VAL 148.A N PRO 145.A O no hydrogen 3.131 N/A GLU 150.A N GLU 147.A O no hydrogen 3.182 N/A VAL 158.A N ASP 155.A O no hydrogen 3.060 N/A SER 159.A N THR 141.A O no hydrogen 2.879 N/A SER 159.A OG GLU 147.A OE1 no hydrogen 2.745 N/A SER 159.A OG GLU 147.A OE2 no hydrogen 3.326 N/A GLN 160.A NE2 VAL 158.A O no hydrogen 3.546 N/A ARG 161.A NE PHE 163.A O no hydrogen 3.031 N/A ARG 161.A NE LEU 164.A O no hydrogen 3.116 N/A ARG 161.A NH1 TYR 139.A O no hydrogen 3.404 N/A ARG 161.A NH1 SER 142.A O no hydrogen 2.793 N/A ARG 161.A NH1 SER 159.A OG no hydrogen 3.030 N/A ARG 161.A NH2 TYR 139.A O no hydrogen 2.903 N/A ARG 161.A NH2 LEU 164.A O no hydrogen 2.982 N/A LYS 162.A N ASN 167.A OD1 no hydrogen 2.952 N/A LYS 162.A NZ ASN 208.A OD1 no hydrogen 3.501 N/A PHE 163.A N GLY 166.A O no hydrogen 2.906 N/A LEU 164.A N ASP 173.A OD1 no hydrogen 3.197 N/A THR 170.A N ASP 173.A OD2 no hydrogen 2.831 N/A THR 170.A OG1 ASP 173.A OD2 no hydrogen 3.241 N/A LEU 171.A N LEU 92.A O no hydrogen 2.875 N/A CYS 174.A N THR 170.A O no hydrogen 3.239 N/A CYS 174.A SG THR 170.A O no hydrogen 3.599 N/A ASN 175.A N LEU 171.A O no hydrogen 3.149 N/A LEU 176.A N ALA 172.A O no hydrogen 3.087 N/A LEU 177.A N ASP 173.A O no hydrogen 2.892 N/A LYS 179.A NZ ASN 175.A OD1 no hydrogen 2.891 N/A LEU 180.A N LEU 176.A O no hydrogen 2.905 N/A HIS 181.A N LEU 177.A O no hydrogen 2.847 N/A HIS 181.A ND1 TYR 210.A OH no hydrogen 2.704 N/A ILE 182.A N PRO 178.A O no hydrogen 3.245 N/A VAL 183.A N LYS 179.A O no hydrogen 3.020 N/A GLN 184.A N LEU 180.A O no hydrogen 2.975 N/A VAL 185.A N HIS 181.A O no hydrogen 3.026 N/A VAL 186.A N ILE 182.A O no hydrogen 2.896 N/A CYS 187.A N VAL 183.A O no hydrogen 2.948 N/A LYS 188.A N GLN 184.A O no hydrogen 3.067 N/A LYS 189.A N VAL 185.A O no hydrogen 3.266 N/A TYR 190.A N VAL 186.A O no hydrogen 2.983 N/A TYR 190.A OH GLU 226.A O no hydrogen 2.746 N/A ARG 191.A N CYS 187.A O no hydrogen 2.963 N/A ARG 191.A NE TYR 113.A O no hydrogen 3.409 N/A ARG 191.A NH1 TYR 190.A O no hydrogen 3.219 N/A ARG 191.A NH1 ALA 233.A O no hydrogen 2.939 N/A ARG 191.A NH2 TYR 113.A O no hydrogen 3.059 N/A PHE 193.A N CYS 187.A O no hydrogen 3.055 N/A PHE 199.A N PRO 196.A O no hydrogen 3.019 N/A VAL 202.A N ASP 137.A OD1 no hydrogen 2.927 N/A HIS 203.A N PHE 199.A O no hydrogen 3.027 N/A HIS 203.A NE2 ILE 195.A O no hydrogen 2.871 N/A ARG 204.A N ARG 200.A O no hydrogen 2.894 N/A ARG 204.A NH2 SER 159.A O no hydrogen 3.080 N/A TYR 205.A N GLY 201.A O no hydrogen 2.993 N/A TYR 205.A OH ASP 173.A OD1 no hydrogen 2.718 N/A LEU 206.A N VAL 202.A O no hydrogen 2.884 N/A SER 207.A N HIS 203.A O no hydrogen 2.900 N/A SER 207.A OG HIS 203.A O no hydrogen 3.092 N/A ASN 208.A N ARG 204.A O no hydrogen 2.947 N/A ASN 208.A ND2 LYS 162.A O no hydrogen 3.687 N/A ALA 209.A N TYR 205.A O no hydrogen 2.880 N/A TYR 210.A N LEU 206.A O no hydrogen 2.851 N/A TYR 210.A OH HIS 181.A ND1 no hydrogen 2.704 N/A TYR 210.A OH GLN 184.A OE1.A no hydrogen 3.276 N/A TYR 210.A OH GLN 184.A OE1.B no hydrogen 2.963 N/A ALA 211.A N SER 207.A O no hydrogen 3.200 N/A ARG 212.A N ALA 209.A O no hydrogen 2.942 N/A ARG 212.A NE GLU 214.A OE1 no hydrogen 2.899 N/A ARG 212.A NH2 GLU 214.A OE2 no hydrogen 3.044 N/A GLU 214.A N GLU 214.A OE1 no hydrogen 2.767 N/A PHE 215.A N ARG 212.A O no hydrogen 3.063 N/A ALA 216.A N ARG 212.A O no hydrogen 2.961 N/A SER 217.A N GLU 213.A O no hydrogen 2.808 N/A THR 218.A N PHE 215.A O no hydrogen 3.146 N/A THR 218.A OG1 GLU 214.A O no hydrogen 2.780 N/A THR 218.A OG1 PHE 215.A O no hydrogen 3.116 N/A CYS 219.A N ALA 216.A O no hydrogen 3.412 N/A CYS 219.A SG PHE 215.A O no hydrogen 3.410 N/A ILE 225.A N ASP 221.A O no hydrogen 3.313 N/A GLU 226.A N ASP 222.A O no hydrogen 2.894 N/A LEU 227.A N GLU 223.A O no hydrogen 2.892 N/A ALA 228.A N GLU 224.A O no hydrogen 2.988 N/A TYR 229.A N ILE 225.A O no hydrogen 3.293 N/A TYR 229.A N GLU 226.A O no hydrogen 3.287 N/A GLU 230.A N LEU 227.A O no hydrogen 3.295 N/A ALA 233.A N TYR 229.A O no hydrogen 2.900 N/A LYS 234.A N GLU 230.A O no hydrogen 3.047 N/A LYS 234.A NZ GLU 230.A OE2 no hydrogen 2.762 N/A ALA 235.A N VAL 232.A O no hydrogen 3.384 N/A LYS 237.A NZ LYS 234.A O no hydrogen 2.957 N/A