Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4bkj_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 6.A N VAL 91.A O no hydrogen 2.787 N/A ARG 8.A NH1 PRO 97.A O no hydrogen 2.737 N/A ARG 8.A NH2 PRO 97.A O no hydrogen 3.118 N/A ARG 10.A N PRO 7.A O no hydrogen 3.040 N/A ARG 10.A NH1 ASP 31.A O no hydrogen 2.858 N/A ARG 10.A NH1 SER 32.A O no hydrogen 2.932 N/A ARG 10.A NH1 ASP 35.A OD2 no hydrogen 3.099 N/A ARG 10.A NH2 ASP 35.A OD2 no hydrogen 3.051 N/A LEU 11.A N ARG 8.A O no hydrogen 3.089 N/A ARG 12.A N GLU 29.A O no hydrogen 2.765 N/A ARG 12.A NH1 SER 9.A O no hydrogen 2.672 N/A ARG 12.A NH2 SER 9.A O no hydrogen 3.404 N/A ARG 12.A NH2 ASP 31.A OD2 no hydrogen 2.673 N/A LYS 14.A N LEU 27.A O no hydrogen 2.873 N/A GLU 15.A N LEU 27.A O no hydrogen 3.198 N/A LYS 16.A NZ GLU 24.A OE2 no hydrogen 3.198 N/A LEU 17.A N VAL 25.A O no hydrogen 2.776 N/A GLY 18.A N VAL 25.A O no hydrogen 3.283 N/A GLU 19.A N SER 174.A O no hydrogen 3.040 N/A GLY 20.A N GLY 23.A O no hydrogen 2.939 N/A GLU 24.A N ILE 57.A O no hydrogen 3.073 N/A VAL 25.A N GLY 18.A O no hydrogen 2.888 N/A HIS 26.A N VAL 55.A O no hydrogen 2.789 N/A HIS 26.A NE2 GLU 24.A OE1 no hydrogen 2.850 N/A LEU 27.A N GLU 15.A O no hydrogen 2.678 N/A CYS 28.A N VAL 53.A O no hydrogen 2.915 N/A GLU 29.A N ARG 12.A O no hydrogen 2.825 N/A VAL 30.A N LEU 51.A O no hydrogen 2.909 N/A ASP 31.A N ARG 10.A O no hydrogen 2.840 N/A ASP 35.A N SER 32.A O no hydrogen 3.077 N/A LEU 36.A N PRO 33.A O no hydrogen 2.900 N/A SER 38.A N PHE 41.A O no hydrogen 3.106 N/A SER 38.A OG LEU 36.A O no hydrogen 2.911 N/A PHE 41.A N SER 38.A OG no hydrogen 3.177 N/A HIS 49.A N ARG 46.A O no hydrogen 2.977 N/A VAL 53.A N CYS 28.A O no hydrogen 2.885 N/A ALA 54.A N THR 102.A O no hydrogen 2.897 N/A VAL 55.A N HIS 26.A O no hydrogen 2.784 N/A LYS 56.A N MET 100.A O no hydrogen 2.769 N/A LYS 56.A NZ GLU 73.A OE1 no hydrogen 2.781 N/A ILE 57.A N GLU 24.A O no hydrogen 2.830 N/A LEU 58.A N LEU 98.A O no hydrogen 2.894 N/A ARG 59.A N PHE 22.A O no hydrogen 2.858 N/A ARG 59.A NE ASP 61.A OD1 no hydrogen 2.812 N/A ARG 59.A NH1 GLN 21.A O no hydrogen 2.746 N/A ARG 59.A NH2 ASP 61.A OD2 no hydrogen 3.181 N/A ALA 62.A N ARG 59.A O no hydrogen 3.042 N/A ALA 66.A N THR 63.A OG1 no hydrogen 3.309 N/A ARG 67.A N THR 63.A O no hydrogen 2.924 N/A ARG 67.A NH1 ASP 96.A OD1 no hydrogen 2.893 N/A ASN 68.A N LYS 64.A O no hydrogen 2.875 N/A ASN 68.A ND2 LYS 64.A O no hydrogen 3.161 N/A ASP 69.A N ASN 65.A O no hydrogen 3.107 N/A PHE 70.A N ALA 66.A O no hydrogen 3.017 N/A LEU 71.A N ARG 67.A O no hydrogen 2.971 N/A LYS 72.A N ASN 68.A O no hydrogen 2.802 N/A GLU 73.A N ASP 69.A O no hydrogen 2.977 N/A VAL 74.A N PHE 70.A O no hydrogen 2.962 N/A LYS 75.A N LEU 71.A O no hydrogen 2.970 N/A ILE 76.A N LYS 72.A O no hydrogen 2.898 N/A MET 77.A N GLU 73.A O no hydrogen 2.807 N/A SER 78.A N VAL 74.A O no hydrogen 2.897 N/A SER 78.A OG.A VAL 74.A O no hydrogen 2.692 N/A SER 78.A OG.B VAL 74.A O no hydrogen 3.567 N/A SER 78.A OG.B LYS 75.A O no hydrogen 2.640 N/A ARG 79.A N ILE 76.A O no hydrogen 2.976 N/A ARG 79.A NH1.A ARG 79.A O no hydrogen 2.649 N/A LEU 80.A N MET 77.A O no hydrogen 3.199 N/A LYS 81.A N TYR 142.A OH no hydrogen 2.989 N/A LYS 81.A NZ SER 78.A O no hydrogen 2.868 N/A ASN 84.A N ASP 82.A OD2 no hydrogen 2.938 N/A ASN 84.A ND2 GLN 135.A OE1 no hydrogen 2.917 N/A ASN 84.A ND2 ILE 166.A O no hydrogen 2.820 N/A ILE 85.A N ASP 82.A O no hydrogen 3.238 N/A ILE 86.A N ILE 168.A O no hydrogen 2.972 N/A LEU 89.A N ILE 101.A O no hydrogen 2.740 N/A GLY 90.A N ILE 101.A O no hydrogen 3.367 N/A CYS 92.A N CYS 99.A O no hydrogen 2.967 N/A CYS 92.A SG PHE 6.A O no hydrogen 3.365 N/A VAL 93.A N ASP 5.A OD1 no hydrogen 3.013 N/A VAL 93.A N ASP 5.A OD2 no hydrogen 3.208 N/A GLN 94.A N ASP 5.A OD2 no hydrogen 2.889 N/A CYS 99.A N CYS 92.A O no hydrogen 2.865 N/A CYS 99.A SG PRO 97.A O no hydrogen 3.372 N/A MET 100.A N LYS 56.A O no hydrogen 2.898 N/A ILE 101.A N GLY 90.A O no hydrogen 2.859 N/A THR 102.A N ALA 54.A O no hydrogen 2.934 N/A THR 102.A OG1 ASP 103.A O no hydrogen 3.044 N/A GLY 108.A N MET 105.A O no hydrogen 2.982 N/A ASP 109.A N GLN 112.A OE1 no hydrogen 2.984 N/A LEU 110.A N CYS 158.A O no hydrogen 2.751 N/A ASN 111.A ND2 THR 155.A OG1 no hydrogen 3.103 N/A GLN 112.A N ASP 109.A OD1 no hydrogen 2.732 N/A PHE 113.A N ASP 109.A O no hydrogen 2.967 N/A LEU 114.A N LEU 110.A O no hydrogen 2.926 N/A SER 115.A N ASN 111.A O no hydrogen 2.924 N/A SER 115.A OG ASN 111.A O no hydrogen 2.851 N/A SER 115.A OG ASN 111.A OD1 no hydrogen 3.328 N/A ALA 116.A N GLN 112.A O no hydrogen 3.200 N/A ALA 116.A N PHE 113.A O no hydrogen 3.191 N/A HIS 117.A N LEU 114.A O no hydrogen 3.090 N/A HIS 117.A ND1 PHE 113.A O no hydrogen 2.645 N/A GLN 118.A N PRO 122.A O no hydrogen 2.984 N/A GLU 120.A N ILE 124.A O no hydrogen 2.916 N/A ILE 124.A N GLN 118.A O no hydrogen 2.925 N/A MET 128.A N SER 125.A OG no hydrogen 2.996 N/A LEU 129.A N SER 125.A O no hydrogen 2.973 N/A LEU 130.A N TYR 126.A O no hydrogen 3.019 N/A HIS 131.A N PRO 127.A O no hydrogen 2.979 N/A VAL 132.A N MET 128.A O no hydrogen 2.860 N/A ALA 133.A N LEU 129.A O no hydrogen 2.984 N/A ALA 134.A N LEU 130.A O no hydrogen 2.782 N/A GLN 135.A N HIS 131.A O no hydrogen 3.020 N/A GLN 135.A NE2 HIS 131.A O no hydrogen 3.386 N/A GLN 135.A NE2 PHE 164.A O no hydrogen 2.899 N/A ILE 136.A N VAL 132.A O no hydrogen 3.146 N/A ALA 137.A N ALA 133.A O no hydrogen 2.951 N/A SER 138.A N ALA 134.A O no hydrogen 2.905 N/A GLY 139.A N GLN 135.A O no hydrogen 2.951 N/A MET 140.A N ILE 136.A O no hydrogen 2.940 N/A ARG 141.A N ALA 137.A O no hydrogen 2.837 N/A TYR 142.A N SER 138.A O no hydrogen 3.110 N/A TYR 142.A OH ARG 79.A O no hydrogen 3.382 N/A LEU 143.A N GLY 139.A O no hydrogen 2.968 N/A ALA 144.A N MET 140.A O no hydrogen 2.877 N/A THR 145.A N ARG 141.A O no hydrogen 2.942 N/A THR 145.A OG1 ARG 141.A O no hydrogen 3.021 N/A THR 145.A OG1 TYR 142.A O no hydrogen 3.037 N/A LEU 146.A N TYR 142.A O no hydrogen 3.194 N/A LEU 146.A N LEU 143.A O no hydrogen 3.091 N/A ASN 147.A N ALA 144.A O no hydrogen 2.894 N/A PHE 148.A N LEU 143.A O no hydrogen 3.045 N/A HIS 150.A N ASP 207.A OD2 no hydrogen 2.735 N/A HIS 150.A NE2 ALA 169.A O no hydrogen 2.741 N/A ARG 151.A N ASP 207.A OD1 no hydrogen 3.019 N/A ASP 152.A N HIS 150.A ND1 no hydrogen 3.065 N/A THR 155.A N GLU 217.A OE2 no hydrogen 3.003 N/A THR 155.A OG1 GLU 217.A OE1 no hydrogen 2.787 N/A ARG 156.A NE TYR 182.A OH no hydrogen 2.852 N/A ARG 156.A NH2 ASP 152.A OD1 no hydrogen 2.896 N/A ARG 156.A NH2 TYR 182.A OH no hydrogen 3.475 N/A ASN 157.A N ALA 154.A O no hydrogen 2.991 N/A ASN 157.A ND2 ASP 152.A O no hydrogen 2.769 N/A CYS 158.A N THR 155.A O no hydrogen 3.097 N/A CYS 158.A SG ALA 154.A O no hydrogen 3.673 N/A LEU 159.A N LYS 167.A O no hydrogen 2.806 N/A VAL 160.A N GLY 108.A O no hydrogen 2.994 N/A GLY 161.A N THR 165.A O no hydrogen 2.688 N/A THR 165.A N GLU 162.A O no hydrogen 3.057 N/A THR 165.A OG1 GLU 162.A O no hydrogen 2.949 N/A ILE 166.A N GLN 135.A OE1 no hydrogen 2.941 N/A LYS 167.A N LEU 159.A O no hydrogen 2.829 N/A LYS 167.A NZ PRO 83.A O no hydrogen 2.691 N/A ILE 168.A N ASN 84.A O no hydrogen 2.816 N/A ALA 169.A N ASN 157.A O no hydrogen 2.743 N/A PHE 171.A N ASN 157.A OD1 no hydrogen 3.129 N/A SER 174.A N GLY 172.A O no hydrogen 2.914 N/A SER 174.A OG.A PHE 171.A O no hydrogen 2.976 N/A SER 174.A OG.B PHE 171.A O no hydrogen 2.942 N/A ARG 175.A NH1 ASP 109.A OD2 no hydrogen 3.202 N/A ARG 175.A NH2 ASP 109.A OD2 no hydrogen 3.378 N/A ARG 175.A NH2 ARG 156.A O no hydrogen 2.667 N/A TYR 178.A N ARG 175.A O no hydrogen 3.220 N/A TYR 178.A OH ASP 109.A OD2 no hydrogen 2.553 N/A ALA 179.A N ASN 176.A O no hydrogen 3.094 N/A ASP 181.A N TYR 178.A O no hydrogen 2.858 N/A TYR 182.A N ALA 179.A O no hydrogen 3.258 N/A TYR 182.A OH ASP 152.A OD1 no hydrogen 3.399 N/A TYR 182.A OH ASP 152.A OD2 no hydrogen 2.585 N/A TYR 183.A N LEU 187.A O no hydrogen 2.805 N/A TYR 183.A OH GLU 233.A OE2.A no hydrogen 2.658 N/A LEU 187.A N TYR 183.A O no hydrogen 2.860 N/A ILE 189.A N LEU 187.A O no hydrogen 2.917 N/A ARG 190.A NH1 PRO 226.A O no hydrogen 3.166 N/A ARG 190.A NH1 PHE 227.A O no hydrogen 2.738 N/A ARG 190.A NH1 LEU 230.A O no hydrogen 3.172 N/A ARG 190.A NH2 LEU 230.A O no hydrogen 2.932 N/A ARG 190.A NH2 ASP 232.A OD1 no hydrogen 2.897 N/A TRP 191.A N PRO 188.A O no hydrogen 2.974 N/A TRP 191.A NE1 GLU 217.A OE2 no hydrogen 2.874 N/A MET 192.A N ILE 189.A O no hydrogen 3.138 N/A TRP 194.A NE1 ARG 272.A O no hydrogen 2.786 N/A GLU 195.A N GLU 195.A OE1 no hydrogen 2.794 N/A CYS 196.A N ALA 193.A O no hydrogen 2.962 N/A CYS 196.A SG LYS 201.A O no hydrogen 3.356 N/A ILE 197.A N ALA 193.A O no hydrogen 3.280 N/A LEU 198.A N TRP 194.A O no hydrogen 2.973 N/A MET 199.A N GLU 195.A O no hydrogen 2.907 N/A GLY 200.A N CYS 196.A O no hydrogen 2.943 N/A LYS 201.A N GLU 195.A O no hydrogen 3.313 N/A THR 203.A N SER 206.A OG no hydrogen 2.905 N/A SER 206.A N THR 203.A OG1 no hydrogen 3.025 N/A SER 206.A OG THR 203.A O no hydrogen 2.982 N/A ASP 207.A N THR 203.A O no hydrogen 2.876 N/A VAL 208.A N THR 204.A O no hydrogen 2.845 N/A TRP 209.A N ALA 205.A O no hydrogen 3.176 N/A ALA 210.A N SER 206.A O no hydrogen 2.996 N/A PHE 211.A N ASP 207.A O no hydrogen 2.780 N/A GLY 212.A N VAL 208.A O no hydrogen 2.938 N/A VAL 213.A N TRP 209.A O no hydrogen 3.176 N/A THR 214.A N ALA 210.A O no hydrogen 2.814 N/A THR 214.A OG1 ALA 210.A O no hydrogen 2.824 N/A LEU 215.A N PHE 211.A O no hydrogen 2.730 N/A TRP 216.A N GLY 212.A O no hydrogen 2.960 N/A TRP 216.A NE1 SER 253.A O no hydrogen 2.732 N/A GLU 217.A N VAL 213.A O no hydrogen 2.888 N/A VAL 218.A N THR 214.A O no hydrogen 2.935 N/A LEU 219.A N LEU 215.A O no hydrogen 2.928 N/A MET 220.A N TRP 216.A O no hydrogen 2.964 N/A MET 220.A N GLU 217.A O no hydrogen 3.146 N/A LEU 221.A N VAL 218.A O no hydrogen 2.943 N/A CYS 222.A N GLU 217.A O no hydrogen 2.894 N/A CYS 222.A SG THR 155.A OG1 no hydrogen 3.540 N/A CYS 222.A SG GLU 217.A O no hydrogen 3.936 N/A ARG 223.A N MET 220.A O no hydrogen 3.095 N/A ARG 223.A NH1 LEU 114.A O no hydrogen 2.984 N/A ARG 223.A NH1 HIS 117.A O no hydrogen 2.998 N/A ARG 223.A NH1 LEU 221.A O no hydrogen 3.004 N/A ARG 223.A NH2 HIS 117.A O no hydrogen 2.896 N/A GLN 225.A NE2 GLY 180.A O no hydrogen 3.015 N/A GLN 225.A NE2 ASP 181.A OD1 no hydrogen 3.038 N/A GLY 228.A N GLN 225.A O no hydrogen 3.036 N/A GLN 229.A N GLN 229.A OE1 no hydrogen 2.728 N/A LEU 230.A N PHE 227.A O no hydrogen 2.760 N/A THR 231.A N GLN 234.A OE1 no hydrogen 3.002 N/A GLN 234.A N THR 231.A OG1 no hydrogen 3.170 N/A VAL 235.A N THR 231.A O no hydrogen 2.918 N/A ILE 236.A N ASP 232.A O no hydrogen 3.131 N/A GLU 237.A N GLU 233.A O no hydrogen 2.977 N/A ASN 238.A N GLN 234.A O no hydrogen 2.801 N/A ASN 238.A ND2 VAL 250.A O no hydrogen 2.939 N/A ALA 239.A N VAL 235.A O no hydrogen 3.101 N/A GLY 240.A N ILE 236.A O no hydrogen 3.253 N/A GLU 241.A N GLU 237.A O no hydrogen 3.073 N/A PHE 242.A N ASN 238.A O no hydrogen 3.076 N/A PHE 243.A N ALA 239.A O no hydrogen 3.071 N/A ARG 244.A N GLY 240.A O no hydrogen 2.899 N/A ASP 245.A N GLU 241.A O no hydrogen 2.889 N/A ARG 248.A NE GLU 241.A OE2 no hydrogen 2.972 N/A ARG 248.A NH2 GLU 241.A OE2 no hydrogen 3.387 N/A GLN 249.A N GLN 249.A OE1 no hydrogen 2.787 N/A GLN 249.A NE2 TYR 251.A OH no hydrogen 3.135 N/A VAL 250.A N ASN 238.A OD1 no hydrogen 2.740 N/A ARG 254.A NH1 CYS 258.A O no hydrogen 2.870 N/A CYS 258.A N PRO 255.A O no hydrogen 2.891 N/A CYS 258.A SG PRO 259.A O no hydrogen 3.390 N/A GLN 260.A NE2 GLU 264.A OE2 no hydrogen 2.920 N/A TYR 263.A N PRO 259.A O no hydrogen 3.002 N/A TYR 263.A OH LEU 252.A O no hydrogen 2.633 N/A GLU 264.A N GLN 260.A O no hydrogen 2.884 N/A LEU 265.A N GLY 261.A O no hydrogen 3.047 N/A MET 266.A N LEU 262.A O no hydrogen 3.061 N/A LEU 267.A N TYR 263.A O no hydrogen 2.863 N/A ARG 268.A N GLU 264.A O no hydrogen 2.915 N/A CYS 269.A N LEU 265.A O no hydrogen 2.994 N/A CYS 269.A SG LEU 265.A O no hydrogen 3.528 N/A TRP 270.A N MET 266.A O no hydrogen 3.181 N/A TRP 270.A N LEU 267.A O no hydrogen 2.988 N/A TRP 270.A NE1 TRP 209.A O no hydrogen 3.133 N/A SER 271.A N ARG 268.A O no hydrogen 3.157 N/A SER 271.A OG ARG 268.A O no hydrogen 2.750 N/A ARG 272.A NE PHE 242.A O no hydrogen 3.161 N/A ARG 272.A NE PHE 243.A O no hydrogen 3.066 N/A ARG 272.A NH1 GLU 273.A OE2 no hydrogen 2.616 N/A ARG 272.A NH2 PHE 243.A O no hydrogen 2.919 N/A GLN 276.A N GLU 273.A O no hydrogen 2.964 N/A ARG 277.A N SER 274.A O no hydrogen 2.981 N/A ARG 277.A NE SER 271.A O no hydrogen 2.892 N/A ARG 277.A NH1 GLU 195.A OE2 no hydrogen 2.738 N/A ARG 277.A NH1 ALA 205.A O no hydrogen 3.115 N/A ARG 277.A NH2 GLU 195.A OE1 no hydrogen 2.900 N/A ARG 277.A NH2 GLU 195.A OE2 no hydrogen 3.493 N/A ARG 277.A NH2 SER 271.A O no hydrogen 3.099 N/A ARG 277.A NH2 ARG 272.A O no hydrogen 3.331 N/A LEU 283.A N PRO 279.A O no hydrogen 2.971 N/A HIS 284.A N PHE 280.A O no hydrogen 2.852 N/A ARG 285.A N SER 281.A O no hydrogen 3.069 N/A PHE 286.A N GLN 282.A O no hydrogen 2.829 N/A LEU 287.A N LEU 283.A O no hydrogen 3.016 N/A ALA 288.A N HIS 284.A O no hydrogen 2.808 N/A GLU 289.A N ARG 285.A O no hydrogen 2.879 N/A ALA 291.A N PHE 286.A O no hydrogen 2.773 N/A LEU 292.A N LEU 287.A O no hydrogen 3.409 N/A ASN 293.A N GLU 289.A O no hydrogen 2.677 N/A THR 294.A N ALA 291.A O no hydrogen 3.154 N/A THR 294.A OG1 ASP 290.A O no hydrogen 2.729 N/A THR 294.A OG1 ALA 291.A O no hydrogen 3.258 N/A