Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3nbl_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 4.A N ASP 1.A OD2 no hydrogen 3.163 N/A ARG 5.A N ASP 1.A O no hydrogen 3.475 N/A PHE 6.A N LEU 2.A O no hydrogen 2.816 N/A ALA 7.A N ALA 3.A O no hydrogen 3.020 N/A GLU 8.A N ASP 4.A O no hydrogen 2.955 N/A LEU 9.A N ARG 5.A O no hydrogen 3.093 N/A GLU 10.A N PHE 6.A O no hydrogen 3.043 N/A ARG 11.A N ALA 7.A O no hydrogen 3.183 N/A ARG 12.A N GLU 8.A O no hydrogen 3.005 N/A ARG 12.A NH1 GLU 251.A OE2 no hydrogen 2.973 N/A TYR 13.A N LEU 9.A O no hydrogen 3.027 N/A TYR 13.A OH GLU 251.A OE2 no hydrogen 2.579 N/A ASP 14.A N ARG 11.A O no hydrogen 3.490 N/A ALA 15.A N GLU 10.A O no hydrogen 2.832 N/A ARG 16.A N ASP 234.A O no hydrogen 2.845 N/A ARG 16.A NE ASP 234.A OD1 no hydrogen 3.083 N/A ARG 16.A NH1 ARG 37.A O no hydrogen 2.802 N/A ARG 16.A NH1 ASP 234.A OD2 no hydrogen 2.767 N/A ARG 16.A NH2 GLU 36.A OE1 no hydrogen 2.894 N/A ARG 16.A NH2 ARG 37.A O no hydrogen 3.043 N/A LEU 17.A N GLU 10.A OE2 no hydrogen 2.702 N/A GLY 18.A N MET 232.A O no hydrogen 2.728 N/A VAL 19.A N TYR 32.A O no hydrogen 2.799 N/A TYR 20.A N ALA 230.A O no hydrogen 2.883 N/A VAL 21.A N ILE 30.A O no hydrogen 2.890 N/A THR 24.A N THR 27.A O no hydrogen 2.855 N/A THR 24.A OG1 THR 27.A OG1 no hydrogen 2.690 N/A THR 26.A N THR 24.A OG1 no hydrogen 3.297 N/A THR 27.A N THR 24.A OG1 no hydrogen 3.066 N/A THR 27.A OG1 THR 24.A OG1 no hydrogen 2.690 N/A ILE 30.A N VAL 21.A O no hydrogen 2.846 N/A TYR 32.A N VAL 19.A O no hydrogen 2.931 N/A TYR 32.A OH GLU 10.A OE1 no hydrogen 2.662 N/A ARG 33.A NE GLU 10.A OE2 no hydrogen 2.711 N/A ARG 33.A NH1 GLU 36.A OE2 no hydrogen 3.169 N/A ARG 33.A NH2 GLU 10.A OE1 no hydrogen 2.982 N/A ARG 33.A NH2 GLU 10.A OE2 no hydrogen 3.552 N/A GLU 36.A N ARG 33.A O no hydrogen 3.112 N/A ARG 37.A NH1 VAL 133.A O no hydrogen 2.947 N/A ARG 37.A NH1 THR 150.A OG1 no hydrogen 2.971 N/A ARG 37.A NH2 VAL 133.A O no hydrogen 2.916 N/A PHE 38.A N THR 151.A O no hydrogen 2.897 N/A PHE 40.A N ASP 149.A O no hydrogen 2.877 N/A THR 43.A N PHE 40.A O no hydrogen 3.223 N/A THR 43.A OG1 PHE 40.A O no hydrogen 2.754 N/A LYS 45.A N SER 42.A O no hydrogen 3.120 N/A LYS 45.A NZ SER 42.A OG no hydrogen 2.918 N/A LYS 45.A NZ SER 100.A O no hydrogen 2.936 N/A LYS 45.A NZ SER 100.A OG no hydrogen 3.348 N/A ALA 46.A N THR 43.A O no hydrogen 3.431 N/A LEU 48.A N PHE 44.A O no hydrogen 2.925 N/A VAL 49.A N LYS 45.A O no hydrogen 3.056 N/A ALA 50.A N ALA 46.A O no hydrogen 3.120 N/A ALA 51.A N PRO 47.A O no hydrogen 2.834 N/A VAL 52.A N LEU 48.A O no hydrogen 3.036 N/A LEU 53.A N VAL 49.A O no hydrogen 2.872 N/A HIS 54.A N ALA 50.A O no hydrogen 2.861 N/A GLN 55.A N ALA 51.A O no hydrogen 2.902 N/A ASN 56.A N LEU 53.A O no hydrogen 3.451 N/A ASN 56.A ND2 VAL 52.A O no hydrogen 2.916 N/A HIS 60.A N PRO 57.A O no hydrogen 2.985 N/A HIS 60.A NE2 ASP 111.A OD2 no hydrogen 2.746 N/A LEU 61.A N LEU 58.A O no hydrogen 3.183 N/A ASP 62.A N THR 59.A O no hydrogen 2.993 N/A LYS 63.A N HIS 60.A O no hydrogen 3.074 N/A ILE 65.A N MET 87.A O no hydrogen 2.723 N/A TYR 67.A OH ALA 79.A O no hydrogen 2.560 N/A THR 68.A N ASP 71.A OD2 no hydrogen 2.815 N/A ASP 71.A N THR 68.A O no hydrogen 2.969 N/A ILE 72.A N SER 69.A O no hydrogen 3.139 N/A ARG 73.A NE ASP 70.A O no hydrogen 2.997 N/A ARG 73.A NH1 GLU 139.A OE2 no hydrogen 3.221 N/A SER 76.A OG SER 74.A O no hydrogen 2.725 N/A SER 76.A OG THR 103.A OG1 no hydrogen 2.776 N/A VAL 78.A N ASP 101.A OD2 no hydrogen 2.926 N/A ALA 79.A N ASP 101.A OD2 no hydrogen 2.811 N/A GLN 80.A N SER 76.A O no hydrogen 3.175 N/A GLN 80.A NE2 PRO 77.A O no hydrogen 3.309 N/A GLN 81.A N VAL 78.A O no hydrogen 2.817 N/A GLN 81.A NE2 PRO 77.A O no hydrogen 2.613 N/A HIS 82.A N ALA 79.A O no hydrogen 3.267 N/A HIS 82.A ND1 VAL 78.A O no hydrogen 3.163 N/A THR 85.A N HIS 82.A O no hydrogen 3.005 N/A THR 85.A OG1 HIS 82.A O no hydrogen 3.143 N/A THR 85.A OG1 GLY 86.A O no hydrogen 3.022 N/A GLY 86.A N HIS 82.A O no hydrogen 2.883 N/A MET 87.A N ILE 65.A O no hydrogen 2.873 N/A THR 88.A N GLN 91.A OE1 no hydrogen 2.662 N/A THR 88.A OG1 LEU 61.A O no hydrogen 3.522 N/A ILE 89.A N LYS 63.A O no hydrogen 2.915 N/A GLY 90.A N LEU 61.A O no hydrogen 2.865 N/A GLN 91.A N THR 88.A OG1 no hydrogen 3.101 N/A LEU 92.A N THR 88.A O no hydrogen 2.889 N/A CYS 93.A N ILE 89.A O no hydrogen 2.888 N/A CYS 93.A SG ILE 89.A O no hydrogen 3.412 N/A ASP 94.A N GLY 90.A O no hydrogen 2.950 N/A ALA 95.A N GLN 91.A O no hydrogen 2.914 N/A ALA 96.A N LEU 92.A O no hydrogen 2.874 N/A ILE 97.A N CYS 93.A O no hydrogen 3.096 N/A ARG 98.A N ASP 94.A O no hydrogen 2.827 N/A ARG 98.A NE ARG 183.A O no hydrogen 2.924 N/A ARG 98.A NH1 ASP 94.A OD1 no hydrogen 2.804 N/A TYR 99.A N ALA 95.A O no hydrogen 3.057 N/A ASP 101.A N ALA 95.A O no hydrogen 3.071 N/A GLY 102.A N ILE 75.A O no hydrogen 2.830 N/A THR 103.A N SER 76.A OG no hydrogen 3.056 N/A THR 103.A OG1 ASP 71.A O no hydrogen 3.109 N/A THR 103.A OG1 SER 76.A OG no hydrogen 2.776 N/A ALA 104.A N ASP 101.A OD1 no hydrogen 2.854 N/A ALA 105.A N ASP 101.A O no hydrogen 3.247 N/A ASN 106.A N GLY 102.A O no hydrogen 3.025 N/A ASN 106.A ND2 ALA 140.A O no hydrogen 2.899 N/A LEU 107.A N THR 103.A O no hydrogen 2.907 N/A LEU 108.A N ALA 104.A O no hydrogen 2.910 N/A LEU 109.A N ALA 105.A O no hydrogen 2.888 N/A ALA 110.A N ASN 106.A O no hydrogen 2.891 N/A ASP 111.A N LEU 107.A O no hydrogen 2.859 N/A LEU 112.A N LEU 108.A O no hydrogen 2.930 N/A GLY 113.A N LEU 109.A O no hydrogen 2.975 N/A GLY 118.A N PRO 115.A O no hydrogen 3.258 N/A THR 119.A N GLY 116.A O no hydrogen 3.149 N/A THR 119.A OG1 GLY 116.A O no hydrogen 2.878 N/A PHE 122.A N GLY 118.A O no hydrogen 2.845 N/A THR 123.A N THR 119.A O no hydrogen 2.987 N/A THR 123.A OG1 THR 119.A O no hydrogen 2.821 N/A THR 123.A OG1 LEU 136.A O no hydrogen 3.233 N/A GLY 124.A N ALA 120.A O no hydrogen 2.843 N/A TYR 125.A N ALA 121.A O no hydrogen 2.946 N/A LEU 126.A N PHE 122.A O no hydrogen 3.259 N/A ARG 127.A N THR 123.A O no hydrogen 2.948 N/A ARG 127.A NH1 ASP 131.A O no hydrogen 2.770 N/A ARG 127.A NH1 SER 134.A O no hydrogen 2.847 N/A ARG 127.A NH2 SER 134.A O no hydrogen 3.018 N/A SER 128.A N GLY 124.A O no hydrogen 3.013 N/A SER 128.A OG TYR 125.A O no hydrogen 2.613 N/A LEU 129.A N LEU 126.A O no hydrogen 2.867 N/A GLY 130.A N ARG 127.A O no hydrogen 2.886 N/A ASP 131.A N LEU 126.A O no hydrogen 3.135 N/A VAL 133.A N ASP 131.A OD1 no hydrogen 2.890 N/A SER 134.A N ASP 131.A OD1 no hydrogen 2.903 N/A SER 134.A OG ASP 131.A OD1 no hydrogen 3.286 N/A SER 134.A OG ASP 131.A OD2 no hydrogen 2.515 N/A SER 134.A OG THR 151.A OG1 no hydrogen 2.625 N/A ARG 135.A N THR 150.A O no hydrogen 2.998 N/A ARG 135.A NE ASP 137.A OD1 no hydrogen 2.866 N/A ARG 135.A NE ASP 137.A OD2 no hydrogen 3.195 N/A ARG 135.A NH1 ASP 137.A OD2 no hydrogen 2.776 N/A LEU 136.A N THR 123.A OG1 no hydrogen 3.234 N/A ASP 137.A N ASP 149.A OD1 no hydrogen 2.648 N/A ALA 138.A N ASP 149.A OD1 no hydrogen 2.969 N/A ALA 140.A N ASN 106.A OD1 no hydrogen 3.257 N/A ASP 146.A N PRO 143.A O no hydrogen 3.127 N/A ARG 148.A N ASP 146.A OD1 no hydrogen 2.918 N/A ARG 148.A NE ASP 146.A OD1 no hydrogen 3.154 N/A ARG 148.A NE ASP 146.A OD2 no hydrogen 3.511 N/A ARG 148.A NH2 ASP 146.A OD2 no hydrogen 3.216 N/A ASP 149.A N ASP 137.A OD1 no hydrogen 2.872 N/A THR 150.A OG1 GLU 147.A O no hydrogen 2.619 N/A THR 151.A N PHE 38.A O no hydrogen 3.005 N/A THR 151.A OG1 SER 134.A OG no hydrogen 2.625 N/A THR 151.A OG1 THR 152.A O no hydrogen 3.440 N/A HIS 154.A N ALA 34.A O no hydrogen 2.899 N/A HIS 154.A ND1 ASP 35.A OD1 no hydrogen 2.766 N/A ALA 155.A N THR 152.A OG1 no hydrogen 2.999 N/A ILE 156.A N THR 152.A O no hydrogen 3.055 N/A ALA 157.A N PRO 153.A O no hydrogen 3.085 N/A LEU 158.A N HIS 154.A O no hydrogen 3.209 N/A VAL 159.A N ALA 155.A O no hydrogen 3.065 N/A LEU 160.A N ILE 156.A O no hydrogen 2.928 N/A GLN 161.A N ALA 157.A O no hydrogen 2.868 N/A GLN 162.A N LEU 158.A O no hydrogen 3.159 N/A LEU 163.A N VAL 159.A O no hydrogen 3.050 N/A VAL 164.A N LEU 160.A O no hydrogen 2.930 N/A LEU 165.A N GLN 161.A O no hydrogen 2.772 N/A GLY 166.A N GLN 161.A O no hydrogen 2.890 N/A ALA 168.A N GLN 162.A O no hydrogen 3.415 N/A LYS 173.A N ASP 172.A OD1 no hydrogen 2.897 N/A LYS 173.A NZ LEU 53.A O no hydrogen 2.951 N/A LYS 173.A NZ ASN 56.A O no hydrogen 2.818 N/A ARG 174.A N PRO 170.A O no hydrogen 2.840 N/A ARG 174.A NE LEU 169.A O no hydrogen 3.380 N/A ARG 174.A NH2 LEU 169.A O no hydrogen 2.964 N/A ALA 175.A N PRO 171.A O no hydrogen 2.882 N/A LEU 176.A N ASP 172.A O no hydrogen 3.407 N/A LEU 177.A N LYS 173.A O no hydrogen 3.185 N/A THR 178.A N ARG 174.A O no hydrogen 2.947 N/A THR 178.A OG1 ARG 174.A O no hydrogen 2.909 N/A ASP 179.A N ALA 175.A O no hydrogen 2.883 N/A TRP 180.A N LEU 176.A O no hydrogen 3.146 N/A MET 181.A N LEU 177.A O no hydrogen 3.115 N/A ALA 182.A N THR 178.A O no hydrogen 2.858 N/A ARG 183.A N ASP 179.A O no hydrogen 3.020 N/A ARG 183.A N TRP 180.A O no hydrogen 3.253 N/A ARG 183.A NH1 ASP 94.A OD2 no hydrogen 3.365 N/A ASN 184.A N MET 181.A O no hydrogen 3.345 N/A ASN 184.A ND2 THR 186.A OG1 no hydrogen 3.161 N/A ASN 184.A ND2 ASP 203.A OD1 no hydrogen 2.983 N/A THR 185.A N ARG 98.A O no hydrogen 3.070 N/A THR 185.A OG1 ARG 98.A O no hydrogen 2.771 N/A THR 186.A N ASN 184.A OD1 no hydrogen 3.059 N/A THR 186.A OG1 ASN 184.A OD1 no hydrogen 2.960 N/A THR 186.A OG1 THR 205.A OG1 no hydrogen 2.552 N/A ARG 190.A N GLY 187.A O no hydrogen 3.203 N/A ARG 190.A NE GLU 246.A OE2 no hydrogen 2.752 N/A ARG 190.A NH1 THR 207.A OG1 no hydrogen 2.709 N/A ARG 190.A NH1 GLU 246.A OE2 no hydrogen 3.441 N/A ARG 190.A NH2 GLY 206.A O no hydrogen 2.857 N/A ARG 190.A NH2 THR 207.A OG1 no hydrogen 3.192 N/A ARG 190.A NH2 ASN 214.A O no hydrogen 2.864 N/A ILE 191.A N ASP 215.A OD2 no hydrogen 3.083 N/A ARG 192.A NE ARG 192.A O no hydrogen 2.773 N/A ARG 192.A NH1 TRP 199.A O no hydrogen 2.778 N/A ARG 192.A NH2 PHE 195.A O no hydrogen 2.914 N/A ARG 192.A NH2 TRP 199.A O no hydrogen 3.138 N/A ALA 193.A N ARG 190.A O no hydrogen 3.019 N/A GLY 194.A N ILE 191.A O no hydrogen 3.049 N/A TRP 199.A N PRO 196.A O no hydrogen 2.988 N/A LYS 200.A N TRP 220.A O no hydrogen 2.987 N/A ILE 202.A N VAL 218.A O no hydrogen 3.009 N/A ASP 203.A N MET 181.A O no hydrogen 3.308 N/A LYS 204.A N ILE 216.A O no hydrogen 2.902 N/A LYS 204.A NZ SER 100.A OG no hydrogen 2.882 N/A LYS 204.A NZ THR 205.A O no hydrogen 2.811 N/A THR 205.A OG1 THR 186.A OG1 no hydrogen 2.552 N/A GLY 206.A N ASN 214.A O no hydrogen 3.119 N/A GLY 208.A N ARG 212.A O no hydrogen 2.920 N/A TYR 210.A N TYR 240.A O no hydrogen 2.894 N/A ARG 212.A N ASP 209.A O no hydrogen 3.187 N/A ARG 212.A NH1 ASP 142.A O no hydrogen 2.639 N/A ARG 212.A NH2 ASP 142.A O no hydrogen 2.671 N/A ALA 213.A N SER 233.A O no hydrogen 3.110 N/A ASN 214.A N GLY 206.A O no hydrogen 2.674 N/A ASN 214.A ND2 ALA 39.A O no hydrogen 2.844 N/A ASN 214.A ND2 PHE 40.A O no hydrogen 2.959 N/A ASP 215.A N VAL 231.A O no hydrogen 2.899 N/A ILE 216.A N LYS 204.A O no hydrogen 3.017 N/A ALA 217.A N VAL 229.A O no hydrogen 2.771 N/A VAL 218.A N ILE 202.A O no hydrogen 3.042 N/A VAL 219.A N TYR 227.A O no hydrogen 2.851 N/A TRP 220.A N LYS 200.A O no hydrogen 2.823 N/A SER 221.A N VAL 225.A O no hydrogen 2.994 N/A SER 221.A OG THR 223.A OG1 no hydrogen 3.192 N/A THR 223.A N SER 221.A OG no hydrogen 3.198 N/A THR 223.A OG1 SER 221.A OG no hydrogen 3.192 N/A GLY 224.A N SER 221.A O no hydrogen 2.879 N/A VAL 225.A N SER 221.A OG no hydrogen 3.035 N/A TYR 227.A N VAL 219.A O no hydrogen 2.894 N/A VAL 229.A N ALA 217.A O no hydrogen 2.839 N/A ALA 230.A N TYR 20.A O no hydrogen 2.926 N/A VAL 231.A N ASP 215.A O no hydrogen 2.951 N/A MET 232.A N GLY 18.A O no hydrogen 2.811 N/A SER 233.A N ASN 214.A OD1 no hydrogen 3.346 N/A SER 233.A OG ALA 213.A O no hydrogen 2.892 N/A ASP 234.A N ARG 16.A O no hydrogen 3.120 N/A ARG 235.A N TYR 210.A O no hydrogen 2.834 N/A ARG 235.A NE TYR 13.A O no hydrogen 2.664 N/A ARG 235.A NH1 TYR 13.A O no hydrogen 3.090 N/A ARG 235.A NH2 GLU 243.A O no hydrogen 2.818 N/A GLY 238.A N ARG 235.A O no hydrogen 2.950 N/A GLY 239.A N ALA 236.A O no hydrogen 3.007 N/A ASP 241.A N ASP 241.A OD1 no hydrogen 2.654 N/A ALA 242.A N GLY 239.A O no hydrogen 3.134 N/A LEU 248.A N ARG 245.A O no hydrogen 3.103 N/A ALA 250.A N GLU 246.A O no hydrogen 2.970 N/A GLU 251.A N ALA 247.A O no hydrogen 2.873 N/A ALA 252.A N LEU 248.A O no hydrogen 2.958 N/A ALA 253.A N LEU 249.A O no hydrogen 2.886 N/A THR 254.A N ALA 250.A O no hydrogen 2.932 N/A THR 254.A OG1 ALA 250.A O no hydrogen 2.838 N/A CYS 255.A N GLU 251.A O no hydrogen 3.005 N/A CYS 255.A SG GLU 251.A O no hydrogen 3.478 N/A VAL 256.A N ALA 252.A O no hydrogen 3.032 N/A ALA 257.A N ALA 253.A O no hydrogen 2.788 N/A GLY 258.A N THR 254.A O no hydrogen 3.012 N/A VAL 259.A N VAL 256.A O no hydrogen 3.001 N/A LEU 260.A N VAL 256.A O no hydrogen 3.051 N/A ALA 261.A N ALA 257.A O no hydrogen 2.932 N/A