Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2buq_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 4.A N ARG 229.A O no hydrogen 2.802 N/A TYR 6.A N GLU 39.A OE2 no hydrogen 2.830 N/A ALA 7.A N GLY 227.A O no hydrogen 2.955 N/A ASN 10.A ND2 GLU 12.A OE2 no hydrogen 2.980 N/A ASP 13.A N ASN 10.A O no hydrogen 2.901 N/A HIS 14.A N THR 11.A O no hydrogen 3.323 N/A ALA 19.A N SER 25.A OG no hydrogen 2.985 N/A TYR 22.A N ALA 19.A O no hydrogen 2.825 N/A LYS 23.A N ASN 149.A OD1 no hydrogen 2.933 N/A LYS 23.A NZ ASN 149.A O no hydrogen 3.050 N/A SER 25.A N TYR 22.A O no hydrogen 2.956 N/A SER 25.A OG ALA 19.A O no hydrogen 2.875 N/A SER 25.A OG TYR 22.A O no hydrogen 2.977 N/A VAL 26.A N LYS 23.A O no hydrogen 3.063 N/A ARG 28.A N SER 25.A O no hydrogen 3.216 N/A SER 29.A OG SER 25.A O no hydrogen 2.942 N/A THR 40.A N GLU 43.A OE1 no hydrogen 2.831 N/A THR 40.A OG1 GLU 43.A OE1 no hydrogen 2.604 N/A SER 42.A N THR 40.A OG1 no hydrogen 3.135 N/A GLU 43.A N THR 40.A O no hydrogen 3.044 N/A VAL 44.A N THR 40.A O no hydrogen 3.235 N/A THR 45.A OG1 LEU 41.A O no hydrogen 2.775 N/A THR 45.A OG1 SER 42.A O no hydrogen 3.528 N/A LYS 53.A N SER 50.A O no hydrogen 3.154 N/A PHE 54.A N ALA 51.A O no hydrogen 3.068 N/A GLY 55.A N ASP 58.A OD1 no hydrogen 2.819 N/A ASP 58.A N GLY 55.A O no hydrogen 3.257 N/A ASN 59.A ND2 VAL 136.A O no hydrogen 3.021 N/A ASP 60.A N LYS 57.A O no hydrogen 2.923 N/A LEU 61.A N ARG 138.A O no hydrogen 2.830 N/A ILE 62.A N ASP 60.A OD2 no hydrogen 3.157 N/A LEU 63.A N ASP 60.A O no hydrogen 3.222 N/A LEU 63.A N ASP 60.A OD2 no hydrogen 3.291 N/A ASN 64.A N ASP 60.A O no hydrogen 2.806 N/A ASN 64.A ND2 LYS 57.A O no hydrogen 3.420 N/A ASN 64.A ND2 CYS 124.A O no hydrogen 2.990 N/A ALA 66.A N LEU 63.A O no hydrogen 3.163 N/A ILE 72.A N ASP 118.A OD2 no hydrogen 2.750 N/A ARG 75.A NE ASP 215.A O no hydrogen 3.288 N/A ARG 75.A NE ASP 215.A OD2 no hydrogen 3.033 N/A ARG 75.A NH2 ASP 215.A OD2 no hydrogen 2.901 N/A VAL 76.A N THR 139.A O no hydrogen 2.980 N/A ILE 77.A N ARG 217.A O no hydrogen 2.790 N/A VAL 78.A N PHE 137.A O no hydrogen 2.895 N/A HIS 79.A N TYR 219.A O no hydrogen 2.996 N/A HIS 79.A ND1 TYR 134.A OH no hydrogen 2.711 N/A HIS 79.A NE2 ASP 207.A OD2 no hydrogen 2.670 N/A GLY 80.A N TYR 135.A O no hydrogen 3.168 N/A TYR 81.A N ASP 222.A OD2 no hydrogen 2.876 N/A VAL 82.A N GLY 133.A O no hydrogen 2.764 N/A ARG 83.A N ILE 223.A O no hydrogen 2.952 N/A ARG 83.A NH2 ASP 222.A OD1 no hydrogen 2.520 N/A ASP 84.A N ARG 88.A O no hydrogen 2.831 N/A PHE 86.A N ASP 84.A OD2 no hydrogen 2.891 N/A GLY 87.A N ASP 84.A O no hydrogen 2.783 N/A ARG 88.A N ASP 84.A OD2 no hydrogen 3.032 N/A ARG 88.A NH1 ARG 228.A O no hydrogen 3.113 N/A ARG 88.A NH2 ASP 84.A OD1 no hydrogen 3.160 N/A ARG 88.A NH2 ARG 228.A O no hydrogen 2.916 N/A VAL 90.A N VAL 82.A O no hydrogen 3.033 N/A ASN 92.A N THR 129.A O no hydrogen 3.046 N/A ALA 93.A N THR 129.A OG1 no hydrogen 2.923 N/A LEU 94.A N ILE 164.A O no hydrogen 2.778 N/A VAL 95.A N MET 127.A O no hydrogen 2.853 N/A GLU 96.A N SER 162.A O no hydrogen 3.011 N/A VAL 97.A N GLY 125.A O no hydrogen 2.934 N/A TRP 98.A N HIS 160.A O no hydrogen 3.084 N/A GLN 99.A N GLY 123.A O no hydrogen 2.953 N/A GLN 99.A NE2 ALA 100.A O no hydrogen 3.055 N/A GLN 99.A NE2 ILE 140.A O no hydrogen 2.791 N/A ASN 101.A N ARG 105.A O no hydrogen 2.738 N/A SER 103.A OG ALA 116.A O no hydrogen 2.824 N/A GLY 104.A N ASN 101.A O no hydrogen 2.988 N/A ARG 105.A NE ASP 111.A O no hydrogen 3.312 N/A ARG 105.A NH1 GLY 115.A O no hydrogen 3.049 N/A ARG 105.A NH2 ASP 111.A O no hydrogen 3.409 N/A TYR 106.A N ASP 111.A OD1 no hydrogen 2.752 N/A TYR 106.A OH HIS 160.A NE2 no hydrogen 3.173 N/A ARG 107.A NE PHE 121.A O no hydrogen 2.899 N/A ARG 107.A NH2 ASP 118.A O no hydrogen 2.984 N/A ARG 107.A NH2 PHE 121.A O no hydrogen 3.258 N/A ASN 110.A N HIS 108.A ND1 no hydrogen 3.018 N/A ASP 111.A N HIS 108.A O no hydrogen 3.107 N/A GLN 112.A NE2 ASP 111.A O no hydrogen 2.808 N/A TYR 113.A N ASP 111.A OD2 no hydrogen 3.031 N/A ASN 120.A N ASP 118.A OD1 no hydrogen 2.879 N/A PHE 121.A N ASP 118.A O no hydrogen 3.122 N/A GLY 125.A N VAL 97.A O no hydrogen 3.190 N/A ARG 126.A N ASP 58.A O no hydrogen 2.951 N/A ARG 126.A NE ASP 58.A OD1 no hydrogen 2.836 N/A ARG 126.A NH1 ASP 58.A OD1 no hydrogen 3.048 N/A MET 127.A N VAL 95.A O no hydrogen 2.901 N/A THR 129.A N ALA 93.A O no hydrogen 3.020 N/A THR 129.A OG1 VAL 90.A O no hydrogen 2.791 N/A ASP 130.A N TYR 134.A O no hydrogen 3.033 N/A ASN 132.A N ASP 130.A OD1 no hydrogen 2.649 N/A GLY 133.A N ASP 130.A O no hydrogen 2.955 N/A TYR 134.A N ASP 130.A OD1 no hydrogen 2.868 N/A TYR 134.A OH HIS 79.A ND1 no hydrogen 2.711 N/A TYR 135.A N GLY 80.A O no hydrogen 2.916 N/A TYR 135.A OH PHE 221.A O no hydrogen 2.640 N/A PHE 137.A N VAL 78.A O no hydrogen 3.010 N/A ARG 138.A N ASN 59.A O no hydrogen 3.060 N/A ARG 138.A NE ASP 60.A OD2 no hydrogen 3.018 N/A ARG 138.A NH2 ASP 60.A OD1 no hydrogen 2.850 N/A THR 139.A N VAL 76.A O no hydrogen 2.888 N/A THR 139.A OG1 GLN 99.A OE1 no hydrogen 2.669 N/A THR 139.A OG1 ILE 140.A O no hydrogen 3.449 N/A LYS 141.A N GLU 74.A O no hydrogen 2.833 N/A LYS 141.A NZ TYR 219.A OH no hydrogen 3.201 N/A GLY 143.A N ASN 101.A O no hydrogen 3.021 N/A TYR 145.A N ARG 155.A O no hydrogen 3.267 N/A TYR 145.A OH ASP 111.A OD2 no hydrogen 2.957 N/A TRP 147.A N GLU 153.A O no hydrogen 2.923 N/A ASN 149.A N ARG 150.A O no hydrogen 2.970 N/A ASN 149.A ND2 GLY 21.A O no hydrogen 2.888 N/A ASN 149.A ND2 GLU 153.A OE1 no hydrogen 3.039 N/A ARG 150.A N GLU 153.A OE1 no hydrogen 3.141 N/A ARG 150.A NE GLU 153.A OE1 no hydrogen 2.934 N/A ARG 150.A NH2 GLU 153.A OE1 no hydrogen 3.564 N/A ARG 150.A NH2 GLU 153.A OE2 no hydrogen 2.855 N/A TRP 154.A NE1 ASN 152.A OD1 no hydrogen 2.889 N/A ARG 155.A N TYR 145.A O no hydrogen 2.715 N/A ARG 155.A NH1 GLN 175.A OE1 no hydrogen 2.829 N/A ARG 155.A NH2 GLN 175.A OE1 no hydrogen 3.117 N/A ALA 157.A N ASP 181.A OD1 no hydrogen 2.907 N/A HIS 158.A ND1 PRO 156.A O no hydrogen 2.915 N/A HIS 158.A NE2 HIS 160.A NE2 no hydrogen 3.069 N/A ILE 159.A N PHE 176.A O no hydrogen 3.071 N/A HIS 160.A N TRP 98.A O no hydrogen 2.920 N/A HIS 160.A NE2 TYR 106.A OH no hydrogen 3.173 N/A PHE 161.A N SER 174.A O no hydrogen 2.974 N/A SER 162.A N GLU 96.A O no hydrogen 2.909 N/A LEU 163.A N LEU 172.A O no hydrogen 2.928 N/A ILE 164.A N LEU 94.A O no hydrogen 3.021 N/A TRP 168.A N THR 45.A O no hydrogen 2.726 N/A ALA 169.A N GLU 43.A O no hydrogen 2.998 N/A GLN 170.A N GLY 167.A O no hydrogen 2.885 N/A ARG 171.A N TRP 168.A O no hydrogen 3.003 N/A ARG 171.A NH1 SER 162.A OG no hydrogen 2.934 N/A ARG 171.A NH2 SER 162.A OG no hydrogen 2.905 N/A LEU 172.A N LEU 163.A O no hydrogen 3.444 N/A SER 174.A N PHE 161.A O no hydrogen 2.900 N/A GLN 175.A N SER 174.A OG no hydrogen 2.824 N/A PHE 176.A N ILE 159.A O no hydrogen 2.955 N/A TYR 177.A N LEU 202.A O no hydrogen 2.772 N/A GLU 179.A N ALA 204.A O no hydrogen 2.903 N/A ASP 181.A N PHE 178.A O no hydrogen 3.092 N/A LEU 183.A N ASP 181.A OD2 no hydrogen 2.942 N/A ILE 184.A N ASP 181.A O no hydrogen 3.281 N/A SER 186.A N LEU 183.A O no hydrogen 3.134 N/A CYS 187.A N LEU 183.A O no hydrogen 3.245 N/A LYS 191.A N CYS 187.A O no hydrogen 2.939 N/A LYS 191.A NZ ASP 185.A O no hydrogen 2.962 N/A THR 192.A N ILE 189.A O no hydrogen 3.189 N/A THR 192.A OG1 ILE 189.A O no hydrogen 2.667 N/A ILE 193.A N LEU 190.A O no hydrogen 3.132 N/A GLN 198.A N SER 195.A OG no hydrogen 3.100 N/A GLN 198.A NE2 ASP 13.A O no hydrogen 2.941 N/A ARG 199.A N SER 195.A O no hydrogen 3.046 N/A ARG 199.A NE ILE 193.A O no hydrogen 2.861 N/A ARG 199.A NH2 ILE 193.A O no hydrogen 2.948 N/A ARG 200.A N GLU 196.A O no hydrogen 3.047 N/A ALA 201.A N GLN 197.A O no hydrogen 3.129 N/A ALA 201.A N GLN 198.A O no hydrogen 3.128 N/A LEU 202.A N ARG 199.A O no hydrogen 3.181 N/A ILE 203.A N ARG 200.A O no hydrogen 3.134 N/A ALA 204.A N TYR 177.A O no hydrogen 2.690 N/A LEU 205.A N ARG 220.A O no hydrogen 2.970 N/A GLU 206.A N GLU 179.A OE1 no hydrogen 2.840 N/A ASP 207.A N CYS 218.A O no hydrogen 2.822 N/A ASN 210.A N ASP 207.A O no hydrogen 3.011 N/A ASN 210.A ND2 ASP 207.A OD1 no hydrogen 3.367 N/A ASN 210.A ND2 ASP 207.A OD2 no hydrogen 2.900 N/A PHE 211.A N LYS 208.A O no hydrogen 3.163 N/A ILE 212.A N SER 216.A O no hydrogen 2.744 N/A GLU 213.A N GLU 213.A OE1 no hydrogen 2.781 N/A ASP 215.A N ILE 212.A O no hydrogen 3.015 N/A SER 216.A N ILE 212.A O no hydrogen 3.006 N/A SER 216.A OG ASP 215.A OD2 no hydrogen 2.547 N/A ARG 217.A N ARG 75.A O no hydrogen 3.047 N/A ARG 217.A NH1 GLU 74.A OE1 no hydrogen 2.971 N/A ARG 217.A NH2 GLU 74.A OE1 no hydrogen 3.442 N/A CYS 218.A SG ILE 77.A O no hydrogen 3.847 N/A CYS 218.A SG TYR 219.A O no hydrogen 4.018 N/A TYR 219.A N ILE 77.A O no hydrogen 2.833 N/A ARG 220.A N LEU 205.A O no hydrogen 2.802 N/A ARG 220.A NE ASP 222.A OD2 no hydrogen 2.643 N/A ARG 220.A NH1 ASP 222.A OD1 no hydrogen 2.794 N/A ARG 220.A NH1 ASP 222.A OD2 no hydrogen 3.440 N/A PHE 221.A N HIS 79.A O no hydrogen 2.877 N/A ILE 223.A N TYR 81.A O no hydrogen 2.943 N/A LEU 225.A N ARG 83.A O no hydrogen 2.849 N/A ARG 226.A NE ALA 7.A O no hydrogen 3.099 N/A ARG 226.A NH2 ALA 7.A O no hydrogen 2.969 N/A GLY 227.A N GLN 85.A OE1 no hydrogen 2.951 N/A ARG 228.A NE GLY 4.A O no hydrogen 2.943 N/A ARG 228.A NH2 GLY 4.A O no hydrogen 3.028 N/A ARG 229.A N ALA 5.A O no hydrogen 3.004 N/A THR 231.A N ILE 2.A O no hydrogen 2.700 N/A