Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3bhu_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 6.A N MET 3.A O no hydrogen 3.487 N/A GLN 7.A N ARG 24.A O no hydrogen 2.860 N/A GLN 7.A NE2 LYS 8.A O no hydrogen 3.037 N/A VAL 9.A N LYS 22.A O no hydrogen 2.644 N/A GLU 10.A N LYS 22.A O no hydrogen 3.309 N/A LYS 11.A NZ GLU 14.A OE1 no hydrogen 3.496 N/A ILE 12.A N VAL 20.A O no hydrogen 3.050 N/A THR 16.A OG1 TYR 17.A O no hydrogen 2.697 N/A VAL 19.A N LYS 36.A O no hydrogen 2.996 N/A VAL 20.A N GLY 13.A O no hydrogen 2.942 N/A TYR 21.A N LEU 34.A O no hydrogen 2.865 N/A LYS 22.A N GLU 10.A O no hydrogen 2.760 N/A ALA 23.A N VAL 32.A O no hydrogen 2.979 N/A ARG 24.A N GLN 7.A O no hydrogen 2.959 N/A ASN 25.A N GLU 30.A O no hydrogen 2.723 N/A LYS 26.A N ASN 5.A O no hydrogen 2.705 N/A LYS 26.A NZ GLU 4.A O no hydrogen 3.483 N/A LEU 27.A N ASN 25.A OD1 no hydrogen 2.959 N/A THR 28.A N ASN 25.A OD1 no hydrogen 3.090 N/A GLY 29.A N ASN 25.A O no hydrogen 2.985 N/A GLU 30.A N THR 28.A OG1 no hydrogen 3.285 N/A VAL 32.A N ALA 23.A O no hydrogen 2.777 N/A ALA 33.A N PHE 80.A O no hydrogen 2.910 N/A LEU 34.A N TYR 21.A O no hydrogen 2.768 N/A LYS 35.A N LEU 78.A O no hydrogen 2.791 N/A LYS 35.A NZ GLU 51.A OE1 no hydrogen 2.647 N/A LYS 35.A NZ GLU 51.A OE2 no hydrogen 3.361 N/A LYS 35.A NZ ASP 145.A OD1 no hydrogen 3.343 N/A LYS 36.A N VAL 19.A O no hydrogen 2.774 N/A ILE 37.A N LEU 76.A O no hydrogen 2.716 N/A LEU 39.A N ASN 74.A O no hydrogen 3.350 N/A GLY 43.A N ASP 40.A OD1 no hydrogen 3.222 N/A ILE 49.A N PRO 45.A O no hydrogen 2.969 N/A ARG 50.A N SER 46.A O no hydrogen 2.899 N/A GLU 51.A N THR 47.A O no hydrogen 2.977 N/A ILE 52.A N ALA 48.A O no hydrogen 2.924 N/A SER 53.A N ILE 49.A O no hydrogen 3.156 N/A SER 53.A OG ILE 49.A O no hydrogen 2.937 N/A SER 53.A OG ARG 50.A O no hydrogen 3.384 N/A LEU 54.A N ARG 50.A O no hydrogen 3.089 N/A LEU 55.A N GLU 51.A O no hydrogen 2.989 N/A LYS 56.A N ILE 52.A O no hydrogen 3.003 N/A GLU 57.A N LEU 54.A O no hydrogen 3.273 N/A LEU 58.A N LEU 54.A O no hydrogen 3.195 N/A ASN 62.A ND2 GLN 110.A OE1 no hydrogen 2.929 N/A ASN 62.A ND2 ILE 141.A O no hydrogen 3.072 N/A ILE 63.A N HIS 60.A O no hydrogen 3.204 N/A VAL 64.A N LEU 143.A O no hydrogen 2.931 N/A LYS 65.A N GLU 81.A OE2 no hydrogen 2.913 N/A LEU 67.A N VAL 79.A O no hydrogen 2.626 N/A ASP 68.A N VAL 79.A O no hydrogen 3.367 N/A VAL 69.A N ASP 68.A OD1 no hydrogen 2.988 N/A ILE 70.A N TYR 77.A O no hydrogen 2.842 N/A THR 72.A N LYS 75.A O no hydrogen 2.923 N/A THR 72.A OG1 LYS 75.A O no hydrogen 3.545 N/A LEU 76.A N ILE 37.A O no hydrogen 3.177 N/A TYR 77.A N ILE 70.A O no hydrogen 2.792 N/A LEU 78.A N LYS 35.A O no hydrogen 2.826 N/A VAL 79.A N ASP 68.A O no hydrogen 2.923 N/A PHE 80.A N ALA 33.A O no hydrogen 2.815 N/A GLU 81.A N LYS 65.A O no hydrogen 3.096 N/A GLN 85.A N ILE 135.A O no hydrogen 3.302 N/A LEU 87.A N LEU 133.A O no hydrogen 2.792 N/A LYS 88.A NZ ASP 92.A OD1 no hydrogen 2.793 N/A LYS 89.A N ASP 86.A OD1 no hydrogen 3.051 N/A PHE 90.A N ASP 86.A O no hydrogen 3.125 N/A MET 91.A N LEU 87.A O no hydrogen 2.864 N/A ASP 92.A N LYS 88.A O no hydrogen 3.005 N/A ALA 93.A N LYS 89.A O no hydrogen 2.958 N/A SER 94.A N MET 91.A O no hydrogen 3.237 N/A SER 94.A OG PHE 90.A O no hydrogen 2.931 N/A GLY 98.A N SER 94.A O no hydrogen 2.653 N/A LEU 103.A N PRO 100.A O no hydrogen 3.040 N/A ILE 104.A N PRO 100.A O no hydrogen 3.133 N/A LYS 105.A N LEU 101.A O no hydrogen 2.858 N/A LYS 105.A NZ ASP 287.A OD1 no hydrogen 3.101 N/A SER 106.A N PRO 102.A O no hydrogen 3.009 N/A SER 106.A OG THR 289.A O no hydrogen 3.061 N/A TYR 107.A N LEU 103.A O no hydrogen 2.842 N/A LEU 108.A N ILE 104.A O no hydrogen 2.960 N/A PHE 109.A N LYS 105.A O no hydrogen 3.053 N/A GLN 110.A N SER 106.A O no hydrogen 3.073 N/A GLN 110.A NE2 SER 106.A O no hydrogen 3.369 N/A GLN 110.A NE2 SER 106.A OG no hydrogen 3.261 N/A GLN 110.A NE2 GLY 139.A O no hydrogen 2.910 N/A LEU 111.A N TYR 107.A O no hydrogen 2.943 N/A LEU 112.A N LEU 108.A O no hydrogen 2.934 N/A GLN 113.A N PHE 109.A O no hydrogen 3.049 N/A GLN 113.A NE2 PHE 109.A O no hydrogen 3.679 N/A GLY 114.A N GLN 110.A O no hydrogen 2.937 N/A LEU 115.A N LEU 111.A O no hydrogen 2.839 N/A ALA 116.A N LEU 112.A O no hydrogen 2.881 N/A PHE 117.A N GLN 113.A O no hydrogen 3.114 N/A CYS 118.A N GLY 114.A O no hydrogen 3.099 N/A CYS 118.A SG GLY 114.A O no hydrogen 3.414 N/A HIS 119.A N LEU 115.A O no hydrogen 2.924 N/A HIS 119.A ND1 VAL 123.A O no hydrogen 3.193 N/A SER 120.A N ALA 116.A O no hydrogen 2.857 N/A SER 120.A OG ALA 116.A O no hydrogen 2.861 N/A HIS 121.A N CYS 118.A O no hydrogen 3.033 N/A HIS 121.A ND1 PHE 117.A O no hydrogen 2.566 N/A ARG 122.A N HIS 119.A O no hydrogen 3.199 N/A ARG 122.A NH1 GLU 57.A OE1 no hydrogen 2.798 N/A ARG 122.A NH1 HIS 121.A O no hydrogen 2.876 N/A ARG 122.A NH2 GLU 57.A OE1 no hydrogen 3.212 N/A ARG 122.A NH2 GLU 57.A OE2 no hydrogen 3.271 N/A VAL 123.A N CYS 118.A O no hydrogen 2.890 N/A LEU 124.A N ARG 150.A O no hydrogen 2.917 N/A HIS 125.A N ASP 184.A OD2 no hydrogen 2.903 N/A HIS 125.A NE2 ALA 144.A O no hydrogen 2.943 N/A ARG 126.A N ASP 184.A OD1 no hydrogen 2.916 N/A ARG 126.A NE LEU 148.A O no hydrogen 2.913 N/A ARG 126.A NH1 TYR 179.A OH no hydrogen 2.716 N/A ARG 126.A NH2 LEU 148.A O no hydrogen 2.952 N/A ARG 126.A NH2 ALA 149.A O no hydrogen 3.540 N/A ASP 127.A N HIS 125.A ND1 no hydrogen 3.142 N/A GLN 131.A N GLN 131.A OE1 no hydrogen 2.831 N/A ASN 132.A N LYS 129.A O no hydrogen 2.965 N/A ASN 132.A ND2 ASP 127.A O no hydrogen 2.946 N/A LEU 133.A N PRO 130.A O no hydrogen 3.190 N/A LEU 134.A N LYS 142.A O no hydrogen 2.925 N/A ILE 135.A N GLN 85.A O no hydrogen 2.714 N/A ASN 136.A N ALA 140.A O no hydrogen 3.157 N/A GLU 138.A N ASN 136.A OD1 no hydrogen 2.933 N/A ALA 140.A N ASN 136.A OD1 no hydrogen 3.050 N/A ILE 141.A N GLN 110.A OE1 no hydrogen 3.211 N/A LYS 142.A N LEU 134.A O no hydrogen 2.790 N/A LYS 142.A NZ GLU 81.A OE1 no hydrogen 2.673 N/A LYS 142.A NZ GLU 81.A OE2 no hydrogen 3.032 N/A LEU 143.A N ASN 62.A O no hydrogen 2.975 N/A ALA 144.A N ASN 132.A O no hydrogen 2.903 N/A PHE 146.A N GLU 51.A OE2 no hydrogen 2.720 N/A GLY 147.A N ASP 145.A OD1 no hydrogen 3.287 N/A ALA 149.A N PHE 146.A O no hydrogen 3.135 N/A ARG 150.A N LEU 124.A O no hydrogen 2.960 N/A PHE 152.A N ARG 122.A O no hydrogen 2.802 N/A GLY 153.A N TYR 159.A OH no hydrogen 3.141 N/A ARG 157.A N TYR 159.A OH no hydrogen 3.406 N/A THR 158.A OG1 LYS 177.A O no hydrogen 2.976 N/A HIS 160.A NE2 ILE 172.A O no hydrogen 2.975 N/A THR 164.A N ASP 127.A OD1 no hydrogen 3.054 N/A THR 164.A OG1 ASP 127.A OD1 no hydrogen 2.659 N/A TRP 166.A NE1 GLY 204.A O no hydrogen 2.962 N/A TYR 167.A N THR 164.A O no hydrogen 2.895 N/A TYR 167.A OH GLU 194.A OE1 no hydrogen 2.750 N/A TYR 167.A OH GLU 194.A OE2 no hydrogen 3.345 N/A ARG 168.A N LEU 165.A O no hydrogen 3.141 N/A ARG 168.A NE VAL 163.A O no hydrogen 2.987 N/A ARG 168.A NH2 VAL 163.A O no hydrogen 2.913 N/A GLU 171.A N GLU 171.A OE1 no hydrogen 2.775 N/A ILE 172.A N ALA 169.A O no hydrogen 3.122 N/A LEU 173.A N ALA 169.A O no hydrogen 3.193 N/A LEU 174.A N PRO 170.A O no hydrogen 2.856 N/A GLY 175.A N ILE 172.A O no hydrogen 3.069 N/A CYS 176.A N GLU 171.A O no hydrogen 3.072 N/A CYS 176.A SG.B TYR 178.A O no hydrogen 3.179 N/A VAL 183.A N SER 180.A O no hydrogen 3.119 N/A ASP 184.A N THR 181.A O no hydrogen 3.149 N/A TRP 186.A N ALA 182.A O no hydrogen 2.991 N/A SER 187.A N VAL 183.A O no hydrogen 3.227 N/A SER 187.A OG TYR 167.A O no hydrogen 2.801 N/A SER 187.A OG VAL 183.A O no hydrogen 3.295 N/A LEU 188.A N ASP 184.A O no hydrogen 3.101 N/A GLY 189.A N ILE 185.A O no hydrogen 2.825 N/A CYS 190.A N TRP 186.A O no hydrogen 3.112 N/A CYS 190.A SG TRP 166.A O no hydrogen 3.871 N/A CYS 190.A SG TRP 186.A O no hydrogen 3.578 N/A ILE 191.A N SER 187.A O no hydrogen 3.093 N/A PHE 192.A N LEU 188.A O no hydrogen 2.885 N/A ALA 193.A N GLY 189.A O no hydrogen 3.165 N/A GLU 194.A N CYS 190.A O no hydrogen 2.957 N/A MET 195.A N ILE 191.A O no hydrogen 2.772 N/A VAL 196.A N PHE 192.A O no hydrogen 3.284 N/A THR 197.A N ALA 193.A O no hydrogen 2.922 N/A THR 197.A OG1 ALA 193.A O no hydrogen 3.155 N/A THR 197.A OG1 ARG 199.A O no hydrogen 2.973 N/A ARG 198.A N GLU 194.A O no hydrogen 2.565 N/A ARG 199.A N THR 197.A OG1 no hydrogen 3.260 N/A GLY 204.A N PHE 202.A O no hydrogen 3.004 N/A GLY 204.A N GLN 210.A OE1 no hydrogen 2.877 N/A ASP 205.A N ASP 209.A OD2 no hydrogen 2.888 N/A ASP 209.A N SER 206.A OG no hydrogen 3.385 N/A GLN 210.A N SER 206.A O no hydrogen 2.707 N/A GLN 210.A NE2 PHE 202.A O no hydrogen 2.905 N/A LEU 211.A N GLU 207.A O no hydrogen 2.995 N/A PHE 212.A N ILE 208.A O no hydrogen 2.879 N/A ARG 213.A N ASP 209.A O no hydrogen 2.947 N/A ARG 213.A NE ASP 209.A OD2 no hydrogen 3.412 N/A ILE 214.A N GLN 210.A O no hydrogen 3.179 N/A PHE 215.A N LEU 211.A O no hydrogen 2.872 N/A ARG 216.A N PHE 212.A O no hydrogen 2.959 N/A THR 217.A N ILE 214.A O no hydrogen 3.113 N/A THR 217.A OG1 ARG 213.A O no hydrogen 2.952 N/A LEU 218.A N ILE 214.A O no hydrogen 2.823 N/A THR 220.A N TRP 242.A O no hydrogen 2.858 N/A THR 220.A OG1 PRO 240.A O no hydrogen 2.798 N/A VAL 225.A N ASP 222.A OD1 no hydrogen 3.213 N/A TRP 226.A N ASP 222.A O no hydrogen 2.905 N/A GLY 228.A N GLU 223.A OE1 no hydrogen 2.782 N/A VAL 229.A N TRP 226.A O no hydrogen 3.116 N/A THR 230.A N GLU 223.A OE2 no hydrogen 3.038 N/A THR 230.A OG1 GLU 223.A OE2 no hydrogen 2.631 N/A SER 231.A N GLY 228.A O no hydrogen 3.090 N/A MET 232.A N VAL 229.A O no hydrogen 3.167 N/A ASP 234.A N LEU 174.A O no hydrogen 3.126 N/A TYR 235.A N MET 232.A O no hydrogen 3.123 N/A PHE 239.A N LYS 236.A O no hydrogen 3.054 N/A TRP 242.A N THR 220.A OG1 no hydrogen 2.801 N/A ARG 244.A NH1 LEU 218.A O no hydrogen 3.178 N/A SER 248.A N ASP 246.A OD1 no hydrogen 3.364 N/A SER 248.A OG ASP 246.A OD1 no hydrogen 2.865 N/A LYS 249.A N ASP 246.A O no hydrogen 2.966 N/A VAL 250.A N PHE 247.A O no hydrogen 3.381 N/A LEU 254.A N VAL 251.A O no hydrogen 3.057 N/A GLY 258.A N ASP 255.A OD1.A no hydrogen 2.793 N/A ARG 259.A N ASP 255.A O.A no hydrogen 2.896 N/A ARG 259.A N ASP 255.A O.B no hydrogen 2.920 N/A ARG 259.A NH1 LEU 254.A O no hydrogen 2.920 N/A SER 260.A N GLU 256.A O no hydrogen 3.065 N/A SER 260.A OG GLN 264.A OE1 no hydrogen 3.141 N/A SER 260.A OG HIS 282.A NE2 no hydrogen 2.811 N/A LEU 261.A N ASP 257.A O no hydrogen 3.090 N/A LEU 262.A N GLY 258.A O no hydrogen 2.961 N/A SER 263.A N ARG 259.A O no hydrogen 2.975 N/A SER 263.A OG ARG 259.A O no hydrogen 3.133 N/A SER 263.A OG SER 260.A O no hydrogen 2.572 N/A GLN 264.A N SER 260.A O no hydrogen 3.171 N/A GLN 264.A N LEU 261.A O no hydrogen 2.977 N/A MET 265.A N LEU 261.A O no hydrogen 2.960 N/A LEU 266.A N LEU 262.A O no hydrogen 2.965 N/A TYR 268.A OH GLY 219.A O no hydrogen 2.639 N/A ASN 271.A N ASP 269.A OD1 no hydrogen 3.277 N/A LYS 272.A N ASP 269.A O no hydrogen 2.967 N/A LYS 272.A NZ ASP 269.A OD2 no hydrogen 3.566 N/A ARG 273.A N ASP 269.A O no hydrogen 2.972 N/A ARG 273.A NE HIS 267.A O no hydrogen 2.766 N/A ARG 273.A NH1 GLU 171.A OE1 no hydrogen 3.493 N/A ARG 273.A NH1 GLU 171.A OE2 no hydrogen 2.943 N/A ARG 273.A NH1 ALA 182.A O no hydrogen 2.770 N/A ARG 273.A NH2 GLU 171.A OE1 no hydrogen 2.951 N/A ARG 273.A NH2 HIS 267.A O no hydrogen 3.124 N/A ARG 273.A NH2 TYR 268.A O no hydrogen 2.933 N/A ILE 274.A N GLN 264.A O no hydrogen 2.939 N/A ALA 278.A N SER 275.A OG no hydrogen 3.022 N/A ALA 279.A N SER 275.A O no hydrogen 2.855 N/A LEU 280.A N ALA 276.A O no hydrogen 3.245 N/A ALA 281.A N ALA 278.A O no hydrogen 3.255 N/A HIS 282.A N ALA 279.A O no hydrogen 3.104 N/A HIS 282.A NE2 SER 260.A OG no hydrogen 2.811 N/A PHE 284.A N HIS 282.A ND1 no hydrogen 3.018 N/A PHE 285.A N HIS 282.A O no hydrogen 3.000 N/A GLN 286.A N PRO 283.A O no hydrogen 3.005 N/A GLN 286.A NE2 PRO 283.A O no hydrogen 3.204 N/A VAL 288.A N PHE 285.A O no hydrogen 3.012 N/A