Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3f61_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A OG1 GLU 24.A OE2 no hydrogen 2.677 N/A LEU 7.A N TYR 11.A O no hydrogen 2.835 N/A SER 8.A OG TYR 89.A OH no hydrogen 2.516 N/A ARG 10.A N LEU 7.A O no hydrogen 3.076 N/A ARG 10.A NE ASP 30.A OD1 no hydrogen 2.923 N/A ARG 10.A NH2 ASP 30.A OD2 no hydrogen 2.859 N/A TYR 11.A N LEU 7.A O no hydrogen 3.024 N/A GLU 12.A N ARG 29.A O no hydrogen 2.921 N/A LEU 13.A N SER 5.A O no hydrogen 2.907 N/A GLY 14.A N LEU 27.A O no hydrogen 2.586 N/A LEU 17.A N VAL 25.A O no hydrogen 2.581 N/A GLY 18.A N VAL 25.A O no hydrogen 3.228 N/A GLY 20.A N SER 23.A O no hydrogen 2.907 N/A GLU 24.A N VAL 41.A O no hydrogen 2.889 N/A VAL 25.A N GLY 18.A O no hydrogen 2.833 N/A HIS 26.A N VAL 39.A O no hydrogen 2.927 N/A HIS 26.A NE2 GLU 24.A OE2 no hydrogen 2.776 N/A LEU 27.A N GLU 15.A O no hydrogen 2.907 N/A ALA 28.A N VAL 37.A O no hydrogen 2.880 N/A ARG 29.A N GLU 12.A O no hydrogen 2.852 N/A ARG 29.A NE ASP 36.A OD2 no hydrogen 2.569 N/A ARG 29.A NH2 ASP 36.A OD2 no hydrogen 2.974 N/A ASP 30.A N ARG 35.A O no hydrogen 2.735 N/A LEU 31.A N ARG 10.A O no hydrogen 2.810 N/A ARG 32.A N ASP 30.A OD1 no hydrogen 2.974 N/A ARG 32.A NH1 ASP 33.A OD1 no hydrogen 3.259 N/A ASP 33.A N ASP 30.A OD1 no hydrogen 3.069 N/A ARG 35.A N ASP 30.A O no hydrogen 3.284 N/A VAL 37.A N ALA 28.A O no hydrogen 2.856 N/A ALA 38.A N MET 92.A O no hydrogen 2.872 N/A VAL 39.A N HIS 26.A O no hydrogen 2.791 N/A LYS 40.A N ILE 90.A O no hydrogen 2.778 N/A LYS 40.A NZ ASP 156.A OD1 no hydrogen 3.167 N/A LYS 40.A NZ ASP 156.A OD2 no hydrogen 3.042 N/A VAL 41.A N GLU 24.A O no hydrogen 2.831 N/A LEU 42.A N PRO 88.A O no hydrogen 3.197 N/A ARG 43.A N MET 22.A O no hydrogen 2.898 N/A ARG 43.A NE ASP 45.A OD1 no hydrogen 2.960 N/A ARG 43.A NH1 GLY 20.A O no hydrogen 2.848 N/A ARG 43.A NH2 ASP 45.A OD2 no hydrogen 2.897 N/A ALA 44.A N GLU 24.A OE1 no hydrogen 2.976 N/A LEU 46.A N ARG 43.A O no hydrogen 2.863 N/A ALA 47.A N ALA 44.A O no hydrogen 3.372 N/A ASP 49.A N LEU 46.A O no hydrogen 3.011 N/A SER 51.A OG.B ASP 49.A OD2 no hydrogen 2.400 N/A PHE 52.A N ASP 49.A OD2 no hydrogen 3.262 N/A TYR 53.A N ASP 49.A O no hydrogen 2.916 N/A TYR 53.A OH GLU 79.A OE2 no hydrogen 2.588 N/A LEU 54.A N PRO 50.A O no hydrogen 2.955 N/A ARG 55.A N SER 51.A O.A no hydrogen 3.102 N/A ARG 55.A N SER 51.A O.B no hydrogen 3.079 N/A ARG 55.A NE GLU 59.A OE2 no hydrogen 2.816 N/A PHE 56.A N PHE 52.A O no hydrogen 2.918 N/A ARG 57.A N TYR 53.A O no hydrogen 3.073 N/A ARG 57.A NH1 GLU 79.A OE2 no hydrogen 3.049 N/A ARG 58.A N LEU 54.A O no hydrogen 2.928 N/A GLU 59.A N ARG 55.A O no hydrogen 2.951 N/A ALA 60.A N PHE 56.A O no hydrogen 2.961 N/A GLN 61.A N ARG 57.A O no hydrogen 3.477 N/A ASN 62.A N GLU 59.A O no hydrogen 2.898 N/A ASN 62.A ND2 ARG 58.A O no hydrogen 3.192 N/A ALA 64.A N PHE 157.A O no hydrogen 2.964 N/A ALA 70.A N HIS 68.A ND1 no hydrogen 2.973 N/A ILE 71.A N HIS 68.A O no hydrogen 2.987 N/A VAL 72.A N VAL 154.A O no hydrogen 2.929 N/A ALA 73.A N GLU 93.A OE2 no hydrogen 2.985 N/A TYR 75.A N VAL 91.A O no hydrogen 2.822 N/A ASP 76.A N VAL 91.A O no hydrogen 3.322 N/A THR 77.A N ASP 76.A OD1 no hydrogen 2.833 N/A GLY 78.A N TYR 89.A O no hydrogen 3.037 N/A ALA 80.A N LEU 87.A O no hydrogen 2.940 N/A THR 82.A N GLY 85.A O no hydrogen 2.984 N/A THR 82.A OG1 GLY 85.A O no hydrogen 2.707 N/A ALA 84.A N THR 82.A OG1 no hydrogen 3.083 N/A GLY 85.A N THR 82.A O no hydrogen 2.962 N/A LEU 87.A N ALA 80.A O no hydrogen 2.761 N/A TYR 89.A N GLY 78.A O no hydrogen 2.898 N/A TYR 89.A OH SER 8.A OG no hydrogen 2.516 N/A ILE 90.A N LYS 40.A O no hydrogen 2.820 N/A VAL 91.A N ASP 76.A O no hydrogen 2.770 N/A MET 92.A N ALA 38.A O no hydrogen 2.809 N/A GLU 93.A N ALA 73.A O no hydrogen 2.838 N/A VAL 98.A N ILE 146.A O no hydrogen 3.111 N/A THR 99.A N ASP 102.A OD1 no hydrogen 3.112 N/A LEU 100.A N ILE 144.A O no hydrogen 2.934 N/A ARG 101.A N PRO 141.A O no hydrogen 3.443 N/A ASP 102.A N THR 99.A OG1 no hydrogen 2.884 N/A ILE 103.A N THR 99.A O no hydrogen 3.008 N/A VAL 104.A N LEU 100.A O no hydrogen 2.916 N/A HIS 105.A N ARG 101.A O no hydrogen 3.155 N/A THR 106.A N ASP 102.A O no hydrogen 2.896 N/A THR 106.A OG1 ASP 102.A O no hydrogen 3.026 N/A GLU 107.A N ILE 103.A O no hydrogen 2.668 N/A GLY 108.A N VAL 104.A O no hydrogen 3.087 N/A MET 110.A N VAL 190.A O no hydrogen 2.865 N/A ARG 114.A N THR 111.A OG1 no hydrogen 3.071 N/A ALA 115.A N THR 111.A O no hydrogen 2.905 N/A ILE 116.A N PRO 112.A O no hydrogen 2.839 N/A GLU 117.A N LYS 113.A O no hydrogen 2.927 N/A VAL 118.A N ARG 114.A O no hydrogen 2.924 N/A ILE 119.A N ALA 115.A O no hydrogen 2.909 N/A ALA 120.A N ILE 116.A O no hydrogen 2.720 N/A ASP 121.A N GLU 117.A O no hydrogen 2.967 N/A ALA 122.A N VAL 118.A O no hydrogen 3.010 N/A CYS 123.A N ILE 119.A O no hydrogen 2.969 N/A CYS 123.A SG ILE 119.A O no hydrogen 3.526 N/A CYS 123.A SG ALA 247.A O no hydrogen 3.609 N/A GLN 124.A N ALA 120.A O no hydrogen 3.395 N/A ALA 125.A N ASP 121.A O no hydrogen 3.304 N/A LEU 126.A N ALA 122.A O no hydrogen 3.031 N/A ASN 127.A N CYS 123.A O no hydrogen 2.738 N/A PHE 128.A N GLN 124.A O no hydrogen 3.029 N/A SER 129.A N ALA 125.A O no hydrogen 2.929 N/A SER 129.A OG ILE 134.A O no hydrogen 2.586 N/A HIS 130.A N LEU 126.A O no hydrogen 2.808 N/A HIS 130.A NE2 ASP 179.A OD1 no hydrogen 2.739 N/A GLN 131.A N ASN 127.A O no hydrogen 2.967 N/A ASN 132.A N SER 129.A O no hydrogen 2.830 N/A GLY 133.A N HIS 130.A O no hydrogen 2.997 N/A ILE 134.A N SER 129.A O no hydrogen 3.052 N/A HIS 136.A N ASP 179.A OD1 no hydrogen 2.712 N/A ARG 137.A N ASP 179.A OD2 no hydrogen 2.962 N/A LYS 140.A NZ ASP 138.A OD1 no hydrogen 3.544 N/A ASN 143.A N LYS 140.A O no hydrogen 3.019 N/A ASN 143.A ND2 ASP 138.A O no hydrogen 2.935 N/A ASN 143.A ND2 ASP 138.A OD1 no hydrogen 3.097 N/A ILE 144.A N PRO 141.A O no hydrogen 3.286 N/A MET 145.A N LYS 153.A O no hydrogen 2.745 N/A ILE 146.A N VAL 98.A O no hydrogen 2.848 N/A SER 147.A N ALA 151.A O no hydrogen 2.882 N/A SER 147.A OG THR 149.A OG1 no hydrogen 3.066 N/A ALA 148.A N ASP 96.A O no hydrogen 2.808 N/A THR 149.A N SER 147.A OG no hydrogen 3.191 N/A THR 149.A OG1 SER 147.A OG no hydrogen 3.066 N/A ASN 150.A N SER 147.A O no hydrogen 2.794 N/A ALA 151.A N SER 147.A OG no hydrogen 3.207 N/A LYS 153.A N MET 145.A O no hydrogen 2.839 N/A LYS 153.A NZ PRO 69.A O no hydrogen 2.809 N/A LYS 153.A NZ GLU 93.A OE1 no hydrogen 2.832 N/A VAL 154.A N ALA 70.A O no hydrogen 2.793 N/A MET 155.A N ASN 143.A O no hydrogen 2.974 N/A GLY 158.A N HIS 136.A O no hydrogen 2.810 N/A TYR 163.A OH GLU 189.A OE1 no hydrogen 2.502 N/A LEU 164.A N ALA 161.A O no hydrogen 3.393 N/A SER 165.A OG SER 178.A OG.B no hydrogen 2.661 N/A GLU 167.A N GLU 167.A OE1 no hydrogen 2.693 N/A GLN 168.A N SER 165.A OG no hydrogen 3.243 N/A ALA 169.A N SER 165.A O no hydrogen 2.915 N/A ARG 170.A N PRO 166.A O no hydrogen 2.890 N/A GLY 171.A N GLN 168.A O no hydrogen 2.970 N/A ASP 172.A N GLU 167.A O no hydrogen 2.893 N/A ASP 175.A N SER 178.A OG.A no hydrogen 2.978 N/A ARG 177.A N ASP 175.A OD1 no hydrogen 2.922 N/A ARG 177.A NE GLN 245.A OE1 no hydrogen 3.121 N/A ARG 177.A NH1 ASP 175.A OD2 no hydrogen 2.900 N/A ARG 177.A NH2 GLU 241.A OE2 no hydrogen 2.415 N/A ARG 177.A NH2 GLN 245.A OE1 no hydrogen 3.127 N/A SER 178.A N.A ASP 175.A O no hydrogen 2.761 N/A SER 178.A N.B ASP 175.A O no hydrogen 2.760 N/A SER 178.A OG.A GLU 167.A OE2 no hydrogen 2.847 N/A SER 178.A OG.A ASP 175.A O no hydrogen 3.004 N/A SER 178.A OG.B SER 165.A OG no hydrogen 2.661 N/A VAL 180.A N ALA 176.A O no hydrogen 3.112 N/A TYR 181.A N ARG 177.A O no hydrogen 3.029 N/A TYR 181.A OH HIS 209.A ND1 no hydrogen 2.689 N/A SER 182.A N SER 178.A O.A no hydrogen 2.944 N/A SER 182.A N SER 178.A O.B no hydrogen 2.928 N/A SER 182.A OG TYR 163.A O no hydrogen 2.542 N/A SER 182.A OG SER 178.A O.A no hydrogen 3.310 N/A SER 182.A OG SER 178.A O.B no hydrogen 3.353 N/A LEU 183.A N ASP 179.A O no hydrogen 2.821 N/A GLY 184.A N VAL 180.A O no hydrogen 2.850 N/A CYS 185.A N TYR 181.A O no hydrogen 2.985 N/A CYS 185.A SG GLN 162.A O no hydrogen 3.975 N/A CYS 185.A SG TYR 181.A O no hydrogen 3.608 N/A VAL 186.A N SER 182.A O no hydrogen 3.009 N/A LEU 187.A N LEU 183.A O no hydrogen 2.820 N/A TYR 188.A N GLY 184.A O no hydrogen 2.879 N/A TYR 188.A OH ILE 215.A O no hydrogen 2.469 N/A GLU 189.A N CYS 185.A O no hydrogen 3.128 N/A VAL 190.A N VAL 186.A O no hydrogen 2.911 N/A LEU 191.A N LEU 187.A O no hydrogen 2.982 N/A THR 192.A N TYR 188.A O no hydrogen 2.956 N/A THR 192.A OG1 TYR 188.A O no hydrogen 2.817 N/A GLY 193.A N GLU 189.A O no hydrogen 2.701 N/A GLU 194.A N THR 192.A OG1 no hydrogen 3.137 N/A SER 201.A OG ASP 200.A OD1.A no hydrogen 3.138 N/A SER 204.A N SER 201.A OG no hydrogen 3.034 N/A VAL 205.A N SER 201.A O no hydrogen 3.183 N/A ALA 206.A N PRO 202.A O no hydrogen 2.839 N/A TYR 207.A N ASP 203.A O no hydrogen 2.926 N/A GLN 208.A N SER 204.A O no hydrogen 3.137 N/A GLN 208.A NE2 THR 198.A O no hydrogen 2.998 N/A GLN 208.A NE2 SER 204.A O no hydrogen 3.232 N/A HIS 209.A N VAL 205.A O no hydrogen 3.114 N/A HIS 209.A ND1 TYR 181.A OH no hydrogen 2.689 N/A HIS 209.A NE2 ALA 161.A O no hydrogen 2.917 N/A VAL 210.A N ALA 206.A O no hydrogen 3.120 N/A ARG 211.A N TYR 207.A O no hydrogen 2.937 N/A GLU 212.A N GLN 208.A O no hydrogen 2.903 N/A SER 218.A N ASP 229.A OD2 no hydrogen 2.912 N/A SER 218.A OG ASP 229.A OD1 no hydrogen 2.483 N/A SER 218.A OG ASP 229.A OD2 no hydrogen 3.447 N/A ALA 219.A N PRO 216.A O no hydrogen 2.937 N/A ARG 220.A N PRO 217.A O no hydrogen 2.806 N/A ARG 220.A NH1 TYR 188.A OH no hydrogen 3.245 N/A HIS 221.A N PRO 217.A O no hydrogen 3.289 N/A LEU 228.A N SER 225.A OG no hydrogen 3.001 N/A ASP 229.A N SER 225.A O no hydrogen 2.943 N/A ALA 230.A N ALA 226.A O no hydrogen 2.946 N/A VAL 231.A N ASP 227.A O no hydrogen 3.212 N/A VAL 232.A N LEU 228.A O no hydrogen 2.952 N/A LEU 233.A N ASP 229.A O no hydrogen 2.936 N/A LYS 234.A N ALA 230.A O no hydrogen 3.042 N/A ALA 235.A N VAL 231.A O no hydrogen 3.094 N/A LEU 236.A N VAL 232.A O no hydrogen 3.066 N/A ALA 237.A N LYS 234.A O no hydrogen 3.051 N/A LYS 238.A NZ GLN 208.A O no hydrogen 3.252 N/A LYS 238.A NZ HIS 209.A O no hydrogen 2.756 N/A LYS 238.A NZ GLU 212.A O no hydrogen 2.664 N/A ASN 242.A N ASN 239.A O no hydrogen 2.820 N/A ARG 243.A N PRO 240.A O no hydrogen 3.305 N/A ARG 243.A NE ALA 237.A O no hydrogen 2.808 N/A ARG 243.A NH1 GLU 167.A OE1 no hydrogen 2.772 N/A ARG 243.A NH1 LYS 238.A O no hydrogen 2.918 N/A ARG 243.A NH2 GLU 167.A OE1 no hydrogen 3.431 N/A ARG 243.A NH2 GLU 167.A OE2 no hydrogen 2.642 N/A ARG 243.A NH2 ARG 177.A O no hydrogen 2.956 N/A TYR 244.A OH ASP 253.A OD2 no hydrogen 2.605 N/A GLN 245.A N GLU 249.A OE1 no hydrogen 2.976 N/A GLN 245.A NE2 PRO 240.A O no hydrogen 2.857 N/A GLN 245.A NE2 ARG 243.A O no hydrogen 2.974 N/A GLU 249.A N THR 246.A OG1 no hydrogen 3.025 N/A MET 250.A N THR 246.A O no hydrogen 3.274 N/A ARG 251.A N ALA 247.A O no hydrogen 2.950 N/A ALA 252.A N ALA 248.A O no hydrogen 2.884 N/A ASP 253.A N GLU 249.A O no hydrogen 3.133 N/A LEU 254.A N MET 250.A O no hydrogen 2.921 N/A VAL 255.A N ARG 251.A O no hydrogen 2.798 N/A ARG 256.A N ALA 252.A O no hydrogen 2.993 N/A ARG 256.A NE ASP 253.A OD1 no hydrogen 2.948 N/A ARG 256.A NH2 ASP 253.A OD1 no hydrogen 2.950 N/A VAL 257.A N ASP 253.A O no hydrogen 3.145 N/A HIS 258.A N LEU 254.A O no hydrogen 2.897 N/A ASN 259.A N VAL 255.A O no hydrogen 2.946 N/A ASN 259.A N ARG 256.A O no hydrogen 3.036 N/A ASN 259.A ND2 VAL 255.A O no hydrogen 3.159 N/A GLY 260.A N VAL 257.A O no hydrogen 3.029 N/A GLU 261.A N ARG 256.A O no hydrogen 2.841 N/A GLU 264.A N ASP 253.A OD1 no hydrogen 2.793 N/A ALA 265.A N ASP 253.A OD2 no hydrogen 3.104 N/A