Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3r13_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 5.A N SER 1.A O no hydrogen 2.948 N/A HIS 5.A ND1 GLU 138.A OE2 no hydrogen 2.757 N/A HIS 6.A N ASP 2.A O no hydrogen 2.652 N/A HIS 7.A N LYS 3.A O no hydrogen 2.976 N/A HIS 8.A N ILE 4.A O no hydrogen 2.888 N/A HIS 8.A ND1 GLU 138.A OE1 no hydrogen 2.779 N/A HIS 9.A N HIS 5.A O no hydrogen 2.908 N/A HIS 10.A N HIS 6.A O no hydrogen 3.052 N/A GLU 12.A N HIS 9.A O no hydrogen 3.080 N/A TYR 13.A N HIS 10.A O no hydrogen 3.066 N/A ILE 15.A N ILE 11.A O no hydrogen 2.844 N/A GLU 16.A N GLU 12.A O no hydrogen 2.913 N/A GLU 17.A N TYR 13.A O no hydrogen 2.887 N/A ALA 18.A N ARG 14.A O no hydrogen 3.121 N/A VAL 19.A N ILE 15.A O no hydrogen 2.882 N/A ALA 20.A N GLU 16.A O no hydrogen 2.892 N/A LYS 21.A N GLU 17.A O no hydrogen 3.009 N/A TYR 22.A N ALA 18.A O no hydrogen 2.847 N/A ARG 23.A N VAL 19.A O no hydrogen 2.889 N/A ARG 23.A NH2 GLU 168.A OE2 no hydrogen 3.167 N/A GLU 24.A N ALA 20.A O no hydrogen 3.085 N/A PHE 25.A N LYS 21.A O no hydrogen 2.862 N/A TYR 26.A N TYR 22.A O no hydrogen 3.041 N/A TYR 26.A OH HIS 202.A ND1 no hydrogen 2.595 N/A ARG 32.A NE.B SER 34.A O no hydrogen 3.069 N/A ARG 32.A NH1.A ILE 227.A O no hydrogen 2.763 N/A ARG 32.A NH1.A ALA 230.A O no hydrogen 2.905 N/A ARG 32.A NH1.B SER 34.A O no hydrogen 2.839 N/A ARG 32.A NH1.B ASP 39.A OD2 no hydrogen 3.310 N/A ARG 32.A NH2.A ASP 231.A OD1 no hydrogen 3.339 N/A GLY 36.A N ASP 39.A OD2 no hydrogen 2.914 N/A VAL 40.A N GLY 36.A O no hydrogen 3.003 N/A LYS 41.A N ILE 37.A O.A no hydrogen 2.872 N/A LYS 41.A N ILE 37.A O.B no hydrogen 2.898 N/A SER 42.A N.A GLU 38.A O no hydrogen 2.965 N/A SER 42.A N.B GLU 38.A O no hydrogen 2.956 N/A SER 42.A OG.A GLU 38.A O no hydrogen 3.302 N/A SER 42.A OG.B GLU 38.A O no hydrogen 3.561 N/A SER 42.A OG.B ASP 39.A O no hydrogen 2.824 N/A ALA 43.A N VAL 40.A O no hydrogen 2.956 N/A ILE 44.A N LYS 41.A O no hydrogen 3.161 N/A GLU 45.A N ILE 233.A O.A no hydrogen 2.932 N/A GLU 45.A N ILE 233.A O.B no hydrogen 3.026 N/A HIS 46.A N GLY 72.A O no hydrogen 2.948 N/A HIS 46.A NE2 GLU 64.A OE1 no hydrogen 2.736 N/A THR 47.A N THR 235.A O no hydrogen 2.970 N/A THR 47.A OG1 GLU 45.A O no hydrogen 2.834 N/A THR 47.A OG1 THR 235.A O no hydrogen 3.454 N/A ASN 48.A N CYS 74.A O no hydrogen 2.981 N/A LYS 50.A N ASN 48.A OD1 no hydrogen 3.007 N/A ALA 53.A N LYS 50.A O no hydrogen 3.102 N/A THR 54.A N ASP 57.A OD2 no hydrogen 2.992 N/A ASP 57.A N THR 54.A OG1 no hydrogen 3.226 N/A ILE 58.A N THR 54.A O no hydrogen 3.178 N/A LYS 59.A N PRO 55.A O no hydrogen 2.992 N/A LYS 60.A N ASP 56.A O no hydrogen 2.979 N/A LEU 61.A N ASP 57.A O no hydrogen 2.903 N/A CYS 62.A N ILE 58.A O no hydrogen 2.879 N/A CYS 62.A SG ILE 58.A O no hydrogen 3.336 N/A LEU 63.A N LYS 59.A O no hydrogen 3.048 N/A GLU 64.A N LYS 60.A O no hydrogen 2.881 N/A ALA 65.A N LEU 61.A O no hydrogen 2.977 N/A ARG 66.A N CYS 62.A O no hydrogen 3.032 N/A GLU 67.A N LEU 63.A O no hydrogen 2.907 N/A ASN 68.A N GLU 64.A O no hydrogen 2.966 N/A ASN 68.A ND2 GLU 64.A O no hydrogen 2.835 N/A ARG 69.A N ARG 66.A O no hydrogen 3.284 N/A ARG 69.A NH1 GLU 38.A OE1 no hydrogen 2.912 N/A ARG 69.A NH2 GLU 38.A OE1 no hydrogen 3.440 N/A ARG 69.A NH2 GLU 38.A OE2 no hydrogen 3.184 N/A PHE 70.A N ALA 65.A O no hydrogen 3.076 N/A GLY 72.A N ILE 44.A O no hydrogen 3.422 N/A VAL 73.A N LYS 93.A O no hydrogen 2.868 N/A CYS 74.A N HIS 46.A O no hydrogen 2.909 N/A CYS 74.A SG VAL 95.A O no hydrogen 3.927 N/A VAL 75.A N VAL 95.A O no hydrogen 3.101 N/A ASN 76.A ND2 LEU 49.A O no hydrogen 3.075 N/A TYR 79.A N ASN 76.A O no hydrogen 2.863 N/A TYR 79.A OH ALA 53.A O no hydrogen 2.705 N/A VAL 80.A N PRO 77.A O no hydrogen 3.251 N/A LYS 81.A NZ SER 120.A OG no hydrogen 3.354 N/A ALA 83.A N TYR 79.A O no hydrogen 2.968 N/A ARG 84.A N.A VAL 80.A O no hydrogen 2.946 N/A ARG 84.A N.B VAL 80.A O no hydrogen 2.966 N/A ARG 84.A NE.A GLY 121.A O no hydrogen 3.074 N/A ARG 84.A NE.B GLY 121.A O no hydrogen 2.936 N/A ARG 84.A NH2.A GLY 121.A O no hydrogen 2.864 N/A ARG 84.A NH2.A ASP 123.A OD2 no hydrogen 2.484 N/A GLU 85.A N LYS 81.A O no hydrogen 3.011 N/A GLU 86.A N LEU 82.A O no hydrogen 2.930 N/A LEU 87.A N ALA 83.A O no hydrogen 3.021 N/A GLU 88.A N GLU 85.A O no hydrogen 3.478 N/A THR 90.A N LEU 87.A O no hydrogen 2.974 N/A THR 90.A OG1 LEU 87.A O no hydrogen 2.643 N/A VAL 92.A N THR 90.A OG1 no hydrogen 3.322 N/A LYS 93.A N HIS 71.A O no hydrogen 2.987 N/A VAL 94.A N ASP 123.A OD2 no hydrogen 2.816 N/A VAL 95.A N VAL 73.A O no hydrogen 2.769 N/A THR 96.A N GLU 124.A O no hydrogen 3.181 N/A THR 96.A OG1 VAL 75.A O no hydrogen 2.612 N/A VAL 98.A N ASP 126.A O no hydrogen 2.946 N/A GLY 99.A N GLU 113.A OE1 no hydrogen 3.024 N/A GLY 103.A N GLY 99.A O no hydrogen 2.782 N/A THR 107.A OG1 ASP 143.A OD1 no hydrogen 2.604 N/A ARG 108.A NE GLU 106.A OE1 no hydrogen 2.851 N/A ARG 108.A NH2 GLU 106.A OE1 no hydrogen 3.116 N/A LYS 110.A N GLU 106.A O no hydrogen 3.230 N/A LYS 110.A NZ GLY 103.A O no hydrogen 2.837 N/A LYS 110.A NZ VAL 127.A O no hydrogen 2.759 N/A LYS 110.A NZ ASP 143.A OD2 no hydrogen 2.706 N/A ALA 111.A N THR 107.A O no hydrogen 3.020 N/A HIS 112.A N ARG 108.A O no hydrogen 2.939 N/A HIS 112.A ND1 ARG 108.A O no hydrogen 2.802 N/A GLU 113.A N THR 109.A O no hydrogen 2.769 N/A ALA 114.A N LYS 110.A O no hydrogen 2.956 N/A ILE 115.A N ALA 111.A O no hydrogen 2.997 N/A PHE 116.A N HIS 112.A O no hydrogen 2.892 N/A ALA 117.A N GLU 113.A O no hydrogen 2.884 N/A VAL 118.A N ALA 114.A O no hydrogen 3.032 N/A GLU 119.A N ILE 115.A O no hydrogen 2.986 N/A SER 120.A N PHE 116.A O no hydrogen 2.897 N/A SER 120.A OG PHE 116.A O no hydrogen 3.210 N/A GLY 121.A N VAL 118.A O no hydrogen 2.941 N/A ALA 122.A N ALA 117.A O no hydrogen 2.938 N/A ASP 123.A N VAL 94.A O no hydrogen 2.832 N/A GLU 124.A N VAL 94.A O no hydrogen 3.374 N/A ILE 125.A N VAL 155.A O no hydrogen 2.895 N/A ASP 126.A N THR 96.A O no hydrogen 2.829 N/A ILE 128.A N ILE 159.A O no hydrogen 2.987 N/A LYS 133.A N VAL 130.A O no hydrogen 2.794 N/A LYS 133.A NZ TYR 164.A O no hydrogen 2.885 N/A LYS 133.A NZ GLU 169.A OE1 no hydrogen 2.588 N/A LYS 133.A NZ GLU 169.A OE2 no hydrogen 3.269 N/A ALA 134.A N GLY 131.A O no hydrogen 2.978 N/A LYS 135.A N LEU 132.A O no hydrogen 2.914 N/A TRP 137.A NE1 GLU 12.A OE1 no hydrogen 2.823 N/A VAL 140.A N GLU 136.A O no hydrogen 3.141 N/A TYR 141.A N TRP 137.A O no hydrogen 2.843 N/A GLU 142.A N.A GLU 138.A O no hydrogen 2.918 N/A GLU 142.A N.B GLU 138.A O no hydrogen 2.928 N/A ASP 143.A N TYR 139.A O no hydrogen 2.909 N/A ILE 144.A N VAL 140.A O no hydrogen 3.084 N/A ARG 145.A N TYR 141.A O no hydrogen 2.822 N/A ARG 145.A NH1 ALA 180.A O no hydrogen 2.867 N/A SER 146.A N.A GLU 142.A O.A no hydrogen 2.910 N/A SER 146.A N.A GLU 142.A O.B no hydrogen 3.033 N/A SER 146.A N.B GLU 142.A O.A no hydrogen 2.905 N/A SER 146.A N.B GLU 142.A O.B no hydrogen 3.029 N/A SER 146.A OG.B GLU 142.A O.A no hydrogen 2.700 N/A SER 146.A OG.B GLU 142.A O.B no hydrogen 2.573 N/A VAL 148.A N ILE 144.A O no hydrogen 3.022 N/A GLU 149.A N ARG 145.A O no hydrogen 2.900 N/A SER 150.A N SER 146.A O.A no hydrogen 3.177 N/A SER 150.A N SER 146.A O.B no hydrogen 3.247 N/A SER 150.A N VAL 147.A O no hydrogen 3.040 N/A SER 150.A OG SER 146.A O.A no hydrogen 2.664 N/A SER 150.A OG SER 146.A O.B no hydrogen 2.645 N/A VAL 151.A N VAL 147.A O no hydrogen 3.339 N/A VAL 151.A N VAL 148.A O no hydrogen 3.377 N/A LYS 154.A N VAL 151.A O no hydrogen 2.882 N/A VAL 156.A N HIS 183.A ND1 no hydrogen 3.096 N/A LYS 157.A N ILE 125.A O no hydrogen 2.853 N/A LYS 157.A NZ GLU 45.A OE1 no hydrogen 2.856 N/A LYS 157.A NZ GLU 45.A OE2 no hydrogen 3.413 N/A LYS 157.A NZ GLU 124.A OE1 no hydrogen 2.845 N/A LYS 157.A NZ ASP 126.A OD1 no hydrogen 2.681 N/A VAL 158.A N PHE 184.A O no hydrogen 3.000 N/A ILE 160.A N LYS 186.A O no hydrogen 3.073 N/A THR 162.A N THR 187.A O no hydrogen 2.955 N/A THR 162.A OG1 THR 187.A O no hydrogen 3.528 N/A THR 162.A OG1 ASP 200.A OD2 no hydrogen 3.540 N/A CYS 163.A SG THR 193.A OG1 no hydrogen 3.771 N/A CYS 163.A SG GLY 194.A O no hydrogen 4.002 N/A TYR 164.A N GLU 161.A O no hydrogen 3.096 N/A LEU 165.A N THR 162.A O no hydrogen 3.121 N/A ASP 166.A N GLU 169.A OE1 no hydrogen 2.910 N/A GLU 169.A N ASP 166.A OD1 no hydrogen 2.799 N/A LYS 170.A N ASP 166.A O no hydrogen 2.880 N/A LYS 170.A NZ ASP 200.A OD1 no hydrogen 2.736 N/A ILE 171.A N THR 167.A O no hydrogen 3.019 N/A ALA 172.A N GLU 168.A O no hydrogen 2.895 N/A ALA 173.A N GLU 169.A O no hydrogen 2.944 N/A CYS 174.A N LYS 170.A O no hydrogen 3.109 N/A CYS 174.A SG LYS 170.A O no hydrogen 3.452 N/A VAL 175.A N ILE 171.A O no hydrogen 3.061 N/A ILE 176.A N ALA 172.A O no hydrogen 2.878 N/A SER 177.A N ALA 173.A O no hydrogen 2.984 N/A SER 177.A OG ALA 173.A O no hydrogen 2.721 N/A LYS 178.A N CYS 174.A O no hydrogen 2.980 N/A LYS 178.A NZ VAL 207.A O no hydrogen 2.828 N/A LEU 179.A N VAL 175.A O no hydrogen 2.954 N/A ALA 180.A N ILE 176.A O no hydrogen 2.968 N/A GLY 181.A N LYS 178.A O no hydrogen 3.086 N/A ALA 182.A N SER 177.A O no hydrogen 3.196 N/A HIS 183.A N VAL 156.A O no hydrogen 2.929 N/A PHE 184.A N VAL 156.A O no hydrogen 3.278 N/A VAL 185.A N GLY 211.A O no hydrogen 2.914 N/A LYS 186.A N VAL 158.A O no hydrogen 2.877 N/A LYS 186.A NZ ASP 126.A OD2 no hydrogen 2.906 N/A THR 187.A N LYS 213.A O no hydrogen 3.075 N/A THR 187.A OG1 SER 188.A OG no hydrogen 3.186 N/A THR 187.A OG1 SER 215.A O no hydrogen 2.992 N/A THR 187.A OG1 SER 215.A OG no hydrogen 3.348 N/A SER 188.A N SER 215.A OG no hydrogen 3.131 N/A SER 188.A OG THR 187.A OG1 no hydrogen 3.186 N/A SER 188.A OG SER 215.A O no hydrogen 3.269 N/A THR 189.A N GLU 161.A OE1 no hydrogen 2.876 N/A THR 189.A OG1 GLU 161.A OE1 no hydrogen 3.560 N/A THR 189.A OG1 GLU 161.A OE2 no hydrogen 2.681 N/A PHE 191.A N THR 189.A OG1 no hydrogen 2.925 N/A ALA 196.A N GLY 216.A O no hydrogen 2.980 N/A GLU 199.A N GLU 199.A OE1 no hydrogen 2.680 N/A ASP 200.A N THR 197.A OG1 no hydrogen 2.998 N/A VAL 201.A N THR 197.A O no hydrogen 3.051 N/A HIS 202.A N ALA 198.A O no hydrogen 2.973 N/A HIS 202.A ND1 TYR 26.A OH no hydrogen 2.595 N/A LEU 203.A N GLU 199.A O no hydrogen 3.122 N/A LYS 204.A NZ GLY 208.A O no hydrogen 3.428 N/A LYS 204.A NZ ASP 231.A OD2 no hydrogen 2.823 N/A TRP 205.A N HIS 202.A O no hydrogen 2.807 N/A ILE 206.A N LEU 203.A O no hydrogen 2.933 N/A GLY 208.A N LYS 204.A O no hydrogen 2.874 N/A GLY 211.A N HIS 183.A O no hydrogen 2.877 N/A VAL 212.A N ASP 231.A OD2 no hydrogen 2.952 N/A LYS 213.A N VAL 185.A O no hydrogen 2.869 N/A LYS 213.A NZ GLU 45.A OE1 no hydrogen 2.559 N/A LYS 213.A NZ ASP 126.A OD2 no hydrogen 2.772 N/A ALA 214.A N ARG 232.A O no hydrogen 2.948 N/A SER 215.A N THR 187.A OG1 no hydrogen 2.940 N/A SER 215.A OG THR 187.A OG1 no hydrogen 3.348 N/A SER 215.A OG SER 188.A O no hydrogen 2.654 N/A ARG 219.A N ASP 223.A OD2 no hydrogen 2.923 N/A THR 220.A N ASP 223.A OD2 no hydrogen 3.273 N/A GLU 222.A N GLU 222.A OE1 no hydrogen 2.860 N/A ASP 223.A N THR 220.A OG1 no hydrogen 3.070 N/A ALA 224.A N THR 220.A O no hydrogen 3.141 N/A VAL 225.A N PHE 221.A O no hydrogen 2.909 N/A LYS 226.A N GLU 222.A O no hydrogen 3.010 N/A GLY 229.A N ILE 227.A O no hydrogen 3.143 N/A ASP 231.A N VAL 212.A O no hydrogen 2.831 N/A ARG 232.A N VAL 212.A O no hydrogen 3.329 N/A ARG 232.A NH1 GLU 45.A OE2 no hydrogen 2.698 N/A ARG 232.A NH1 GLU 124.A OE1 no hydrogen 2.926 N/A ARG 232.A NH1 GLU 124.A OE2 no hydrogen 3.426 N/A ARG 232.A NH2 GLU 124.A OE2 no hydrogen 3.441 N/A ILE 233.A N.A ALA 43.A O no hydrogen 2.792 N/A ILE 233.A N.B ALA 43.A O no hydrogen 2.822 N/A GLY 234.A N ALA 214.A O no hydrogen 2.772 N/A THR 235.A N GLU 45.A O no hydrogen 3.487 N/A THR 235.A OG1 ILE 218.A O no hydrogen 2.676 N/A SER 236.A OG.B THR 47.A O no hydrogen 2.879 N/A SER 237.A N THR 235.A OG1 no hydrogen 2.892 N/A LYS 240.A NZ.A GLN 243.A OE1 no hydrogen 2.626 N/A ILE 241.A N SER 237.A O no hydrogen 2.893 N/A VAL 242.A N GLY 238.A O no hydrogen 2.979 N/A GLN 243.A N VAL 239.A O no hydrogen 3.004 N/A GLY 244.A N LYS 240.A O.A no hydrogen 2.767 N/A GLY 244.A N LYS 240.A O.B no hydrogen 2.759 N/A GLY 245.A N ILE 241.A O no hydrogen 3.017 N/A GLU 246.A N VAL 242.A O no hydrogen 2.998 N/A GLU 247.A N GLN 243.A O no hydrogen 2.895 N/A ARG 248.A N GLY 244.A O no hydrogen 2.850 N/A ARG 248.A NE GLU 222.A OE2 no hydrogen 2.627 N/A ARG 248.A NH1 GLU 247.A OE2 no hydrogen 3.160 N/A ARG 248.A NH2 GLU 222.A OE1 no hydrogen 2.752 N/A ARG 248.A NH2 GLU 222.A OE2 no hydrogen 3.466 N/A TYR 249.A N GLY 245.A O no hydrogen 2.969 N/A TYR 249.A OH GLU 222.A OE2 no hydrogen 2.653 N/A GLY 250.A N GLU 246.A O no hydrogen 3.119 N/A