Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5m02_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 3.A N LEU 103.A O no hydrogen 2.746 N/A HIS 3.A ND1 ASP 29.A OD2 no hydrogen 2.771 N/A SER 4.A N ASP 29.A OD1 no hydrogen 2.809 N/A MET 5.A N CYS 101.A O no hydrogen 3.024 N/A ARG 6.A N TYR 27.A O no hydrogen 2.942 N/A ARG 6.A NH1 MET 5.A O no hydrogen 3.044 N/A ARG 6.A NH1 CYS 101.A O no hydrogen 3.094 N/A ARG 6.A NH1 ASP 102.A OD1 no hydrogen 2.987 N/A ARG 6.A NH2 ASP 102.A OD1 no hydrogen 2.828 N/A TYR 7.A N SER 99.A O no hydrogen 2.844 N/A PHE 8.A N VAL 25.A O no hydrogen 2.874 N/A GLU 9.A N GLN 97.A O no hydrogen 2.880 N/A THR 10.A N ILE 23.A O no hydrogen 2.899 N/A ALA 11.A N LEU 95.A O no hydrogen 2.836 N/A VAL 12.A N ARG 21.A O no hydrogen 2.851 N/A SER 13.A N HIS 93.A O no hydrogen 2.907 N/A SER 13.A OG HIS 93.A O no hydrogen 3.473 N/A ARG 14.A NE GLU 19.A O no hydrogen 3.000 N/A ARG 14.A NH1 ASP 39.A OD1 no hydrogen 3.333 N/A ARG 14.A NH1 ASP 39.A OD2 no hydrogen 3.027 N/A ARG 14.A NH2 GLU 19.A O no hydrogen 2.978 N/A ARG 14.A NH2 ASP 39.A OD2 no hydrogen 3.286 N/A ARG 21.A N VAL 12.A O no hydrogen 2.838 N/A ARG 21.A NE ASP 37.A OD1 no hydrogen 2.844 N/A ARG 21.A NH2 ASP 37.A OD1 no hydrogen 3.459 N/A ARG 21.A NH2 ASP 37.A OD2 no hydrogen 2.772 N/A TYR 22.A N SER 38.A OG no hydrogen 2.902 N/A TYR 22.A OH GLU 9.A OE1 no hydrogen 2.474 N/A ILE 23.A N THR 10.A O no hydrogen 2.844 N/A SER 24.A N PHE 36.A O no hydrogen 2.899 N/A SER 24.A OG TYR 45.A OH no hydrogen 2.583 N/A VAL 25.A N PHE 8.A O no hydrogen 2.871 N/A GLY 26.A N VAL 34.A O no hydrogen 2.922 N/A TYR 27.A N ARG 6.A O no hydrogen 2.769 N/A VAL 28.A N LYS 31.A O no hydrogen 2.954 N/A ASP 29.A N SER 4.A O no hydrogen 2.811 N/A LYS 31.A N VAL 28.A O no hydrogen 2.874 N/A LYS 31.A NZ LEU 179.A O no hydrogen 3.538 N/A LYS 31.A NZ TYR 208.A OH no hydrogen 3.209 N/A PHE 33.A N GLY 26.A O no hydrogen 2.875 N/A ARG 35.A N GLU 46.A O no hydrogen 3.100 N/A ARG 35.A NE GLU 32.A OE2 no hydrogen 2.895 N/A ARG 35.A NH2 GLU 32.A OE1 no hydrogen 2.934 N/A ARG 35.A NH2 GLU 32.A OE2 no hydrogen 3.546 N/A PHE 36.A N SER 24.A O no hydrogen 2.881 N/A SER 38.A N TYR 22.A O no hydrogen 2.895 N/A SER 38.A OG TYR 22.A O no hydrogen 3.402 N/A ASP 39.A N ASP 37.A OD1 no hydrogen 2.921 N/A ALA 40.A N ASP 37.A O no hydrogen 2.996 N/A ARG 44.A NH1.B ASN 42.A O no hydrogen 3.377 N/A TYR 45.A N THR 64.A OG1 no hydrogen 2.985 N/A TYR 45.A OH SER 24.A OG no hydrogen 2.583 N/A GLU 46.A N ARG 35.A O no hydrogen 2.909 N/A ARG 48.A N PHE 33.A O no hydrogen 2.768 N/A ARG 48.A NE GLU 32.A OE2 no hydrogen 2.757 N/A MET 52.A N ALA 49.A O no hydrogen 3.091 N/A GLU 53.A N PRO 50.A O no hydrogen 3.126 N/A GLN 54.A N TRP 51.A O no hydrogen 3.329 N/A GLU 55.A N MET 52.A O no hydrogen 3.220 N/A GLU 58.A N GLU 58.A OE2.A no hydrogen 2.945 N/A TYR 59.A N GLY 56.A O no hydrogen 3.106 N/A TYR 59.A OH TYR 171.A OH no hydrogen 2.585 N/A GLU 61.A N PRO 57.A O no hydrogen 2.883 N/A ARG 62.A N GLU 58.A O no hydrogen 2.942 N/A ARG 62.A NH1 GLU 58.A OE2.B no hydrogen 2.898 N/A GLU 63.A N TYR 59.A O no hydrogen 2.933 N/A THR 64.A N TRP 60.A O no hydrogen 2.879 N/A THR 64.A OG1 TRP 60.A O no hydrogen 2.715 N/A GLN 65.A N GLU 61.A O no hydrogen 2.921 N/A LYS 66.A N ARG 62.A O no hydrogen 2.904 N/A LYS 66.A NZ GLU 63.A OE2 no hydrogen 2.756 N/A ALA 67.A N GLU 63.A O no hydrogen 2.940 N/A LYS 68.A N THR 64.A O no hydrogen 2.974 N/A GLY 69.A N GLN 65.A O no hydrogen 3.063 N/A GLN 70.A N LYS 66.A O no hydrogen 2.936 N/A GLU 71.A N ALA 67.A O no hydrogen 2.805 N/A GLN 72.A N LYS 68.A O no hydrogen 3.347 N/A TRP 73.A N GLY 69.A O no hydrogen 2.993 N/A PHE 74.A N GLN 70.A O no hydrogen 2.779 N/A ARG 75.A N GLU 71.A O no hydrogen 2.962 N/A ARG 75.A NE GLN 72.A OE1 no hydrogen 2.964 N/A ARG 75.A NH2 GLN 72.A OE1 no hydrogen 2.771 N/A VAL 76.A N GLN 72.A O no hydrogen 2.990 N/A SER 77.A N TRP 73.A O no hydrogen 2.922 N/A SER 77.A OG TRP 73.A O no hydrogen 3.027 N/A LEU 78.A N PHE 74.A O no hydrogen 2.845 N/A ARG 79.A N ARG 75.A O no hydrogen 3.100 N/A ASN 80.A N VAL 76.A O no hydrogen 2.843 N/A LEU 81.A N SER 77.A O no hydrogen 2.881 N/A LEU 82.A N LEU 78.A O no hydrogen 3.023 N/A GLY 83.A N ARG 79.A O no hydrogen 3.348 N/A TYR 84.A N ASN 80.A O no hydrogen 3.011 N/A TYR 85.A N LEU 81.A O no hydrogen 2.971 N/A TYR 85.A OH ASP 137.A OD1 no hydrogen 2.485 N/A ASN 86.A N GLY 83.A O no hydrogen 3.123 N/A GLN 87.A N LEU 82.A O no hydrogen 2.952 N/A GLN 87.A NE2 TYR 118.A OH no hydrogen 2.595 N/A SER 92.A OG SER 13.A O no hydrogen 2.600 N/A HIS 93.A N SER 13.A OG no hydrogen 2.950 N/A HIS 93.A ND1 GLU 119.A OE2 no hydrogen 2.652 N/A THR 94.A N GLU 119.A OE1 no hydrogen 2.978 N/A LEU 95.A N ALA 11.A O no hydrogen 2.930 N/A GLN 96.A N ALA 117.A O no hydrogen 2.892 N/A GLN 97.A N GLU 9.A O no hydrogen 2.822 N/A GLN 97.A NE2 SER 99.A OG no hydrogen 2.911 N/A MET 98.A N GLN 115.A O no hydrogen 2.921 N/A SER 99.A N TYR 7.A O no hydrogen 3.040 N/A GLY 100.A N TYR 113.A O no hydrogen 3.005 N/A CYS 101.A N MET 5.A O no hydrogen 3.039 N/A ASP 102.A N ARG 111.A O no hydrogen 2.876 N/A LEU 103.A N HIS 3.A O no hydrogen 2.835 N/A GLY 104.A N ARG 108.A O no hydrogen 3.034 N/A TRP 107.A N GLY 104.A O no hydrogen 2.918 N/A ARG 108.A N ASP 106.A OD2 no hydrogen 3.205 N/A ARG 108.A NE.A ASP 106.A OD1 no hydrogen 3.279 N/A LEU 110.A N ASP 102.A O no hydrogen 2.734 N/A ARG 111.A N ASP 102.A O no hydrogen 3.468 N/A TYR 113.A N GLY 100.A O no hydrogen 2.819 N/A TYR 113.A OH ASP 102.A OD2 no hydrogen 2.727 N/A GLN 115.A N MET 98.A O no hydrogen 2.904 N/A PHE 116.A N ILE 124.A O no hydrogen 2.882 N/A ALA 117.A N GLN 96.A O no hydrogen 2.928 N/A TYR 118.A N ARG 121.A O no hydrogen 2.926 N/A GLU 119.A N THR 94.A O no hydrogen 2.914 N/A ARG 121.A N TYR 118.A O no hydrogen 3.101 N/A TYR 123.A N PHE 116.A O no hydrogen 2.863 N/A TYR 123.A OH THR 143.A OG1 no hydrogen 2.829 N/A ALA 125.A N THR 134.A O no hydrogen 2.969 N/A LEU 126.A N LEU 114.A O no hydrogen 2.806 N/A ASN 127.A N THR 132.A O no hydrogen 2.795 N/A ASN 127.A ND2 THR 134.A OG1 no hydrogen 2.601 N/A LEU 130.A N ASN 127.A O no hydrogen 2.861 N/A LYS 131.A N ASP 129.A OD2 no hydrogen 2.859 N/A THR 132.A N ASP 129.A OD2 no hydrogen 3.016 N/A THR 132.A OG1 ASN 127.A OD1 no hydrogen 2.823 N/A THR 132.A OG1 ASP 129.A OD1 no hydrogen 2.842 N/A THR 132.A OG1 ASP 129.A OD2 no hydrogen 3.246 N/A THR 134.A N ALA 125.A O no hydrogen 2.887 N/A ALA 136.A N TYR 123.A O no hydrogen 2.862 N/A ALA 140.A N ASP 137.A OD2 no hydrogen 2.961 N/A GLN 141.A N ASP 137.A O no hydrogen 3.147 N/A GLN 141.A N MET 138.A O no hydrogen 3.166 N/A GLN 141.A NE2 ALA 135.A O no hydrogen 3.255 N/A GLN 141.A NE2 ASP 137.A O no hydrogen 3.167 N/A ILE 142.A N ALA 139.A O no hydrogen 2.901 N/A THR 143.A N ALA 139.A O no hydrogen 3.260 N/A THR 143.A OG1 TYR 123.A OH no hydrogen 2.829 N/A ARG 144.A N ALA 140.A O no hydrogen 2.752 N/A ARG 144.A NE GLN 141.A OE1 no hydrogen 3.150 N/A ARG 144.A NH1 GLU 148.A OE2 no hydrogen 2.920 N/A ARG 144.A NH2 GLN 141.A OE1 no hydrogen 2.857 N/A ARG 145.A N GLN 141.A O no hydrogen 3.020 N/A LYS 146.A N ILE 142.A O no hydrogen 3.011 N/A TRP 147.A N THR 143.A O no hydrogen 2.907 N/A GLU 148.A N ARG 144.A O no hydrogen 2.815 N/A GLN 149.A N ARG 145.A O no hydrogen 2.896 N/A SER 150.A N LYS 146.A O no hydrogen 2.966 N/A SER 150.A OG LYS 146.A O no hydrogen 3.343 N/A SER 150.A OG TRP 147.A O no hydrogen 3.440 N/A GLY 151.A N GLU 148.A O no hydrogen 3.385 N/A ALA 152.A N TRP 147.A O no hydrogen 3.036 N/A GLU 154.A N GLY 151.A O no hydrogen 3.162 N/A TYR 156.A N ALA 152.A O no hydrogen 3.012 N/A LYS 157.A N ALA 153.A O no hydrogen 2.820 N/A LYS 157.A NZ GLU 161.A OE1 no hydrogen 3.067 N/A LYS 157.A NZ GLU 161.A OE2 no hydrogen 2.686 N/A ALA 158.A N GLU 154.A O no hydrogen 3.090 N/A TYR 159.A N HIS 155.A O no hydrogen 3.178 N/A LEU 160.A N TYR 156.A O no hydrogen 2.874 N/A GLU 161.A N LYS 157.A O no hydrogen 2.886 N/A GLY 162.A N ALA 158.A O no hydrogen 2.961 N/A CYS 164.A N TYR 159.A O no hydrogen 2.820 N/A GLU 166.A N GLY 162.A O no hydrogen 2.996 N/A TRP 167.A N GLU 163.A O no hydrogen 2.910 N/A LEU 168.A N CYS 164.A O no hydrogen 2.980 N/A HIS 169.A N VAL 165.A O no hydrogen 3.074 N/A ARG 170.A N GLU 166.A O no hydrogen 3.124 N/A ARG 170.A NE GLU 55.A OE1 no hydrogen 3.460 N/A ARG 170.A NE GLU 55.A OE2 no hydrogen 2.793 N/A ARG 170.A NH2 GLU 55.A OE1 no hydrogen 3.199 N/A ARG 170.A NH2 GLU 55.A OE2 no hydrogen 3.352 N/A TYR 171.A N TRP 167.A O no hydrogen 2.835 N/A TYR 171.A OH TYR 59.A OH no hydrogen 2.585 N/A LEU 172.A N LEU 168.A O no hydrogen 2.879 N/A LYS 173.A N HIS 169.A O no hydrogen 3.068 N/A ASN 174.A N ARG 170.A O no hydrogen 2.975 N/A GLY 175.A N TYR 171.A O no hydrogen 2.770 N/A LEU 179.A N GLY 175.A O no hydrogen 2.742 N/A LEU 180.A N ASN 176.A O no hydrogen 2.992 N/A ARG 181.A N THR 178.A O no hydrogen 3.146 N/A ARG 181.A NH1 ASP 183.A OD2 no hydrogen 2.778 N/A ASP 183.A N TYR 208.A O no hydrogen 2.857 N/A LYS 186.A N LEU 205.A O no hydrogen 2.863 N/A HIS 188.A N TRP 203.A O no hydrogen 3.208 N/A THR 190.A N ARG 201.A O no hydrogen 2.948 N/A THR 190.A OG1 HIS 192.A NE2 no hydrogen 2.646 N/A HIS 191.A NE2 GLU 253.A OE1 no hydrogen 2.724 N/A HIS 192.A N THR 199.A O no hydrogen 2.847 N/A HIS 192.A NE2 THR 190.A OG1 no hydrogen 2.646 N/A ARG 194.A N GLU 197.A O no hydrogen 3.083 N/A ARG 194.A NH1 GLU 197.A OE2 no hydrogen 3.555 N/A VAL 198.A N VAL 248.A O no hydrogen 2.897 N/A THR 199.A N HIS 192.A O no hydrogen 2.766 N/A LEU 200.A N VAL 246.A O no hydrogen 2.881 N/A ARG 201.A N THR 190.A O no hydrogen 2.969 N/A CYS 202.A N ALA 244.A O no hydrogen 2.727 N/A TRP 203.A N HIS 188.A O no hydrogen 2.855 N/A TRP 203.A NE1 THR 190.A OG1 no hydrogen 2.931 N/A ALA 204.A N LYS 242.A O no hydrogen 2.848 N/A LEU 205.A N LYS 186.A O no hydrogen 2.817 N/A PHE 207.A N PHE 240.A O no hydrogen 3.294 N/A TYR 208.A N ASP 183.A O no hydrogen 2.996 N/A THR 213.A N TYR 261.A O no hydrogen 3.045 N/A THR 215.A N ARG 259.A O no hydrogen 3.000 N/A TRP 216.A NE1 ALA 244.A O no hydrogen 2.967 N/A GLN 217.A N THR 257.A O no hydrogen 2.771 N/A LEU 218.A N GLU 221.A O no hydrogen 2.867 N/A GLU 221.A N LEU 218.A O no hydrogen 2.979 N/A LEU 223.A N TRP 216.A O no hydrogen 2.865 N/A GLU 228.A N SER 245.A O no hydrogen 2.851 N/A VAL 230.A N TRP 243.A O no hydrogen 3.177 N/A ARG 233.A N GLN 241.A O no hydrogen 2.977 N/A ARG 233.A NH1 GLN 241.A OE1 no hydrogen 3.066 N/A ALA 235.A N THR 239.A O no hydrogen 2.870 N/A THR 239.A N ASP 237.A OD1 no hydrogen 3.086 N/A THR 239.A OG1 ASP 237.A OD1 no hydrogen 2.703 N/A PHE 240.A N PHE 207.A O no hydrogen 2.771 N/A GLN 241.A N ARG 233.A O no hydrogen 2.866 N/A LYS 242.A N ALA 204.A O no hydrogen 3.002 N/A LYS 242.A NZ VAL 230.A O no hydrogen 2.834 N/A LYS 242.A NZ THR 232.A OG1 no hydrogen 2.985 N/A ALA 244.A N CYS 202.A O no hydrogen 2.997 N/A SER 245.A N GLU 228.A O no hydrogen 2.793 N/A VAL 246.A N LEU 200.A O no hydrogen 2.986 N/A VAL 247.A N ASP 226.A O no hydrogen 3.251 N/A VAL 248.A N VAL 198.A O no hydrogen 2.783 N/A LEU 250.A N GLY 196.A O no hydrogen 2.839 N/A GLY 251.A N GLU 253.A OE2 no hydrogen 2.848 N/A LYS 252.A N PRO 249.A O no hydrogen 3.115 N/A GLU 253.A N GLU 253.A OE2 no hydrogen 2.811 N/A ASN 255.A N LYS 252.A O no hydrogen 2.954 N/A TYR 256.A N GLU 253.A O no hydrogen 3.192 N/A THR 257.A N GLN 217.A O no hydrogen 2.964 N/A THR 257.A OG1 GLN 217.A OE1 no hydrogen 2.889 N/A CYS 258.A N LEU 271.A O no hydrogen 2.806 N/A CYS 258.A SG THR 215.A O no hydrogen 3.714 N/A CYS 258.A SG ARG 259.A O no hydrogen 3.833 N/A ARG 259.A N THR 215.A O no hydrogen 2.857 N/A VAL 260.A N LEU 269.A O no hydrogen 2.945 N/A TYR 261.A N THR 213.A O no hydrogen 2.859 N/A HIS 262.A NE2 TYR 208.A O no hydrogen 3.128 N/A LEU 265.A N HIS 262.A O no hydrogen 3.066 N/A LEU 269.A N VAL 260.A O no hydrogen 2.959 N/A LEU 271.A N CYS 258.A O no hydrogen 2.905 N/A ARG 272.A NH1 GLN 254.A O no hydrogen 3.164 N/A