Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3h21_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 1.A NZ GLU 240.A OE1 no hydrogen 3.311 N/A TRP 2.A N ASN 16.A OD1 no hydrogen 2.748 N/A TRP 2.A NE1 GLU 240.A OE1 no hydrogen 2.961 N/A LEU 6.A N LEU 13.A O no hydrogen 2.948 N/A ARG 7.A NE THR 12.A OG1 no hydrogen 3.184 N/A ARG 7.A NH2 GLY 9.A O no hydrogen 2.744 N/A ARG 7.A NH2 THR 12.A OG1 no hydrogen 3.077 N/A CYS 8.A N TYR 11.A O no hydrogen 2.864 N/A TYR 11.A N CYS 8.A O no hydrogen 3.080 N/A LEU 13.A N LEU 6.A O no hydrogen 2.848 N/A ASN 16.A N ASN 14.A OD1 no hydrogen 2.563 N/A ASN 16.A ND2 TRP 2.A O no hydrogen 2.754 N/A GLU 17.A N ASN 14.A OD1 no hydrogen 2.924 N/A LYS 18.A NZ HIS 57.A NE2 no hydrogen 3.074 N/A THR 19.A N ASP 258.A OD1 no hydrogen 2.907 N/A THR 19.A OG1 ASP 258.A OD1 no hydrogen 3.423 N/A THR 19.A OG1 ASP 258.A OD2 no hydrogen 2.465 N/A LEU 20.A N GLU 240.A O no hydrogen 2.894 N/A ILE 21.A N HIS 57.A ND1 no hydrogen 2.784 N/A MET 22.A N VAL 242.A O no hydrogen 2.882 N/A GLY 23.A N ILE 58.A O no hydrogen 2.845 N/A ILE 24.A N VAL 244.A O no hydrogen 2.926 N/A LEU 25.A N ASP 60.A O no hydrogen 2.871 N/A ASN 26.A N HIS 47.A ND1 no hydrogen 3.351 N/A SER 33.A N ASP 30.A O no hydrogen 3.090 N/A SER 33.A OG SER 37.A OG no hydrogen 2.963 N/A SER 33.A OG GLU 40.A OE1 no hydrogen 2.808 N/A GLY 35.A N SER 33.A OG no hydrogen 3.107 N/A SER 37.A OG SER 33.A OG no hydrogen 2.963 N/A VAL 41.A N SER 37.A O no hydrogen 3.065 N/A ASP 42.A N TYR 38.A O no hydrogen 2.887 N/A ALA 43.A N ASN 39.A O no hydrogen 3.031 N/A ALA 44.A N GLU 40.A O no hydrogen 2.989 N/A VAL 45.A N VAL 41.A O no hydrogen 2.973 N/A ARG 46.A N ASP 42.A O no hydrogen 2.948 N/A ARG 46.A NE ASP 42.A OD2 no hydrogen 3.295 N/A HIS 47.A N ALA 43.A O no hydrogen 2.860 N/A ALA 48.A N ALA 44.A O no hydrogen 2.936 N/A LYS 49.A N VAL 45.A O no hydrogen 2.969 N/A GLU 50.A N ARG 46.A O no hydrogen 3.033 N/A MET 51.A N HIS 47.A O no hydrogen 2.943 N/A ARG 52.A N ALA 48.A O no hydrogen 2.809 N/A ARG 52.A NH1 ASP 53.A OD1 no hydrogen 2.689 N/A ASP 53.A N LYS 49.A O no hydrogen 2.889 N/A GLU 54.A N GLU 50.A O no hydrogen 2.902 N/A GLU 54.A N MET 51.A O no hydrogen 3.223 N/A GLY 55.A N ARG 52.A O no hydrogen 3.299 N/A ALA 56.A N MET 51.A O no hydrogen 3.046 N/A HIS 57.A N ILE 21.A O no hydrogen 2.803 N/A ILE 58.A N ILE 21.A O no hydrogen 3.235 N/A ILE 59.A N PRO 86.A O no hydrogen 2.883 N/A ASP 60.A N GLY 23.A O no hydrogen 2.930 N/A ILE 61.A N SER 88.A O no hydrogen 2.976 N/A GLU 68.A N SER 64.A O no hydrogen 2.800 N/A ILE 69.A N VAL 65.A O no hydrogen 3.322 N/A LYS 70.A N GLU 66.A O no hydrogen 3.258 N/A LYS 70.A NZ ASP 34.A OD2 no hydrogen 3.484 N/A ARG 71.A N GLU 67.A O no hydrogen 3.091 N/A VAL 72.A N GLU 68.A O no hydrogen 2.975 N/A VAL 73.A N ILE 69.A O no hydrogen 2.893 N/A ILE 76.A N VAL 72.A O no hydrogen 2.974 N/A GLN 77.A N VAL 73.A O no hydrogen 2.978 N/A ALA 78.A N PRO 74.A O no hydrogen 3.031 N/A VAL 79.A N MET 75.A O no hydrogen 2.926 N/A SER 80.A N ILE 76.A O no hydrogen 2.865 N/A SER 80.A OG ILE 76.A O no hydrogen 2.829 N/A SER 80.A OG GLN 77.A O no hydrogen 3.309 N/A LYS 81.A N GLN 77.A O no hydrogen 3.268 N/A GLU 82.A N ALA 78.A O no hydrogen 2.902 N/A VAL 83.A N VAL 79.A O no hydrogen 2.548 N/A SER 88.A N ILE 59.A O no hydrogen 2.874 N/A SER 88.A OG ASP 60.A OD2 no hydrogen 2.578 N/A ILE 89.A N ILE 107.A O no hydrogen 2.838 N/A ASP 90.A N ILE 61.A O no hydrogen 2.903 N/A THR 91.A N ILE 89.A O no hydrogen 3.202 N/A THR 91.A OG1 GLU 68.A OE1 no hydrogen 3.134 N/A LYS 93.A N THR 91.A OG1 no hydrogen 3.195 N/A ALA 94.A N GLU 117.A OE1 no hydrogen 2.914 N/A ALA 97.A N LYS 93.A O no hydrogen 3.011 N/A LYS 98.A N ALA 94.A O no hydrogen 2.979 N/A LYS 98.A NZ GLU 95.A OE2 no hydrogen 3.271 N/A GLN 99.A N GLU 95.A O no hydrogen 3.016 N/A GLN 99.A NE2 GLU 95.A OE2 no hydrogen 2.586 N/A ALA 100.A N VAL 96.A O no hydrogen 2.850 N/A ILE 101.A N ALA 97.A O no hydrogen 3.001 N/A GLU 102.A N LYS 98.A O no hydrogen 3.062 N/A ALA 103.A N GLN 99.A O no hydrogen 2.638 N/A GLY 104.A N ILE 101.A O no hydrogen 2.978 N/A ALA 105.A N ALA 100.A O no hydrogen 2.706 N/A HIS 106.A N ILE 87.A O no hydrogen 2.693 N/A ILE 107.A N ILE 87.A O no hydrogen 3.138 N/A ILE 108.A N PRO 130.A O no hydrogen 2.921 N/A ASN 109.A N ILE 89.A O no hydrogen 2.833 N/A ASN 109.A ND2 ASP 60.A OD1 no hydrogen 3.542 N/A ASN 109.A ND2 ASP 60.A OD2 no hydrogen 3.276 N/A ASP 110.A N ILE 132.A O no hydrogen 3.030 N/A TRP 112.A N ASP 110.A OD2 no hydrogen 2.718 N/A GLY 113.A N ASP 110.A O no hydrogen 2.987 N/A ALA 114.A N ASP 110.A OD1 no hydrogen 2.829 N/A LYS 115.A N TRP 112.A O no hydrogen 3.075 N/A LYS 115.A NZ ASP 152.A O no hydrogen 2.963 N/A ILE 120.A N GLU 117.A O no hydrogen 2.801 N/A ALA 121.A N PRO 118.A O no hydrogen 2.950 N/A VAL 123.A N LYS 119.A O no hydrogen 3.033 N/A ALA 124.A N ILE 120.A O no hydrogen 2.913 N/A ALA 125.A N ALA 121.A O no hydrogen 2.758 N/A HIS 126.A N GLU 122.A O no hydrogen 2.933 N/A TYR 127.A N VAL 123.A O no hydrogen 3.137 N/A TYR 127.A OH GLU 102.A OE2 no hydrogen 3.288 N/A ASP 128.A N ALA 124.A O no hydrogen 2.924 N/A VAL 129.A N ALA 124.A O no hydrogen 3.340 N/A ILE 131.A N ASN 169.A O no hydrogen 2.796 N/A ILE 132.A N ILE 108.A O no hydrogen 2.856 N/A LEU 133.A N ILE 171.A O no hydrogen 2.854 N/A MET 134.A N ASP 110.A O no hydrogen 3.321 N/A HIS 135.A N ASP 173.A O no hydrogen 2.725 N/A HIS 135.A NE2 ASP 152.A OD2 no hydrogen 2.786 N/A ASN 136.A ND2 ILE 111.A O no hydrogen 2.663 N/A ARG 137.A N ASN 136.A OD1 no hydrogen 2.888 N/A ARG 137.A NE ASP 152.A OD2 no hydrogen 3.000 N/A ARG 137.A NH1 ASN 139.A OD1 no hydrogen 2.926 N/A ARG 137.A NH2 ASP 152.A OD2 no hydrogen 3.152 N/A ASN 139.A ND2 ASP 138.A OD1 no hydrogen 2.982 N/A ASN 141.A N ASN 139.A OD1 no hydrogen 2.853 N/A TYR 142.A OH ALA 179.A O no hydrogen 2.727 N/A ASN 144.A N ASP 148.A OD2 no hydrogen 3.231 N/A ASP 148.A N ASN 144.A O no hydrogen 2.812 N/A MET 149.A N LEU 145.A O no hydrogen 2.775 N/A ILE 150.A N MET 146.A O no hydrogen 3.066 N/A ALA 151.A N ALA 147.A O no hydrogen 2.899 N/A ASP 152.A N ASP 148.A O no hydrogen 2.728 N/A LEU 153.A N MET 149.A O no hydrogen 2.746 N/A TYR 154.A N ILE 150.A O no hydrogen 2.891 N/A ASP 155.A N ALA 151.A O no hydrogen 2.823 N/A SER 156.A N ASP 152.A O no hydrogen 3.221 N/A SER 156.A N LEU 153.A O no hydrogen 2.856 N/A SER 156.A OG GLY 113.A O no hydrogen 2.780 N/A ILE 157.A N LEU 153.A O no hydrogen 2.960 N/A LYS 158.A N TYR 154.A O no hydrogen 2.941 N/A LYS 158.A NZ ASP 162.A OD1 no hydrogen 2.962 N/A LYS 158.A NZ ASP 162.A OD2 no hydrogen 3.146 N/A ILE 159.A N ASP 155.A O no hydrogen 3.349 N/A ALA 160.A N SER 156.A O no hydrogen 2.941 N/A LYS 161.A N ILE 157.A O no hydrogen 2.786 N/A LYS 161.A NZ ASP 167.A OD1 no hydrogen 2.872 N/A LYS 161.A NZ ASP 167.A OD2 no hydrogen 2.985 N/A ASP 162.A N LYS 158.A O no hydrogen 2.894 N/A ALA 163.A N ALA 160.A O no hydrogen 3.188 N/A GLY 164.A N LYS 161.A O no hydrogen 2.947 N/A VAL 165.A N ALA 160.A O no hydrogen 2.982 N/A ARG 166.A NE ASP 128.A OD1 no hydrogen 3.419 N/A ASN 169.A N ARG 166.A O no hydrogen 2.752 N/A ILE 170.A N ASP 167.A O no hydrogen 3.045 N/A ILE 171.A N ILE 131.A O no hydrogen 3.045 N/A LEU 172.A N PRO 201.A O no hydrogen 2.804 N/A ASP 173.A N LEU 133.A O no hydrogen 3.017 N/A GLY 175.A N ASP 173.A OD2 no hydrogen 2.688 N/A GLY 177.A N ASN 185.A OD1 no hydrogen 2.738 N/A PHE 178.A N GLY 175.A O no hydrogen 3.146 N/A LYS 180.A NZ HIS 135.A ND1 no hydrogen 2.919 N/A LYS 180.A NZ PRO 174.A O no hydrogen 3.188 N/A LYS 180.A NZ GLY 175.A O no hydrogen 2.951 N/A LYS 180.A NZ PHE 178.A O no hydrogen 2.757 N/A THR 181.A N GLN 184.A OE1 no hydrogen 3.005 N/A GLN 184.A N THR 181.A OG1 no hydrogen 3.257 N/A ASN 185.A N THR 181.A O no hydrogen 3.007 N/A ASN 185.A ND2 LYS 180.A O no hydrogen 3.476 N/A LEU 186.A N PRO 182.A O no hydrogen 3.333 N/A GLU 187.A N GLU 183.A O no hydrogen 3.069 N/A ALA 188.A N GLN 184.A O no hydrogen 2.859 N/A MET 189.A N ASN 185.A O no hydrogen 2.997 N/A ARG 190.A N LEU 186.A O no hydrogen 2.954 N/A ASN 191.A N GLU 187.A O no hydrogen 3.078 N/A ASN 191.A N ALA 188.A O no hydrogen 3.176 N/A ASN 191.A ND2 GLU 187.A O no hydrogen 2.719 N/A LEU 192.A N MET 189.A O no hydrogen 3.512 N/A GLU 193.A N GLU 193.A OE2 no hydrogen 2.722 N/A GLN 194.A N ASN 191.A O no hydrogen 3.067 N/A LEU 195.A N LEU 192.A O no hydrogen 2.967 N/A ASN 196.A N GLU 193.A O no hydrogen 3.148 N/A ASN 196.A ND2 LYS 237.A O no hydrogen 3.120 N/A VAL 197.A N GLN 194.A O no hydrogen 3.305 N/A LEU 198.A N LEU 195.A O no hydrogen 3.203 N/A GLY 199.A N ASN 196.A O no hydrogen 2.977 N/A TYR 200.A OH ASP 167.A OD1 no hydrogen 2.848 N/A VAL 202.A N GLU 240.A OE2 no hydrogen 2.840 N/A LEU 203.A N LEU 172.A O no hydrogen 2.856 N/A LEU 204.A N PHE 241.A O no hydrogen 2.938 N/A THR 206.A OG1 THR 230.A OG1 no hydrogen 2.442 N/A SER 207.A OG HIS 245.A ND1 no hydrogen 2.772 N/A ARG 208.A N THR 227.A OG1 no hydrogen 2.905 N/A ARG 208.A NE ASP 246.A OD1 no hydrogen 3.425 N/A ARG 208.A NH2 ASP 246.A OD2 no hydrogen 2.741 N/A LYS 209.A N THR 206.A O no hydrogen 3.143 N/A LYS 209.A NZ ILE 176.A O no hydrogen 2.503 N/A LYS 209.A NZ GLY 205.A O no hydrogen 2.586 N/A ILE 212.A N LYS 209.A O no hydrogen 3.178 N/A HIS 214.A N SER 210.A O no hydrogen 2.812 N/A VAL 215.A N PHE 211.A O no hydrogen 3.126 N/A VAL 215.A N ILE 212.A O no hydrogen 3.256 N/A LEU 216.A N ILE 212.A O no hydrogen 2.888 N/A ASP 217.A N GLY 213.A O no hydrogen 2.678 N/A GLU 221.A N GLU 221.A OE1 no hydrogen 2.996 N/A GLU 222.A N PRO 219.A O no hydrogen 2.766 N/A ARG 223.A NE LEU 218.A O no hydrogen 2.954 N/A ARG 223.A NH1 ARG 208.A O no hydrogen 2.917 N/A ARG 223.A NH2 LEU 218.A O no hydrogen 2.738 N/A GLU 225.A N GLU 225.A OE1 no hydrogen 2.842 N/A THR 227.A N ARG 223.A O no hydrogen 2.956 N/A THR 227.A OG1 ARG 223.A O no hydrogen 2.854 N/A GLY 228.A N LEU 224.A O no hydrogen 2.995 N/A ALA 229.A N GLU 225.A O no hydrogen 3.154 N/A THR 230.A N GLY 226.A O no hydrogen 3.237 N/A THR 230.A OG1 THR 206.A OG1 no hydrogen 2.442 N/A THR 230.A OG1 THR 227.A O no hydrogen 2.797 N/A VAL 231.A N THR 227.A O no hydrogen 3.001 N/A CYS 232.A N GLY 228.A O no hydrogen 3.008 N/A CYS 232.A SG GLY 228.A O no hydrogen 3.291 N/A LEU 233.A N ALA 229.A O no hydrogen 2.991 N/A GLY 234.A N THR 230.A O no hydrogen 2.959 N/A ILE 235.A N VAL 231.A O no hydrogen 2.939 N/A GLU 236.A N CYS 232.A O no hydrogen 2.852 N/A LYS 237.A N LEU 233.A O no hydrogen 3.094 N/A LYS 237.A NZ ARG 190.A O no hydrogen 2.918 N/A LYS 237.A NZ GLU 193.A OE2 no hydrogen 2.692 N/A GLY 238.A N ILE 235.A O no hydrogen 2.957 N/A CYS 239.A N GLY 234.A O no hydrogen 3.063 N/A CYS 239.A SG.A PHE 241.A O no hydrogen 3.673 N/A CYS 239.A SG.B GLY 234.A O no hydrogen 3.430 N/A GLU 240.A N VAL 202.A O no hydrogen 2.859 N/A PHE 241.A N VAL 202.A O no hydrogen 3.222 N/A VAL 242.A N LEU 20.A O no hydrogen 2.897 N/A ARG 243.A N LEU 204.A O no hydrogen 2.897 N/A ARG 243.A NE ASP 60.A OD1 no hydrogen 3.073 N/A ARG 243.A NH2 ASP 60.A OD1 no hydrogen 3.204 N/A VAL 244.A N MET 22.A O no hydrogen 2.922 N/A HIS 245.A N SER 207.A OG no hydrogen 3.127 N/A HIS 245.A ND1 SER 207.A OG no hydrogen 2.772 N/A VAL 247.A N HIS 245.A O no hydrogen 2.977 N/A GLU 249.A N GLU 249.A OE1 no hydrogen 2.552 N/A MET 250.A N ASP 246.A O no hydrogen 3.117 N/A SER 251.A N VAL 247.A O no hydrogen 2.933 N/A SER 251.A OG GLU 54.A O no hydrogen 3.437 N/A ARG 252.A N LYS 248.A O no hydrogen 3.307 N/A MET 253.A N GLU 249.A O no hydrogen 2.962 N/A ALA 254.A N MET 250.A O no hydrogen 2.723 N/A LYS 255.A N SER 251.A O no hydrogen 3.185 N/A MET 256.A N ARG 252.A O no hydrogen 3.085 N/A MET 257.A N MET 253.A O no hydrogen 2.880 N/A ASP 258.A N ALA 254.A O no hydrogen 2.776 N/A ALA 259.A N LYS 255.A O no hydrogen 3.156 N/A MET 260.A N MET 256.A O no hydrogen 3.114 N/A ILE 261.A N MET 257.A O no hydrogen 2.900 N/A LYS 263.A N ASP 258.A O no hydrogen 2.978 N/A LYS 263.A NZ THR 19.A OG1 no hydrogen 3.160 N/A LYS 263.A NZ CYS 239.A O no hydrogen 2.594 N/A