Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3kn5_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 3.A OG ASP 76.A OD1 no hydrogen 3.211 N/A TYR 6.A N SER 3.A O no hydrogen 3.052 N/A GLN 7.A N PRO 4.A O no hydrogen 3.263 N/A GLN 7.A NE2 ASP 2.A O no hydrogen 2.634 N/A HIS 8.A N PHE 5.A O no hydrogen 3.071 N/A TYR 9.A N PHE 5.A O no hydrogen 2.871 N/A TYR 9.A OH GLU 72.A OE1 no hydrogen 2.499 N/A ASP 10.A N VAL 30.A O no hydrogen 2.984 N/A GLY 19.A N CYS 26.A O no hydrogen 3.464 N/A GLY 21.A N SER 24.A O no hydrogen 2.993 N/A ILE 25.A N ILE 42.A O no hydrogen 3.075 N/A CYS 26.A N GLY 19.A O no hydrogen 2.871 N/A CYS 26.A SG VAL 40.A O no hydrogen 3.464 N/A ARG 27.A N VAL 40.A O no hydrogen 2.814 N/A CYS 29.A N PHE 38.A O no hydrogen 2.940 N/A CYS 29.A SG PHE 38.A O no hydrogen 3.977 N/A VAL 30.A N ASP 10.A O no hydrogen 3.176 N/A HIS 31.A N GLN 36.A O no hydrogen 2.622 N/A HIS 31.A ND1 SER 34.A OG no hydrogen 2.766 N/A LYS 32.A N HIS 8.A O no hydrogen 2.840 N/A LYS 32.A NZ TYR 6.A O no hydrogen 2.921 N/A LYS 32.A NZ ASP 10.A OD1 no hydrogen 2.927 N/A SER 34.A N HIS 31.A ND1 no hydrogen 3.250 N/A SER 34.A OG HIS 31.A ND1 no hydrogen 2.766 N/A PHE 38.A N CYS 29.A O no hydrogen 2.882 N/A ALA 39.A N MET 84.A O no hydrogen 3.067 N/A VAL 40.A N ARG 27.A O no hydrogen 2.742 N/A LYS 41.A N LEU 82.A O no hydrogen 2.866 N/A LYS 41.A NZ GLU 54.A OE1 no hydrogen 3.388 N/A LYS 41.A NZ GLU 54.A OE2 no hydrogen 2.809 N/A LYS 41.A NZ ASP 147.A OD1 no hydrogen 3.361 N/A ILE 42.A N ILE 25.A O no hydrogen 2.915 N/A ILE 43.A N THR 80.A O no hydrogen 2.906 N/A SER 44.A N PHE 23.A O no hydrogen 2.968 N/A LYS 45.A N LEU 78.A O no hydrogen 2.803 N/A LYS 45.A NZ ASP 76.A O no hydrogen 3.147 N/A LYS 45.A NZ HIS 79.A O no hydrogen 2.702 N/A LYS 45.A NZ THR 80.A OG1 no hydrogen 2.793 N/A ARG 46.A N SER 44.A OG no hydrogen 3.058 N/A MET 47.A N SER 44.A O no hydrogen 2.836 N/A GLU 48.A N LYS 45.A O no hydrogen 2.960 N/A ASN 50.A ND2 GLY 149.A O no hydrogen 2.904 N/A THR 51.A N MET 47.A O no hydrogen 3.174 N/A GLN 52.A N GLU 48.A O no hydrogen 3.003 N/A GLN 52.A NE2 GLU 48.A OE2 no hydrogen 3.415 N/A LYS 53.A N ALA 49.A O no hydrogen 3.471 N/A LYS 53.A NZ ASN 50.A OD1 no hydrogen 3.122 N/A LYS 53.A NZ GLY 149.A O no hydrogen 2.979 N/A LYS 53.A NZ ALA 151.A O no hydrogen 2.727 N/A GLU 54.A N ASN 50.A O no hydrogen 3.005 N/A ILE 55.A N THR 51.A O no hydrogen 2.827 N/A THR 56.A N GLN 52.A O no hydrogen 3.056 N/A THR 56.A OG1 GLN 52.A O no hydrogen 2.962 N/A ALA 57.A N LYS 53.A O no hydrogen 2.801 N/A LEU 58.A N GLU 54.A O no hydrogen 3.031 N/A LYS 59.A N ILE 55.A O no hydrogen 3.186 N/A LYS 59.A N THR 56.A O no hydrogen 2.824 N/A LEU 60.A N THR 56.A O no hydrogen 2.820 N/A CYS 61.A N ALA 57.A O no hydrogen 3.265 N/A CYS 61.A SG ALA 57.A O no hydrogen 3.403 N/A GLU 62.A N LYS 59.A O no hydrogen 3.406 N/A ASN 66.A ND2 GLU 142.A OE2 no hydrogen 3.431 N/A ASN 66.A ND2 ILE 143.A O no hydrogen 2.974 N/A ILE 67.A N HIS 64.A O no hydrogen 3.218 N/A VAL 68.A N ILE 145.A O no hydrogen 3.003 N/A LYS 69.A N GLU 85.A OE2 no hydrogen 3.060 N/A HIS 71.A N VAL 83.A O no hydrogen 2.754 N/A GLU 72.A N VAL 83.A O no hydrogen 3.455 N/A PHE 74.A N PHE 81.A O no hydrogen 2.873 N/A ASP 76.A N HIS 79.A O no hydrogen 2.938 N/A LEU 78.A N ASP 76.A OD2 no hydrogen 2.694 N/A HIS 79.A N ASP 76.A OD2 no hydrogen 2.711 N/A THR 80.A N ILE 43.A O no hydrogen 2.797 N/A THR 80.A OG1 GLU 48.A OE1 no hydrogen 3.044 N/A PHE 81.A N PHE 74.A O no hydrogen 2.782 N/A LEU 82.A N LYS 41.A O no hydrogen 2.991 N/A VAL 83.A N GLU 72.A O no hydrogen 2.914 N/A MET 84.A N ALA 39.A O no hydrogen 2.830 N/A GLU 85.A N LYS 69.A O no hydrogen 3.299 N/A GLY 89.A N PHE 138.A O no hydrogen 2.751 N/A LEU 92.A N LEU 136.A O no hydrogen 2.948 N/A ARG 95.A N GLU 91.A O no hydrogen 3.035 N/A ILE 96.A N LEU 92.A O no hydrogen 3.039 N/A LYS 97.A N PHE 93.A O no hydrogen 2.925 N/A LYS 97.A NZ GLU 94.A OE2 no hydrogen 3.221 N/A LYS 98.A N ARG 95.A O no hydrogen 2.995 N/A LYS 99.A N ILE 96.A O no hydrogen 3.352 N/A SER 103.A N GLU 106.A OE2 no hydrogen 3.048 N/A SER 103.A OG GLU 106.A OE2 no hydrogen 3.341 N/A ALA 107.A N SER 103.A O no hydrogen 2.888 N/A SER 108.A N GLU 104.A O no hydrogen 2.907 N/A SER 108.A OG TRP 239.A O no hydrogen 2.941 N/A TYR 109.A N THR 105.A O no hydrogen 3.376 N/A ILE 110.A N GLU 106.A O no hydrogen 3.144 N/A MET 111.A N ALA 107.A O no hydrogen 2.910 N/A ARG 112.A N SER 108.A O no hydrogen 2.989 N/A ARG 112.A NH2 LEU 240.A O no hydrogen 3.247 N/A LEU 114.A N ILE 110.A O no hydrogen 3.213 N/A VAL 115.A N MET 111.A O no hydrogen 2.916 N/A SER 116.A N ARG 112.A O no hydrogen 3.044 N/A ALA 117.A N LYS 113.A O no hydrogen 2.837 N/A VAL 118.A N LEU 114.A O no hydrogen 2.835 N/A SER 119.A N VAL 115.A O no hydrogen 2.834 N/A HIS 120.A N SER 116.A O no hydrogen 2.879 N/A MET 121.A N ALA 117.A O no hydrogen 3.004 N/A HIS 122.A N VAL 118.A O no hydrogen 2.948 N/A HIS 122.A NE2 ASP 164.A OD2 no hydrogen 2.647 N/A ASP 123.A N SER 119.A O no hydrogen 2.914 N/A VAL 124.A N HIS 120.A O no hydrogen 3.088 N/A VAL 124.A N MET 121.A O no hydrogen 3.143 N/A GLY 125.A N HIS 122.A O no hydrogen 3.234 N/A VAL 126.A N MET 121.A O no hydrogen 2.865 N/A VAL 127.A N ARG 152.A O no hydrogen 3.122 N/A HIS 128.A N ASP 164.A OD2 no hydrogen 2.976 N/A HIS 128.A NE2 ILE 146.A O no hydrogen 2.978 N/A ARG 129.A N ASP 164.A OD1 no hydrogen 2.760 N/A ARG 129.A NE GLY 158.A O no hydrogen 3.584 N/A ASP 130.A N HIS 128.A ND1 no hydrogen 2.898 N/A LYS 132.A N ASP 130.A O no hydrogen 2.829 N/A ASN 135.A N LYS 132.A O no hydrogen 2.880 N/A LEU 136.A N PRO 133.A O no hydrogen 3.011 N/A LEU 137.A N LYS 144.A O no hydrogen 2.909 N/A PHE 138.A N GLY 90.A O no hydrogen 2.975 N/A THR 139.A N GLU 142.A O no hydrogen 3.054 N/A THR 139.A OG1 GLU 142.A O no hydrogen 3.527 N/A LYS 144.A N LEU 137.A O no hydrogen 2.732 N/A ILE 145.A N ASN 66.A O no hydrogen 2.994 N/A ILE 146.A N ASN 135.A O no hydrogen 3.154 N/A GLY 149.A N ASP 147.A OD1 no hydrogen 3.144 N/A ALA 151.A N PHE 148.A O no hydrogen 3.110 N/A ARG 152.A N VAL 127.A O no hydrogen 2.989 N/A ARG 152.A NE ASN 157.A O no hydrogen 3.099 N/A ARG 152.A NH1 ALA 151.A O no hydrogen 2.965 N/A LYS 154.A N GLY 125.A O no hydrogen 2.955 N/A TYR 159.A OH GLU 161.A OE2 no hydrogen 3.206 N/A SER 162.A N ASP 160.A OD1 no hydrogen 3.414 N/A SER 162.A OG ASP 160.A OD1 no hydrogen 2.961 N/A CYS 163.A N ASP 160.A O no hydrogen 3.166 N/A TRP 166.A N SER 162.A O no hydrogen 2.940 N/A SER 167.A N CYS 163.A O no hydrogen 3.142 N/A SER 167.A OG CYS 163.A O no hydrogen 3.015 N/A LEU 168.A N ASP 164.A O no hydrogen 3.067 N/A GLY 169.A N LEU 165.A O no hydrogen 3.368 N/A VAL 170.A N TRP 166.A O no hydrogen 3.097 N/A ILE 171.A N SER 167.A O no hydrogen 2.818 N/A LEU 172.A N LEU 168.A O no hydrogen 2.922 N/A TYR 173.A N GLY 169.A O no hydrogen 2.887 N/A TYR 173.A OH SER 200.A O no hydrogen 2.907 N/A THR 174.A N VAL 170.A O no hydrogen 3.146 N/A THR 174.A OG1 VAL 170.A O no hydrogen 3.488 N/A THR 174.A OG1 GLN 179.A O no hydrogen 2.869 N/A MET 175.A N ILE 171.A O no hydrogen 2.940 N/A LEU 176.A N LEU 172.A O no hydrogen 3.089 N/A SER 177.A N TYR 173.A O no hydrogen 3.218 N/A SER 177.A N THR 174.A O no hydrogen 3.270 N/A SER 177.A OG TYR 173.A O no hydrogen 2.905 N/A GLY 178.A N THR 174.A O no hydrogen 2.631 N/A GLN 179.A N SER 177.A OG no hydrogen 2.989 N/A GLN 183.A N VAL 180.A O no hydrogen 3.135 N/A ILE 190.A N SER 186.A O no hydrogen 2.906 N/A MET 191.A N ALA 187.A O no hydrogen 3.097 N/A LYS 192.A N VAL 188.A O no hydrogen 3.093 N/A LYS 192.A NZ GLU 189.A OE1 no hydrogen 2.680 N/A LYS 193.A N GLU 189.A O no hydrogen 3.132 N/A ILE 194.A N ILE 190.A O no hydrogen 2.769 N/A LYS 195.A N MET 191.A O no hydrogen 2.899 N/A LYS 196.A N LYS 192.A O no hydrogen 3.337 N/A GLY 197.A N ILE 194.A O no hydrogen 2.890 N/A ASP 198.A N LYS 193.A O no hydrogen 2.671 N/A PHE 199.A N GLY 197.A O no hydrogen 3.053 N/A TRP 206.A N GLY 203.A O no hydrogen 3.257 N/A LYS 207.A N GLU 204.A O no hydrogen 3.233 N/A VAL 209.A N TRP 206.A O no hydrogen 3.222 N/A SER 210.A N GLU 104.A OE2 no hydrogen 2.754 N/A SER 210.A OG GLU 104.A OE1 no hydrogen 2.802 N/A SER 210.A OG GLU 104.A OE2 no hydrogen 3.155 N/A GLN 211.A NE2 ASP 215.A OD1 no hydrogen 2.859 N/A LYS 214.A N SER 210.A O no hydrogen 3.521 N/A LYS 214.A NZ TRP 206.A O no hydrogen 3.036 N/A LYS 214.A NZ VAL 209.A O no hydrogen 2.442 N/A ASP 215.A N GLN 211.A O no hydrogen 2.902 N/A LEU 216.A N GLU 212.A O no hydrogen 2.947 N/A ILE 217.A N ALA 213.A O no hydrogen 2.934 N/A GLN 218.A N LYS 214.A O no hydrogen 2.955 N/A GLY 219.A N ASP 215.A O no hydrogen 3.141 N/A LEU 220.A N LEU 216.A O no hydrogen 3.328 N/A LEU 220.A N ILE 217.A O no hydrogen 3.017 N/A LEU 221.A N ILE 217.A O no hydrogen 2.850 N/A THR 222.A N GLN 218.A O no hydrogen 3.246 N/A ASN 226.A N ASP 224.A OD2 no hydrogen 3.098 N/A LYS 227.A NZ GLN 218.A OE1 no hydrogen 3.206 N/A ARG 228.A N ASP 224.A O no hydrogen 2.873 N/A LEU 229.A N GLY 219.A O no hydrogen 2.695 N/A SER 232.A OG SER 232.A O no hydrogen 2.545 N/A LEU 234.A N MET 231.A O no hydrogen 2.685 N/A ARG 235.A N MET 231.A O no hydrogen 3.112 N/A ASN 237.A N LEU 234.A O no hydrogen 3.118 N/A TRP 239.A NE1 GLU 104.A OE1 no hydrogen 2.831 N/A LEU 240.A N ASN 237.A O no hydrogen 2.996 N/A GLN 241.A N GLU 238.A O no hydrogen 3.236 N/A GLN 241.A NE2 ARG 235.A O no hydrogen 2.810 N/A GLN 241.A NE2 ASN 237.A O no hydrogen 2.620 N/A SER 244.A N GLN 241.A O no hydrogen 3.345 N/A SER 244.A OG GLU 238.A O no hydrogen 2.568 N/A GLN 245.A NE2 GLY 243.A O no hydrogen 3.639 N/A ASN 249.A N SER 247.A OG no hydrogen 3.023 N/A LEU 251.A N PHE 102.A O no hydrogen 2.619 N/A THR 253.A OG1 MET 175.A O no hydrogen 3.434 N/A ILE 256.A N MET 252.A O no hydrogen 3.117 N/A LEU 257.A N THR 253.A O no hydrogen 2.958 N/A GLY 258.A N PRO 254.A O no hydrogen 3.229 N/A SER 259.A N ASP 255.A O no hydrogen 3.136 N/A SER 259.A OG ASP 255.A O no hydrogen 3.296 N/A SER 259.A OG ILE 256.A O no hydrogen 2.801 N/A SER 260.A N LEU 257.A O no hydrogen 3.199 N/A HIS 265.A N GLY 261.A O no hydrogen 2.988 N/A THR 266.A N ALA 262.A O no hydrogen 3.394 N/A THR 266.A OG1 ALA 262.A O no hydrogen 3.298 N/A THR 266.A OG1 ALA 263.A O no hydrogen 3.143 N/A CYS 267.A N ALA 263.A O no hydrogen 2.988 N/A CYS 267.A SG GLN 183.A O no hydrogen 3.842 N/A VAL 268.A N VAL 264.A O no hydrogen 2.866 N/A LYS 269.A N HIS 265.A O no hydrogen 3.081 N/A ALA 270.A N THR 266.A O no hydrogen 2.783 N/A THR 271.A N CYS 267.A O no hydrogen 3.069 N/A THR 271.A OG1 CYS 267.A O no hydrogen 3.039 N/A PHE 272.A N VAL 268.A O no hydrogen 3.084 N/A HIS 273.A N LYS 269.A O no hydrogen 3.210 N/A ALA 274.A N ALA 270.A O no hydrogen 2.977 N/A PHE 275.A N THR 271.A O no hydrogen 3.083 N/A ASN 276.A N PHE 272.A O no hydrogen 3.174 N/A LYS 277.A N HIS 273.A O no hydrogen 3.035 N/A TYR 278.A N ALA 274.A O no hydrogen 3.085 N/A LYS 279.A N PHE 275.A O no hydrogen 3.005 N/A ARG 280.A N LYS 277.A O no hydrogen 2.898 N/A