Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1zk3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N GLU 29.A OE1 no hydrogen 2.997 N/A SER 1.A N GLU 29.A OE2 no hydrogen 3.411 N/A ARG 3.A N GLU 29.A OE1 no hydrogen 2.897 N/A ARG 3.A NE GLU 233.A OE2 no hydrogen 2.736 N/A ARG 3.A NH2 GLU 233.A OE1 no hydrogen 2.877 N/A ARG 3.A NH2 GLU 233.A OE2 no hydrogen 3.563 N/A LEU 4.A N GLU 29.A O no hydrogen 3.000 N/A LYS 7.A N LEU 4.A O no hydrogen 2.995 N/A LYS 7.A NZ LEU 133.A O no hydrogen 3.042 N/A LYS 7.A NZ GLY 134.A O no hydrogen 2.908 N/A VAL 8.A N SER 84.A OG no hydrogen 3.080 N/A ALA 9.A N LYS 32.A O no hydrogen 2.802 N/A ILE 10.A N THR 85.A O no hydrogen 2.826 N/A ILE 11.A N MET 34.A O no hydrogen 2.900 N/A THR 12.A N VAL 87.A O no hydrogen 3.116 N/A THR 12.A OG1 VAL 87.A O no hydrogen 3.467 N/A GLY 13.A N THR 36.A OG1 no hydrogen 3.312 N/A GLY 14.A N THR 36.A O no hydrogen 3.077 N/A THR 15.A OG1 ASP 37.A OD2 no hydrogen 2.707 N/A LEU 20.A N LEU 16.A O no hydrogen 3.078 N/A ALA 21.A N GLY 17.A O no hydrogen 3.032 N/A ILE 22.A N ILE 18.A O no hydrogen 2.931 N/A ALA 23.A N GLY 19.A O no hydrogen 3.057 N/A THR 24.A N LEU 20.A O no hydrogen 2.923 N/A THR 24.A OG1 LEU 20.A O no hydrogen 2.846 N/A LYS 25.A N ALA 21.A O no hydrogen 2.974 N/A LYS 25.A NZ TYR 224.A OH no hydrogen 3.183 N/A PHE 26.A N ILE 22.A O no hydrogen 2.818 N/A VAL 27.A N ALA 23.A O no hydrogen 3.020 N/A GLU 28.A N THR 24.A O no hydrogen 2.996 N/A GLU 29.A N LYS 25.A O no hydrogen 2.891 N/A GLU 29.A N PHE 26.A O no hydrogen 2.848 N/A GLY 30.A N VAL 27.A O no hydrogen 2.861 N/A ALA 31.A N PHE 26.A O no hydrogen 3.082 N/A LYS 32.A N LYS 7.A O no hydrogen 2.887 N/A VAL 33.A N GLN 55.A O no hydrogen 2.746 N/A MET 34.A N ALA 9.A O no hydrogen 3.003 N/A ILE 35.A N GLN 57.A O no hydrogen 2.942 N/A THR 36.A N ILE 11.A O no hydrogen 2.967 N/A HIS 39.A N ASP 37.A OD1 no hydrogen 3.272 N/A ALA 46.A N VAL 42.A O no hydrogen 2.649 N/A ALA 47.A N GLY 43.A O no hydrogen 3.083 N/A LYS 48.A N GLU 44.A O no hydrogen 2.939 N/A SER 49.A N LYS 45.A O no hydrogen 2.973 N/A SER 49.A OG LYS 45.A O no hydrogen 3.376 N/A SER 49.A OG ALA 46.A O no hydrogen 2.656 N/A VAL 50.A N ALA 47.A O no hydrogen 2.976 N/A GLY 51.A N ALA 47.A O no hydrogen 3.012 N/A THR 52.A N GLN 55.A OE1 no hydrogen 2.962 N/A THR 52.A OG1 ASP 54.A OD1 no hydrogen 2.387 N/A GLN 55.A N THR 52.A O no hydrogen 2.811 N/A ILE 56.A N THR 52.A O no hydrogen 3.001 N/A GLN 57.A N VAL 33.A O no hydrogen 2.835 N/A GLN 57.A NE2 PRO 53.A O no hydrogen 2.857 N/A PHE 59.A N ILE 35.A O no hydrogen 2.953 N/A HIS 61.A N ASP 37.A O no hydrogen 2.894 N/A HIS 61.A NE2 ASP 65.A O no hydrogen 3.085 N/A SER 64.A N ASP 62.A OD1 no hydrogen 2.796 N/A SER 64.A OG ASP 62.A OD1 no hydrogen 2.453 N/A ASP 65.A N ASP 62.A O no hydrogen 2.722 N/A GLY 68.A N ASP 65.A OD1 no hydrogen 3.277 N/A TRP 69.A N GLU 66.A O no hydrogen 3.116 N/A TRP 69.A NE1 SER 63.A O no hydrogen 2.801 N/A THR 70.A N ASP 67.A O no hydrogen 3.102 N/A LEU 72.A N GLY 68.A O no hydrogen 2.805 N/A PHE 73.A N TRP 69.A O no hydrogen 3.052 N/A ASP 74.A N THR 70.A O no hydrogen 3.007 N/A ALA 75.A N LYS 71.A O no hydrogen 2.894 N/A THR 76.A N LEU 72.A O no hydrogen 3.054 N/A THR 76.A OG1 LEU 72.A O no hydrogen 2.805 N/A GLU 77.A N PHE 73.A O no hydrogen 2.900 N/A LYS 78.A N ASP 74.A O no hydrogen 2.815 N/A ALA 79.A N ALA 75.A O no hydrogen 3.066 N/A ALA 79.A N THR 76.A O no hydrogen 3.191 N/A PHE 80.A N THR 76.A O no hydrogen 2.853 N/A GLY 81.A N GLU 77.A O no hydrogen 2.701 N/A SER 84.A N VAL 8.A O no hydrogen 2.868 N/A SER 84.A OG VAL 8.A O no hydrogen 3.365 N/A SER 84.A OG THR 85.A OG1 no hydrogen 3.064 N/A THR 85.A N VAL 8.A O no hydrogen 3.033 N/A THR 85.A OG1 SER 84.A OG no hydrogen 3.064 N/A LEU 86.A N SER 136.A O no hydrogen 3.015 N/A VAL 87.A N ILE 10.A O no hydrogen 2.811 N/A ASN 88.A N ILE 138.A O no hydrogen 2.890 N/A ASN 88.A ND2 ASN 139.A OD1 no hydrogen 2.709 N/A ASN 89.A N THR 12.A OG1 no hydrogen 2.933 N/A ALA 90.A N THR 12.A OG1 no hydrogen 2.873 N/A ILE 92.A N ASN 113.A OD1 no hydrogen 2.838 N/A ASN 95.A ND2 SER 151.A O no hydrogen 3.254 N/A LYS 96.A NZ GLU 100.A O no hydrogen 3.071 N/A LYS 96.A NZ GLU 105.A OE1 no hydrogen 2.876 N/A LYS 96.A NZ GLU 105.A OE2 no hydrogen 2.858 N/A GLU 100.A N SER 97.A O no hydrogen 3.190 N/A GLU 100.A N SER 97.A OG no hydrogen 3.207 N/A THR 101.A N VAL 98.A O no hydrogen 3.269 N/A THR 101.A OG1 SER 97.A O no hydrogen 2.535 N/A THR 102.A N GLU 105.A OE2 no hydrogen 3.003 N/A GLU 105.A N THR 102.A OG1 no hydrogen 3.085 N/A TRP 106.A N THR 102.A O no hydrogen 2.884 N/A ARG 107.A N THR 103.A O no hydrogen 2.918 N/A LYS 108.A N ALA 104.A O no hydrogen 2.937 N/A LEU 109.A N GLU 105.A O no hydrogen 2.971 N/A LEU 110.A N TRP 106.A O no hydrogen 3.123 N/A ALA 111.A N ARG 107.A O no hydrogen 2.902 N/A ASN 113.A N LEU 109.A O no hydrogen 2.874 N/A ASN 113.A ND2 ILE 92.A O no hydrogen 2.933 N/A ASN 113.A ND2 SER 158.A OG no hydrogen 3.197 N/A LEU 114.A N LEU 110.A O no hydrogen 2.761 N/A ASP 115.A N LEU 110.A O no hydrogen 2.785 N/A GLY 116.A N ALA 111.A O no hydrogen 2.951 N/A PHE 118.A N LEU 114.A O no hydrogen 2.871 N/A PHE 119.A N ASP 115.A O no hydrogen 2.759 N/A GLY 120.A N GLY 116.A O no hydrogen 3.024 N/A THR 121.A N VAL 117.A O no hydrogen 2.860 N/A THR 121.A OG1 VAL 117.A O no hydrogen 2.753 N/A THR 121.A OG1 ASN 139.A OD1 no hydrogen 3.436 N/A ARG 122.A N PHE 118.A O no hydrogen 2.825 N/A ARG 122.A NH2 GLU 66.A OE2 no hydrogen 2.801 N/A LEU 123.A N PHE 119.A O no hydrogen 3.060 N/A GLY 124.A N GLY 120.A O no hydrogen 2.738 N/A ILE 125.A N THR 121.A O no hydrogen 2.975 N/A GLN 126.A N ARG 122.A O no hydrogen 3.279 N/A ARG 127.A N LEU 123.A O no hydrogen 2.884 N/A ARG 127.A NH2 ASP 74.A OD1 no hydrogen 2.571 N/A MET 128.A N GLY 124.A O no hydrogen 2.773 N/A LYS 129.A N ILE 125.A O no hydrogen 3.172 N/A LYS 129.A NZ TYR 178.A OH no hydrogen 3.325 N/A ASN 130.A N TYR 178.A O no hydrogen 2.848 N/A ASN 130.A ND2 ASP 177.A O no hydrogen 3.135 N/A LYS 131.A NZ ARG 127.A O no hydrogen 2.803 N/A GLY 134.A N ASP 179.A OD2 no hydrogen 2.932 N/A ALA 135.A N ASP 179.A O no hydrogen 3.208 N/A SER 136.A N SER 84.A O no hydrogen 2.920 N/A SER 136.A OG LEU 229.A O no hydrogen 2.757 N/A ILE 137.A N ARG 181.A O no hydrogen 2.822 N/A ILE 138.A N LEU 86.A O no hydrogen 2.724 N/A ASN 139.A N ASN 183.A O no hydrogen 2.903 N/A ASN 139.A ND2 THR 121.A OG1 no hydrogen 3.217 N/A ASN 139.A ND2 SER 166.A OG no hydrogen 2.905 N/A MET 140.A N ASN 88.A O no hydrogen 2.918 N/A SER 141.A N VAL 185.A O no hydrogen 2.579 N/A SER 141.A OG LYS 159.A O no hydrogen 3.462 N/A ILE 143.A N PRO 187.A O no hydrogen 3.126 N/A GLU 144.A N SER 142.A OG no hydrogen 2.870 N/A GLY 145.A N SER 142.A O no hydrogen 2.974 N/A PHE 146.A N ILE 143.A O no hydrogen 2.783 N/A VAL 147.A N ILE 143.A O no hydrogen 2.998 N/A ASP 149.A N ASN 156.A OD1 no hydrogen 2.891 N/A SER 151.A N ASP 149.A OD1 no hydrogen 2.864 N/A LEU 152.A N ASP 149.A O no hydrogen 3.064 N/A GLY 153.A N LYS 96.A O no hydrogen 3.109 N/A ASN 156.A N LEU 152.A O no hydrogen 2.671 N/A ASN 156.A ND2 GLU 144.A O no hydrogen 2.899 N/A ASN 156.A ND2 GLU 144.A OE1 no hydrogen 3.254 N/A ALA 157.A N GLY 153.A O no hydrogen 3.093 N/A SER 158.A N ALA 154.A O no hydrogen 2.992 N/A SER 158.A OG TYR 155.A O no hydrogen 2.887 N/A LYS 159.A N TYR 155.A O no hydrogen 2.986 N/A LYS 159.A NZ MET 140.A O no hydrogen 3.396 N/A GLY 160.A N ASN 156.A O no hydrogen 2.920 N/A ALA 161.A N ALA 157.A O no hydrogen 2.963 N/A VAL 162.A N SER 158.A O no hydrogen 3.059 N/A ARG 163.A N LYS 159.A O no hydrogen 3.189 N/A ARG 163.A NE GLU 241.A OE2 no hydrogen 2.568 N/A ARG 163.A NH1 GLY 145.A O no hydrogen 3.078 N/A ARG 163.A NH2 GLU 241.A OE2 no hydrogen 3.368 N/A ILE 164.A N GLY 160.A O no hydrogen 3.361 N/A MET 165.A N ALA 161.A O no hydrogen 2.829 N/A SER 166.A N VAL 162.A O no hydrogen 3.045 N/A SER 166.A OG VAL 162.A O no hydrogen 2.510 N/A LYS 167.A NZ GLY 239.A O no hydrogen 3.053 N/A SER 168.A N ILE 164.A O no hydrogen 3.181 N/A ALA 169.A N MET 165.A O no hydrogen 3.121 N/A ALA 170.A N SER 166.A O no hydrogen 2.819 N/A LEU 171.A N LYS 167.A O no hydrogen 2.900 N/A ASP 172.A N SER 168.A O no hydrogen 3.028 N/A CYS 173.A N ALA 169.A O no hydrogen 2.980 N/A CYS 173.A SG ALA 169.A O no hydrogen 3.321 N/A ALA 174.A N ALA 170.A O no hydrogen 3.043 N/A LEU 175.A N LEU 171.A O no hydrogen 2.763 N/A LYS 176.A N ASP 172.A O no hydrogen 2.932 N/A ASP 177.A N ALA 174.A O no hydrogen 3.111 N/A TYR 178.A N CYS 173.A O no hydrogen 2.885 N/A ARG 181.A N ALA 135.A O no hydrogen 2.992 N/A ARG 181.A NH1 LEU 229.A O no hydrogen 3.462 N/A ARG 181.A NH1 ALA 237.A O no hydrogen 3.167 N/A ARG 181.A NH2 LEU 229.A O no hydrogen 3.037 N/A VAL 182.A N THR 238.A OG1 no hydrogen 3.153 N/A ASN 183.A N ILE 137.A O no hydrogen 3.100 N/A ASN 183.A ND2 ALA 237.A O no hydrogen 2.993 N/A THR 184.A N SER 240.A O no hydrogen 3.067 N/A THR 184.A OG1 HIS 186.A NE2 no hydrogen 2.685 N/A THR 184.A OG1 SER 240.A O no hydrogen 3.411 N/A VAL 185.A N ASN 139.A O no hydrogen 3.188 N/A HIS 186.A N PHE 242.A O no hydrogen 2.805 N/A HIS 186.A ND1 SER 142.A O no hydrogen 2.870 N/A HIS 186.A NE2 THR 184.A OG1 no hydrogen 2.685 N/A GLY 188.A N VAL 244.A O no hydrogen 2.831 N/A LYS 191.A N GLY 217.A O no hydrogen 2.827 N/A LYS 191.A NZ ASP 196.A OD1 no hydrogen 3.057 N/A LYS 191.A NZ GLU 202.A OE2 no hydrogen 3.141 N/A ASP 196.A N THR 192.A O no hydrogen 3.101 N/A ASP 197.A N PRO 193.A O no hydrogen 3.260 N/A ASP 197.A N LEU 194.A O no hydrogen 3.089 N/A LEU 198.A N VAL 195.A O no hydrogen 3.065 N/A ALA 201.A N LEU 198.A O no hydrogen 3.000 N/A ALA 204.A N GLY 200.A O no hydrogen 3.041 N/A MET 205.A N ALA 201.A O no hydrogen 2.951 N/A SER 206.A N GLU 203.A O no hydrogen 3.258 N/A SER 206.A OG GLU 202.A O no hydrogen 2.705 N/A GLN 207.A NE2 GLU 203.A O no hydrogen 3.035 N/A ARG 208.A NH1 PRO 212.A O no hydrogen 2.735 N/A LYS 210.A N GLN 207.A O no hydrogen 2.700 N/A THR 211.A N GLN 207.A O no hydrogen 2.829 N/A THR 211.A OG1 MET 205.A O no hydrogen 2.842 N/A MET 213.A N GLY 246.A O no hydrogen 3.427 N/A GLY 214.A N THR 211.A O no hydrogen 2.882 N/A GLY 217.A N TYR 189.A O no hydrogen 2.905 N/A GLU 218.A N ASP 221.A OD2 no hydrogen 2.774 N/A ASP 221.A N GLU 218.A O no hydrogen 2.914 N/A ILE 222.A N PRO 219.A O no hydrogen 3.047 N/A ALA 223.A N PRO 219.A O no hydrogen 3.086 N/A TYR 224.A N ASN 220.A O no hydrogen 2.994 N/A CYS 226.A N ILE 222.A O no hydrogen 3.114 N/A CYS 226.A SG ILE 222.A O no hydrogen 3.300 N/A VAL 227.A N ALA 223.A O no hydrogen 2.928 N/A TYR 228.A N TYR 224.A O no hydrogen 3.275 N/A LEU 229.A N ILE 225.A O no hydrogen 3.093 N/A ALA 230.A N CYS 226.A O no hydrogen 2.860 N/A SER 231.A N VAL 227.A O no hydrogen 2.913 N/A SER 231.A N TYR 228.A O no hydrogen 3.230 N/A SER 231.A OG VAL 227.A O no hydrogen 3.559 N/A SER 231.A OG TYR 228.A O no hydrogen 3.033 N/A GLU 233.A N SER 231.A OG no hydrogen 3.234 N/A SER 234.A N SER 231.A O no hydrogen 3.244 N/A SER 234.A OG TYR 228.A O no hydrogen 2.906 N/A SER 234.A OG SER 231.A O no hydrogen 3.232 N/A LYS 235.A N ASN 232.A O no hydrogen 3.233 N/A ALA 237.A N SER 234.A O no hydrogen 2.910 N/A GLY 239.A N VAL 182.A O no hydrogen 2.630 N/A SER 240.A N ASN 183.A OD1 no hydrogen 2.989 N/A PHE 242.A N THR 184.A O no hydrogen 2.906 N/A VAL 244.A N HIS 186.A O no hydrogen 3.175 N/A GLY 247.A N ASP 245.A OD1 no hydrogen 2.841 N/A TYR 248.A N ASP 245.A O no hydrogen 3.207 N/A THR 249.A N ASP 245.A OD2 no hydrogen 2.748 N/A THR 249.A OG1 ASP 245.A OD2 no hydrogen 2.616 N/A ALA 250.A N GLY 247.A O no hydrogen 3.023 N/A GLN 251.A NE2 ARG 208.A O no hydrogen 3.698 N/A