Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4za3_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 3.A N GLU 1.A OE1 no hydrogen 2.800 N/A CYS 3.A SG GLU 1.A OE2 no hydrogen 3.787 N/A SER 4.A N GLU 1.A O no hydrogen 2.911 N/A GLN 6.A NE2 SER 4.A O no hydrogen 2.915 N/A ARG 8.A N PHE 48.A O no hydrogen 3.164 N/A THR 9.A OG1 THR 47.A OG1 no hydrogen 2.817 N/A THR 10.A N TRP 46.A O no hydrogen 2.888 N/A THR 10.A OG1 ARG 11.A O no hydrogen 3.459 N/A ARG 11.A NE ASN 131.A O no hydrogen 3.142 N/A ARG 11.A NH1 GLY 39.A O no hydrogen 2.972 N/A ARG 11.A NH2 ASN 131.A O no hydrogen 2.828 N/A SER 13.A N ARG 128.A O no hydrogen 3.097 N/A SER 13.A OG SER 175.A OG no hydrogen 2.672 N/A GLY 14.A N LEU 18.A O no hydrogen 2.879 N/A ARG 15.A NH1 ALA 105.A O no hydrogen 2.816 N/A ARG 15.A NH1 ALA 107.A O no hydrogen 2.665 N/A ARG 15.A NH2 ALA 107.A O no hydrogen 3.085 N/A ASP 16.A N ASP 176.A OD2 no hydrogen 3.094 N/A GLY 17.A N GLY 14.A O no hydrogen 2.802 N/A LEU 18.A N ARG 15.A O no hydrogen 3.080 N/A CYS 19.A N TYR 36.A O no hydrogen 2.950 N/A CYS 19.A SG ILE 12.A O no hydrogen 3.900 N/A VAL 20.A N ILE 12.A O no hydrogen 2.915 N/A ASP 21.A N ILE 34.A O no hydrogen 2.949 N/A VAL 22.A N ASN 43.A O no hydrogen 2.998 N/A TYR 23.A N ARG 32.A O no hydrogen 3.211 N/A ALA 25.A N VAL 22.A O no hydrogen 2.929 N/A LEU 26.A N TYR 23.A O no hydrogen 3.320 N/A GLY 30.A N ILE 74.A O no hydrogen 2.925 N/A SER 31.A N ALA 28.A O no hydrogen 3.058 N/A SER 31.A OG ALA 28.A O no hydrogen 2.572 N/A ARG 32.A NE ASN 113.A OD1 no hydrogen 2.787 N/A VAL 33.A N VAL 72.A O no hydrogen 3.036 N/A ILE 34.A N ASP 21.A O no hydrogen 2.886 N/A LEU 35.A N THR 112.A O no hydrogen 3.232 N/A TYR 36.A N CYS 19.A O no hydrogen 3.082 N/A CYS 38.A SG GLY 17.A O no hydrogen 3.335 N/A GLY 39.A N GLN 44.A OE1 no hydrogen 2.845 N/A GLN 41.A N GLN 41.A OE1 no hydrogen 2.812 N/A ASN 43.A ND2 VAL 22.A O no hydrogen 3.010 N/A GLN 44.A N GLN 41.A O no hydrogen 3.128 N/A GLN 44.A NE2 ASP 21.A OD2 no hydrogen 2.885 N/A GLN 44.A NE2 PRO 37.A O no hydrogen 3.053 N/A GLN 45.A N GLN 42.A O no hydrogen 3.104 N/A GLN 45.A NE2 GLN 40.A O no hydrogen 3.371 N/A GLN 45.A NE2 GLN 42.A OE1 no hydrogen 2.931 N/A TRP 46.A N THR 10.A O no hydrogen 2.826 N/A TRP 46.A NE1 VAL 20.A O no hydrogen 3.104 N/A THR 47.A N ARG 55.A O no hydrogen 2.799 N/A THR 47.A OG1 THR 9.A OG1 no hydrogen 2.817 N/A PHE 48.A N ARG 8.A O no hydrogen 2.930 N/A TYR 49.A N THR 53.A O no hydrogen 3.299 N/A ASN 52.A N TYR 49.A O no hydrogen 3.127 N/A ASN 52.A ND2 ASP 84.A O no hydrogen 3.327 N/A THR 53.A N ASP 51.A OD1 no hydrogen 3.067 N/A THR 53.A OG1 ASP 51.A OD1 no hydrogen 2.569 N/A THR 53.A OG1 ASP 51.A OD2 no hydrogen 3.440 N/A ARG 55.A N THR 47.A O no hydrogen 2.893 N/A ARG 55.A NE THR 53.A OG1 no hydrogen 2.918 N/A ARG 55.A NH2 ASP 51.A OD2 no hydrogen 3.049 N/A ARG 55.A NH2 THR 53.A OG1 no hydrogen 3.320 N/A SER 56.A N LYS 59.A O no hydrogen 2.914 N/A SER 56.A OG GLN 45.A O no hydrogen 2.922 N/A LYS 59.A N SER 56.A O no hydrogen 2.982 N/A LYS 59.A NZ THR 27.A O no hydrogen 2.867 N/A LYS 59.A NZ ASP 29.A OD1 no hydrogen 2.662 N/A CYS 60.A N THR 75.A O no hydrogen 2.902 N/A LEU 61.A N ILE 54.A O no hydrogen 2.911 N/A ALA 62.A N VAL 73.A O no hydrogen 2.838 N/A SER 64.A OG ASN 71.A O no hydrogen 2.684 N/A GLY 69.A N GLY 116.A O no hydrogen 3.023 N/A VAL 72.A N LEU 114.A O no hydrogen 3.009 N/A VAL 73.A N ALA 62.A O no hydrogen 2.912 N/A ILE 74.A N SER 31.A O no hydrogen 2.970 N/A THR 75.A N CYS 60.A O no hydrogen 2.940 N/A ASN 76.A N ASP 29.A OD1 no hydrogen 3.042 N/A CYS 77.A SG GLY 58.A O no hydrogen 4.021 N/A ASP 78.A N ASN 76.A OD1 no hydrogen 2.852 N/A TYR 79.A N ASN 76.A O no hydrogen 3.088 N/A LEU 80.A N CYS 77.A O no hydrogen 2.813 N/A ARG 81.A N ASP 78.A O no hydrogen 3.501 N/A ASP 83.A N LEU 80.A O no hydrogen 2.953 N/A GLY 85.A N ASP 83.A OD2 no hydrogen 3.059 N/A TRP 86.A N ASN 52.A O no hydrogen 3.119 N/A TRP 86.A NE1 LEU 61.A O no hydrogen 3.031 N/A MET 87.A N MET 95.A O no hydrogen 2.891 N/A SER 89.A N THR 93.A O no hydrogen 2.917 N/A SER 89.A OG SER 91.A OG no hydrogen 3.018 N/A SER 91.A N SER 89.A OG no hydrogen 3.202 N/A SER 91.A OG SER 89.A OG no hydrogen 3.018 N/A GLY 92.A N SER 89.A O no hydrogen 3.004 N/A THR 93.A N SER 89.A OG no hydrogen 3.185 N/A MET 95.A N MET 87.A O no hydrogen 2.976 N/A ASN 96.A N LEU 101.A O no hydrogen 2.976 N/A ASN 96.A ND2 THR 63.A OG1 no hydrogen 3.251 N/A LYS 97.A N GLY 85.A O no hydrogen 2.993 N/A SER 98.A N ASN 96.A OD1 no hydrogen 2.850 N/A SER 99.A N ASN 96.A OD1 no hydrogen 2.883 N/A HIS 100.A N ASN 96.A O no hydrogen 2.836 N/A LEU 101.A N SER 99.A OG no hydrogen 3.329 N/A VAL 102.A N GLU 117.A O no hydrogen 2.936 N/A LEU 103.A N MET 94.A O no hydrogen 3.018 N/A THR 104.A N THR 115.A O no hydrogen 2.928 N/A THR 104.A OG1 VAL 102.A O no hydrogen 2.844 N/A ALA 105.A N LYS 124.A O no hydrogen 3.019 N/A SER 110.A OG ASP 16.A OD2 no hydrogen 2.765 N/A ARG 111.A N THR 109.A OG1 no hydrogen 3.318 N/A THR 112.A OG1 ASN 113.A O no hydrogen 3.364 N/A ASN 113.A ND2 ASN 71.A OD1 no hydrogen 3.609 N/A LEU 114.A N VAL 33.A O no hydrogen 3.113 N/A THR 115.A N THR 104.A O no hydrogen 2.994 N/A THR 115.A OG1 GLU 117.A OE2 no hydrogen 2.730 N/A GLY 116.A N SER 70.A O no hydrogen 3.083 N/A GLU 117.A N VAL 102.A O no hydrogen 3.072 N/A VAL 120.A N GLN 125.A OE1 no hydrogen 2.895 N/A PHE 121.A N ASN 119.A OD1 no hydrogen 3.025 N/A ALA 122.A N GLN 125.A OE1 no hydrogen 3.273 N/A ALA 123.A N SER 208.A O no hydrogen 3.248 N/A LYS 124.A N GLY 207.A O no hydrogen 3.247 N/A LYS 124.A NZ ASN 106.A O no hydrogen 3.361 N/A LYS 124.A NZ ASN 106.A OD1 no hydrogen 3.359 N/A GLN 125.A N ALA 122.A O no hydrogen 2.944 N/A GLN 125.A NE2 THR 104.A OG1 no hydrogen 3.110 N/A GLN 125.A NE2 ASN 118.A O no hydrogen 3.009 N/A ALA 126.A N ALA 123.A O no hydrogen 3.070 N/A TRP 127.A N GLY 92.A O no hydrogen 3.049 N/A TRP 127.A NE1 LEU 103.A O no hydrogen 3.057 N/A ARG 128.A N SER 13.A O no hydrogen 2.783 N/A ARG 128.A NH1 TYR 132.A O no hydrogen 3.046 N/A ARG 128.A NH1 GLU 134.A O no hydrogen 2.823 N/A ARG 128.A NH2 GLU 134.A O no hydrogen 3.255 N/A GLY 130.A N ARG 11.A O no hydrogen 2.932 N/A ILE 136.A N LEU 173.A O no hydrogen 2.950 N/A THR 138.A N TRP 171.A O no hydrogen 2.903 N/A THR 138.A OG1 THR 139.A O no hydrogen 2.847 N/A THR 139.A N PHE 259.A O no hydrogen 2.872 N/A THR 139.A OG1 PHE 259.A O no hydrogen 3.054 N/A ILE 141.A N THR 257.A O no hydrogen 2.877 N/A GLY 142.A N MET 146.A O no hydrogen 2.855 N/A MET 146.A N LEU 143.A O no hydrogen 3.199 N/A CYS 147.A N GLU 160.A O no hydrogen 2.872 N/A LEU 148.A N ILE 140.A O no hydrogen 2.978 N/A GLU 149.A N TRP 158.A O no hydrogen 2.928 N/A ALA 150.A N LYS 168.A O no hydrogen 3.030 N/A THR 151.A N ASN 156.A O no hydrogen 2.817 N/A THR 155.A N THR 151.A O no hydrogen 3.023 N/A THR 155.A N ASP 152.A O no hydrogen 3.179 N/A THR 155.A OG1 ASP 152.A O no hydrogen 2.747 N/A ASN 156.A N THR 151.A O no hydrogen 3.054 N/A ASN 156.A ND2 ASP 152.A OD2 no hydrogen 2.837 N/A TRP 158.A N GLU 149.A O no hydrogen 3.279 N/A TRP 158.A NE1 GLU 160.A OE2 no hydrogen 2.849 N/A GLU 160.A N CYS 147.A O no hydrogen 3.008 N/A CYS 162.A SG HIS 145.A O no hydrogen 3.595 N/A VAL 163.A N GLN 169.A OE1 no hydrogen 2.999 N/A ASN 165.A N TYR 170.A OH no hydrogen 2.801 N/A LYS 166.A N VAL 163.A O no hydrogen 3.086 N/A LYS 166.A NZ GLU 149.A OE1 no hydrogen 2.798 N/A LYS 166.A NZ GLU 149.A OE2 no hydrogen 3.109 N/A LYS 168.A NZ ASP 154.A OD1 no hydrogen 2.983 N/A LYS 168.A NZ ASP 154.A OD2 no hydrogen 2.783 N/A LYS 168.A NZ ASN 183.A OD1 no hydrogen 2.858 N/A GLN 169.A N LYS 166.A O no hydrogen 2.945 N/A GLN 169.A NE2 GLU 149.A OE1 no hydrogen 2.943 N/A GLN 169.A NE2 SER 161.A O no hydrogen 2.986 N/A TYR 170.A N THR 167.A O no hydrogen 3.284 N/A TRP 171.A N THR 138.A O no hydrogen 2.884 N/A TRP 171.A NE1 LEU 148.A O no hydrogen 3.079 N/A ALA 172.A N ARG 180.A O no hydrogen 2.819 N/A LEU 173.A N ILE 136.A O no hydrogen 2.826 N/A TYR 174.A N THR 178.A O no hydrogen 3.104 N/A SER 175.A OG SER 13.A OG no hydrogen 2.672 N/A SER 175.A OG VAL 133.A O no hydrogen 3.478 N/A ASP 177.A N TYR 174.A O no hydrogen 3.101 N/A THR 178.A N ASP 176.A OD1 no hydrogen 3.130 N/A THR 178.A OG1 ASP 176.A OD1 no hydrogen 2.598 N/A ARG 180.A N ALA 172.A O no hydrogen 2.996 N/A ARG 180.A NE THR 178.A OG1 no hydrogen 2.899 N/A ARG 180.A NH1 ARG 185.A O no hydrogen 3.039 N/A ARG 180.A NH2 ASP 16.A OD1 no hydrogen 2.851 N/A ARG 180.A NH2 ASP 176.A OD2 no hydrogen 3.048 N/A VAL 181.A N LEU 187.A O no hydrogen 3.113 N/A ASN 182.A N TYR 170.A O no hydrogen 3.258 N/A ASN 184.A N VAL 181.A O no hydrogen 3.075 N/A ARG 185.A NE ASN 182.A O no hydrogen 3.055 N/A ARG 185.A NE ASN 182.A OD1 no hydrogen 3.406 N/A ARG 185.A NH2 ASN 182.A OD1 no hydrogen 2.720 N/A ASN 186.A N ASN 184.A OD1 no hydrogen 3.388 N/A LEU 187.A N ASN 184.A O no hydrogen 3.139 N/A CYS 188.A N ARG 203.A O no hydrogen 2.807 N/A CYS 188.A SG GLN 211.A OE1 no hydrogen 3.775 N/A VAL 189.A N ILE 179.A O no hydrogen 2.909 N/A SER 190.A N VAL 201.A O no hydrogen 2.822 N/A SER 190.A OG SER 191.A O no hydrogen 2.864 N/A SER 191.A N ASN 210.A O no hydrogen 2.900 N/A SER 192.A OG ASP 194.A O no hydrogen 2.899 N/A SER 192.A OG SER 197.A O no hydrogen 3.034 N/A ASP 194.A N SER 192.A OG no hydrogen 3.017 N/A SER 196.A N ASP 194.A OD1 no hydrogen 2.996 N/A SER 197.A N ASP 194.A O no hydrogen 2.970 N/A LEU 199.A N SER 197.A OG no hydrogen 3.071 N/A ILE 200.A N ILE 242.A O no hydrogen 2.872 N/A VAL 201.A N SER 190.A O no hydrogen 2.954 N/A ILE 202.A N THR 155.A O no hydrogen 3.033 N/A ARG 203.A N CYS 188.A O no hydrogen 3.041 N/A ARG 203.A NH1 THR 155.A O no hydrogen 3.299 N/A ARG 203.A NH1 ILE 202.A O no hydrogen 2.889 N/A CYS 205.A N ASN 186.A O no hydrogen 2.908 N/A ASP 206.A N GLN 211.A OE1 no hydrogen 2.927 N/A SER 208.A N ASP 206.A OD1 no hydrogen 3.037 N/A SER 208.A OG ASP 206.A OD1 no hydrogen 2.722 N/A ASN 210.A ND2 SER 191.A O no hydrogen 3.283 N/A GLN 211.A N SER 208.A O no hydrogen 3.198 N/A GLN 211.A NE2 ARG 204.A O no hydrogen 3.091 N/A ARG 212.A N ILE 209.A O no hydrogen 3.325 N/A ARG 212.A NE ASP 177.A OD2 no hydrogen 2.911 N/A ARG 212.A NH2 SER 91.A O no hydrogen 2.961 N/A ARG 212.A NH2 THR 93.A OG1 no hydrogen 3.386 N/A TRP 213.A N ASP 177.A O no hydrogen 2.886 N/A TRP 213.A NE1 VAL 189.A O no hydrogen 3.009 N/A VAL 214.A N SER 222.A O no hydrogen 2.834 N/A THR 216.A N THR 220.A O no hydrogen 3.052 N/A THR 216.A OG1 THR 220.A O no hydrogen 3.270 N/A THR 216.A OG1 THR 220.A OG1 no hydrogen 2.726 N/A GLN 218.A N GLN 218.A OE1 no hydrogen 2.818 N/A GLY 219.A N THR 216.A O no hydrogen 3.055 N/A THR 220.A N THR 216.A OG1 no hydrogen 3.087 N/A THR 220.A OG1 THR 216.A OG1 no hydrogen 2.726 N/A SER 222.A N VAL 214.A O no hydrogen 2.838 N/A ASN 223.A N ALA 228.A O no hydrogen 2.816 N/A ASN 223.A ND2 ILE 209.A O no hydrogen 3.012 N/A TYR 226.A N ASN 223.A O no hydrogen 3.231 N/A TYR 226.A N ASN 223.A OD1 no hydrogen 3.165 N/A TYR 226.A OH ASN 210.A OD1 no hydrogen 2.854 N/A GLU 227.A N PRO 224.A O no hydrogen 3.287 N/A ALA 228.A N ASN 223.A O no hydrogen 3.443 N/A VAL 229.A N SER 245.A O no hydrogen 2.796 N/A MET 230.A N ILE 221.A O no hydrogen 2.939 N/A ASP 231.A N VAL 243.A O no hydrogen 2.874 N/A VAL 232.A N GLY 253.A O no hydrogen 3.337 N/A ALA 233.A N LYS 241.A O no hydrogen 2.978 N/A ASN 235.A N VAL 232.A O no hydrogen 2.956 N/A ASP 236.A N ALA 233.A O no hydrogen 2.985 N/A TYR 238.A N ASP 236.A OD1 no hydrogen 2.855 N/A LEU 239.A N ASP 236.A O no hydrogen 3.148 N/A LYS 240.A N VAL 237.A O no hydrogen 3.290 N/A VAL 243.A N ASP 231.A O no hydrogen 2.844 N/A LEU 244.A N LYS 198.A O no hydrogen 3.062 N/A SER 245.A N VAL 229.A O no hydrogen 2.931 N/A SER 245.A OG ASP 231.A OD2 no hydrogen 3.311 N/A THR 248.A N GLN 254.A OE1 no hydrogen 2.978 N/A GLY 253.A N ASN 235.A OD1 no hydrogen 2.792 N/A GLN 254.A NE2 ASP 231.A OD2 no hydrogen 3.185 N/A GLN 254.A NE2 SER 246.A O no hydrogen 3.085 N/A GLN 255.A N ASN 252.A O no hydrogen 3.172 N/A GLN 255.A NE2 GLN 218.A O no hydrogen 3.036 N/A TRP 256.A N GLY 219.A O no hydrogen 2.961 N/A TRP 256.A NE1 MET 230.A O no hydrogen 3.303 N/A THR 257.A N ILE 141.A O no hydrogen 2.735 N/A PHE 259.A N THR 139.A O no hydrogen 2.954 N/A