Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4zau_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 3.A ND2 SER 62.A OG no hydrogen 2.951 N/A ALA 5.A N ASN 3.A OD1 no hydrogen 2.822 N/A LEU 10.A N ILE 74.A O no hydrogen 2.690 N/A LYS 11.A N GLU 14.A OE1 no hydrogen 3.401 N/A GLU 14.A N LYS 11.A O no hydrogen 3.254 N/A PHE 15.A N GLU 12.A O no hydrogen 3.176 N/A LYS 16.A N LEU 33.A O no hydrogen 3.041 N/A ILE 18.A N LYS 31.A O no hydrogen 2.806 N/A LEU 21.A N VAL 29.A O no hydrogen 2.851 N/A GLY 24.A N GLY 27.A O no hydrogen 2.973 N/A GLY 27.A N GLY 24.A O no hydrogen 2.911 N/A VAL 29.A N GLY 22.A O no hydrogen 3.067 N/A TYR 30.A N ILE 47.A O no hydrogen 2.960 N/A LYS 31.A N LYS 19.A O no hydrogen 2.912 N/A GLY 32.A N VAL 45.A O no hydrogen 2.802 N/A LEU 33.A N LYS 16.A O no hydrogen 2.784 N/A TRP 34.A N ILE 43.A O no hydrogen 2.768 N/A ILE 35.A N GLU 14.A O no hydrogen 2.815 N/A GLU 37.A N GLU 14.A OE2 no hydrogen 3.285 N/A LYS 42.A N ASP 275.A O no hydrogen 3.009 N/A ILE 43.A N TRP 34.A O no hydrogen 2.829 N/A VAL 45.A N GLY 32.A O no hydrogen 2.988 N/A ALA 46.A N THR 84.A O no hydrogen 2.766 N/A ILE 47.A N TYR 30.A O no hydrogen 3.011 N/A LYS 48.A N LEU 82.A O no hydrogen 2.934 N/A LEU 54.A N ASN 50.A O no hydrogen 3.307 N/A ASP 55.A N LYS 51.A O no hydrogen 2.952 N/A GLU 56.A N GLU 52.A O no hydrogen 3.215 N/A ALA 57.A N ILE 53.A O no hydrogen 2.902 N/A TYR 58.A N LEU 54.A O no hydrogen 2.827 N/A VAL 59.A N ASP 55.A O no hydrogen 3.144 N/A MET 60.A N GLU 56.A O no hydrogen 2.908 N/A ALA 61.A N ALA 57.A O no hydrogen 2.889 N/A SER 62.A N VAL 59.A O no hydrogen 2.964 N/A SER 62.A OG TYR 58.A O no hydrogen 2.660 N/A ASP 64.A N TYR 121.A OH no hydrogen 2.865 N/A HIS 67.A N ASN 65.A OD1 no hydrogen 2.953 N/A HIS 67.A ND1 VAL 145.A O no hydrogen 3.098 N/A VAL 68.A N ASN 65.A O no hydrogen 3.004 N/A CYS 69.A N ILE 147.A O no hydrogen 3.027 N/A CYS 69.A SG THR 148.A OG1 no hydrogen 3.767 N/A LEU 72.A N ILE 83.A O no hydrogen 2.945 N/A GLY 73.A N ILE 83.A O no hydrogen 3.305 N/A ILE 74.A N ARG 8.A O no hydrogen 3.005 N/A CYS 75.A N GLN 81.A O no hydrogen 2.987 N/A CYS 75.A SG LEU 10.A O no hydrogen 3.027 N/A CYS 75.A SG GLN 81.A OE1 no hydrogen 3.984 N/A THR 77.A OG1 THR 79.A O no hydrogen 2.327 N/A THR 77.A OG1 GLN 81.A OE1 no hydrogen 3.014 N/A GLN 81.A N CYS 75.A O no hydrogen 3.143 N/A LEU 82.A N LYS 48.A O no hydrogen 2.931 N/A ILE 83.A N GLY 73.A O no hydrogen 2.867 N/A THR 84.A N ALA 46.A O no hydrogen 2.695 N/A THR 84.A OG1 ALA 46.A O no hydrogen 3.556 N/A GLN 85.A N ARG 70.A O no hydrogen 3.324 N/A GLN 85.A NE2 ASP 278.A OD2 no hydrogen 3.457 N/A GLN 85.A NE2 ASP 280.A OD2 no hydrogen 3.103 N/A LEU 86.A N PRO 44.A O no hydrogen 3.214 N/A PHE 89.A N VAL 139.A O no hydrogen 3.134 N/A GLY 90.A N MET 87.A O no hydrogen 3.047 N/A CYS 91.A SG ASP 94.A OD2 no hydrogen 3.320 N/A LEU 92.A N VAL 137.A O no hydrogen 2.896 N/A LEU 93.A N ALA 134.A O no hydrogen 3.252 N/A TYR 95.A N CYS 91.A O no hydrogen 3.131 N/A VAL 96.A N LEU 92.A O no hydrogen 2.952 N/A ARG 97.A N LEU 93.A O no hydrogen 3.164 N/A ARG 97.A NE GLY 200.A O no hydrogen 2.903 N/A ARG 97.A NH2 GLY 200.A O no hydrogen 2.950 N/A GLU 98.A N ASP 94.A O no hydrogen 2.775 N/A HIS 99.A N TYR 95.A O no hydrogen 3.002 N/A HIS 99.A ND1 TYR 95.A O no hydrogen 3.024 N/A ASN 102.A N HIS 99.A O no hydrogen 2.775 N/A SER 105.A N ASP 273.A OD1 no hydrogen 3.044 N/A SER 105.A OG ASP 273.A OD1 no hydrogen 3.104 N/A SER 105.A OG ASP 273.A OD2 no hydrogen 3.056 N/A GLN 106.A NE2 GLN 106.A O no hydrogen 3.678 N/A GLN 106.A NE2 ALA 261.A O no hydrogen 2.985 N/A LEU 108.A N GLY 104.A O no hydrogen 3.147 N/A LEU 109.A N SER 105.A O no hydrogen 3.004 N/A ASN 110.A N GLN 106.A O no hydrogen 2.944 N/A TRP 111.A N TYR 107.A O no hydrogen 2.751 N/A TRP 111.A NE1 PRO 142.A O no hydrogen 2.839 N/A CYS 112.A N LEU 108.A O no hydrogen 3.025 N/A CYS 112.A SG LEU 108.A O no hydrogen 3.363 N/A VAL 113.A N LEU 109.A O no hydrogen 3.031 N/A GLN 114.A N ASN 110.A O no hydrogen 2.839 N/A GLN 114.A NE2 GLN 143.A O no hydrogen 2.784 N/A ILE 115.A N TRP 111.A O no hydrogen 2.881 N/A ALA 116.A N CYS 112.A O no hydrogen 3.074 N/A LYS 117.A N VAL 113.A O no hydrogen 2.938 N/A GLY 118.A N GLN 114.A O no hydrogen 2.944 N/A MET 119.A N ILE 115.A O no hydrogen 2.931 N/A ASN 120.A N ALA 116.A O no hydrogen 2.649 N/A TYR 121.A N LYS 117.A O no hydrogen 2.996 N/A LEU 122.A N GLY 118.A O no hydrogen 2.998 N/A GLU 123.A N MET 119.A O no hydrogen 2.874 N/A ASP 124.A N ASN 120.A O no hydrogen 2.799 N/A ARG 125.A N TYR 121.A O no hydrogen 2.985 N/A ARG 125.A N LEU 122.A O no hydrogen 2.892 N/A ARG 126.A N GLU 123.A O no hydrogen 3.035 N/A LEU 127.A N LEU 122.A O no hydrogen 2.992 N/A VAL 128.A N LYS 154.A O no hydrogen 2.992 N/A HIS 129.A N ASP 185.A OD2 no hydrogen 3.018 N/A HIS 129.A NE2 THR 148.A O no hydrogen 2.739 N/A ARG 130.A N ASP 185.A OD1 no hydrogen 3.047 N/A ARG 130.A NH1 LEU 152.A O no hydrogen 2.694 N/A ASP 131.A N HIS 129.A ND1 no hydrogen 3.002 N/A ALA 134.A N GLU 195.A OE2 no hydrogen 2.895 N/A ARG 135.A NH2 ASP 131.A OD1 no hydrogen 2.832 N/A ASN 136.A N ALA 133.A O no hydrogen 2.823 N/A ASN 136.A ND2 ASP 131.A O no hydrogen 2.848 N/A VAL 137.A N ALA 134.A O no hydrogen 3.263 N/A LEU 138.A N LYS 146.A O no hydrogen 2.735 N/A VAL 139.A N GLY 90.A O no hydrogen 2.787 N/A LYS 140.A N HIS 144.A O no hydrogen 3.076 N/A LYS 140.A NZ ASP 280.A OD2 no hydrogen 2.845 N/A THR 141.A N HIS 144.A O no hydrogen 3.138 N/A THR 141.A OG1 GLN 143.A OE1 no hydrogen 3.314 N/A GLN 143.A N THR 141.A OG1 no hydrogen 3.237 N/A HIS 144.A N THR 141.A O no hydrogen 2.875 N/A HIS 144.A NE2 PRO 66.A O no hydrogen 2.819 N/A VAL 145.A N GLN 114.A OE1 no hydrogen 2.836 N/A LYS 146.A N LEU 138.A O no hydrogen 2.978 N/A LYS 146.A NZ GLN 85.A OE1 no hydrogen 2.816 N/A LYS 146.A NZ ASP 280.A OD1 no hydrogen 2.767 N/A LYS 146.A NZ ASP 280.A OD2 no hydrogen 3.279 N/A ILE 147.A N HIS 67.A O no hydrogen 3.010 N/A THR 148.A N ASN 136.A O no hydrogen 2.926 N/A ASP 149.A N THR 148.A OG1 no hydrogen 2.677 N/A GLY 151.A N ASP 149.A OD1 no hydrogen 3.445 N/A ALA 153.A N PHE 150.A O no hydrogen 3.122 N/A LYS 154.A N VAL 128.A O no hydrogen 2.891 N/A TYR 160.A N TYR 180.A O no hydrogen 2.954 N/A ALA 162.A N ARG 178.A O no hydrogen 3.331 N/A LYS 168.A NZ PRO 203.A O no hydrogen 3.423 N/A LYS 168.A NZ TYR 204.A O no hydrogen 2.903 N/A LYS 168.A NZ ILE 207.A O no hydrogen 3.201 N/A TRP 169.A N PRO 166.A O no hydrogen 3.392 N/A TRP 169.A NE1 GLU 195.A OE2 no hydrogen 2.752 N/A MET 170.A N ILE 167.A O no hydrogen 3.086 N/A GLU 173.A N GLU 173.A OE1 no hydrogen 2.717 N/A SER 174.A OG ILE 179.A O no hydrogen 2.824 N/A SER 174.A OG SER 184.A OG no hydrogen 2.834 N/A ILE 175.A N ALA 171.A O no hydrogen 3.014 N/A LEU 176.A N LEU 172.A O no hydrogen 2.987 N/A HIS 177.A N GLU 173.A O no hydrogen 2.685 N/A ARG 178.A N SER 174.A O no hydrogen 2.958 N/A ARG 178.A NH1 ALA 162.A O no hydrogen 2.609 N/A TYR 180.A N TYR 160.A O no hydrogen 2.943 N/A GLN 183.A N THR 181.A OG1 no hydrogen 2.817 N/A GLN 183.A NE2 ALA 244.A O no hydrogen 3.109 N/A GLN 183.A NE2 ARG 247.A O no hydrogen 3.447 N/A GLN 183.A NE2 PRO 248.A O no hydrogen 3.139 N/A SER 184.A N THR 181.A OG1 no hydrogen 3.231 N/A SER 184.A OG SER 174.A OG no hydrogen 2.834 N/A ASP 185.A N THR 181.A O no hydrogen 3.131 N/A VAL 186.A N HIS 182.A O no hydrogen 3.071 N/A TRP 187.A N GLN 183.A O no hydrogen 3.366 N/A SER 188.A N SER 184.A O no hydrogen 3.286 N/A SER 188.A OG TRP 169.A O no hydrogen 2.988 N/A SER 188.A OG SER 184.A O no hydrogen 3.240 N/A TYR 189.A N ASP 185.A O no hydrogen 2.777 N/A TYR 189.A OH CYS 112.A O no hydrogen 2.638 N/A GLY 190.A N VAL 186.A O no hydrogen 2.896 N/A VAL 191.A N TRP 187.A O no hydrogen 3.269 N/A THR 192.A N SER 188.A O no hydrogen 3.010 N/A THR 192.A OG1 SER 188.A O no hydrogen 2.927 N/A VAL 193.A N TYR 189.A O no hydrogen 2.946 N/A TRP 194.A N GLY 190.A O no hydrogen 3.057 N/A TRP 194.A NE1 PRO 223.A O no hydrogen 2.817 N/A GLU 195.A N VAL 191.A O no hydrogen 2.840 N/A LEU 196.A N THR 192.A O no hydrogen 3.055 N/A MET 197.A N VAL 193.A O no hydrogen 2.762 N/A THR 198.A N TRP 194.A O no hydrogen 2.907 N/A THR 198.A OG1 TRP 194.A O no hydrogen 2.987 N/A THR 198.A OG1 GLU 195.A O no hydrogen 3.095 N/A PHE 199.A N LEU 196.A O no hydrogen 3.123 N/A GLY 200.A N GLU 195.A O no hydrogen 2.728 N/A SER 201.A N THR 198.A OG1 no hydrogen 3.186 N/A ILE 212.A N ALA 209.A O no hydrogen 2.888 N/A ILE 215.A N GLU 211.A O no hydrogen 3.173 N/A LEU 216.A N ILE 212.A O no hydrogen 3.181 N/A GLU 217.A N SER 213.A O no hydrogen 3.063 N/A LYS 218.A N SER 214.A O no hydrogen 2.812 N/A GLY 219.A N ILE 215.A O no hydrogen 3.241 N/A GLU 220.A N ILE 215.A O no hydrogen 3.340 N/A ARG 221.A NE TRP 240.A O no hydrogen 2.951 N/A ARG 221.A NH1 TRP 240.A O no hydrogen 2.827 N/A ARG 221.A NH2 LEU 216.A O no hydrogen 2.904 N/A ARG 221.A NH2 GLU 220.A O no hydrogen 2.674 N/A GLN 224.A NE2 CYS 228.A O no hydrogen 3.219 N/A CYS 228.A N PRO 225.A O no hydrogen 2.837 N/A THR 229.A N TYR 267.A O no hydrogen 3.235 N/A THR 229.A OG1 TYR 267.A O no hydrogen 2.609 N/A TYR 233.A N THR 229.A O no hydrogen 3.111 N/A TYR 233.A OH LEU 222.A O no hydrogen 2.589 N/A MET 234.A N ILE 230.A O no hydrogen 2.759 N/A ILE 235.A N ASP 231.A O no hydrogen 3.443 N/A MET 236.A N VAL 232.A O no hydrogen 3.289 N/A VAL 237.A N TYR 233.A O no hydrogen 2.996 N/A LYS 238.A N MET 234.A O no hydrogen 2.889 N/A CYS 239.A N ILE 235.A O no hydrogen 3.188 N/A CYS 239.A SG ILE 235.A O no hydrogen 3.438 N/A TRP 240.A N VAL 237.A O no hydrogen 2.892 N/A ASP 245.A N ASP 243.A OD1 no hydrogen 3.367 N/A SER 246.A N ASP 243.A O no hydrogen 2.904 N/A SER 246.A OG ASP 243.A OD2 no hydrogen 2.995 N/A ARG 247.A N ALA 244.A O no hydrogen 3.286 N/A ARG 247.A NE GLN 183.A O no hydrogen 3.364 N/A ARG 247.A NH2 GLU 173.A OE1 no hydrogen 2.640 N/A LYS 249.A N GLU 252.A OE1 no hydrogen 2.773 N/A LYS 249.A NZ GLU 123.A OE1 no hydrogen 2.986 N/A GLU 252.A N LYS 249.A O no hydrogen 2.658 N/A LEU 253.A N LYS 249.A O no hydrogen 2.838 N/A ILE 254.A N PHE 250.A O no hydrogen 2.752 N/A GLU 256.A N GLU 252.A O no hydrogen 2.884 N/A PHE 257.A N LEU 253.A O no hydrogen 3.122 N/A SER 258.A N ILE 254.A O no hydrogen 2.973 N/A SER 258.A OG ILE 254.A O no hydrogen 2.786 N/A LYS 259.A N ILE 255.A O no hydrogen 2.973 N/A MET 260.A N GLU 256.A O no hydrogen 3.090 N/A ALA 261.A N PHE 257.A O no hydrogen 2.626 N/A ARG 262.A N LYS 259.A O no hydrogen 3.231 N/A ASP 263.A N MET 260.A O no hydrogen 2.939 N/A ARG 266.A N ASP 263.A O no hydrogen 3.107 N/A TYR 267.A N PRO 264.A O no hydrogen 3.257 N/A LEU 268.A N PRO 264.A O no hydrogen 3.035 N/A VAL 269.A N ILE 227.A O no hydrogen 2.870 N/A VAL 277.A N LYS 42.A O no hydrogen 3.098 N/A ASP 280.A N ASP 278.A OD1 no hydrogen 2.958 N/A GLU 281.A N ASP 278.A O no hydrogen 3.035 N/A TYR 282.A N ALA 279.A O no hydrogen 2.853 N/A TYR 282.A OH GLU 39.A OE1 no hydrogen 2.733 N/A