Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3zzf_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 4.A N HIS 64.A O no hydrogen 2.798 N/A THR 6.A N THR 9.A OG1 no hydrogen 3.158 N/A THR 6.A OG1 SER 8.A OG no hydrogen 3.088 N/A THR 6.A OG1 THR 9.A OG1 no hydrogen 2.840 N/A SER 8.A OG THR 6.A OG1 no hydrogen 3.088 N/A THR 9.A N THR 6.A OG1 no hydrogen 3.227 N/A THR 9.A OG1 THR 6.A OG1 no hydrogen 2.840 N/A VAL 10.A N THR 6.A O no hydrogen 2.989 N/A ILE 11.A N ARG 7.A O no hydrogen 3.053 N/A GLN 12.A N SER 8.A O no hydrogen 2.830 N/A GLN 12.A NE2 SER 57.A O no hydrogen 3.176 N/A LEU 13.A N THR 9.A O no hydrogen 2.925 N/A LEU 14.A N VAL 10.A O no hydrogen 3.079 N/A ASN 15.A N ILE 11.A O no hydrogen 2.872 N/A ILE 17.A N LEU 14.A O no hydrogen 3.087 N/A SER 18.A N GLU 22.A OE1 no hydrogen 2.640 N/A SER 18.A OG GLU 22.A OE1 no hydrogen 3.085 N/A THR 19.A N GLU 22.A OE1 no hydrogen 3.140 N/A THR 19.A OG1 GLU 22.A OE1 no hydrogen 3.086 N/A LYS 20.A NZ GLU 24.A OE2.B no hydrogen 2.663 N/A ARG 21.A NH1 GLN 25.A OE1.B no hydrogen 3.152 N/A GLU 22.A N THR 19.A OG1 no hydrogen 3.169 N/A VAL 23.A N THR 19.A O no hydrogen 3.250 N/A GLU 24.A N.A LYS 20.A O no hydrogen 2.813 N/A GLU 24.A N.B LYS 20.A O no hydrogen 2.831 N/A GLN 25.A N.A ARG 21.A O no hydrogen 3.018 N/A GLN 25.A N.B ARG 21.A O no hydrogen 3.051 N/A GLN 25.A NE2.A PHE 278.A O no hydrogen 3.226 N/A TYR 26.A N GLU 22.A O no hydrogen 3.146 N/A TYR 26.A OH GLN 274.A OE1 no hydrogen 2.799 N/A LEU 27.A N VAL 23.A O no hydrogen 2.983 N/A LYS 28.A N GLU 24.A O.A no hydrogen 3.039 N/A LYS 28.A N GLU 24.A O.B no hydrogen 3.156 N/A TYR 29.A N GLN 25.A O.A no hydrogen 3.334 N/A TYR 29.A N GLN 25.A O.B no hydrogen 3.393 N/A PHE 30.A N TYR 26.A O no hydrogen 2.933 N/A THR 31.A N LEU 27.A O no hydrogen 2.927 N/A THR 31.A OG1 LEU 27.A O no hydrogen 2.779 N/A THR 31.A OG1 LYS 28.A O no hydrogen 3.554 N/A SER 34.A N SER 32.A OG no hydrogen 3.184 N/A GLN 36.A N SER 34.A OG no hydrogen 3.219 N/A GLN 36.A NE2 GLU 201.A O no hydrogen 2.803 N/A VAL 40.A N LYS 204.A O no hydrogen 3.000 N/A ILE 41.A N ILE 70.A O no hydrogen 2.907 N/A LYS 42.A N VAL 206.A O no hydrogen 2.773 N/A LYS 42.A NZ ASP 190.A OD1 no hydrogen 2.806 N/A VAL 43.A N LEU 72.A O no hydrogen 2.715 N/A GLY 44.A N LEU 208.A O no hydrogen 3.187 N/A ILE 47.A N GLY 44.A O no hydrogen 2.982 N/A ILE 48.A N GLY 45.A O no hydrogen 3.235 N/A SER 49.A OG ALA 46.A O no hydrogen 2.941 N/A SER 49.A OG ASP 50.A OD1 no hydrogen 3.179 N/A ASP 50.A N ALA 46.A O no hydrogen 2.945 N/A ASN 51.A N ILE 47.A O no hydrogen 2.784 N/A LEU 55.A N ASN 51.A O no hydrogen 2.999 N/A ALA 56.A N LEU 52.A O no hydrogen 2.804 N/A SER 57.A N HIS 53.A O no hydrogen 2.907 N/A SER 57.A OG HIS 53.A O no hydrogen 3.248 N/A CYS 58.A N.A GLU 54.A O no hydrogen 3.116 N/A CYS 58.A N.B GLU 54.A O no hydrogen 3.063 N/A CYS 58.A SG.B GLU 54.A O no hydrogen 3.585 N/A CYS 58.A SG.B VAL 270.A O no hydrogen 3.680 N/A LEU 59.A N LEU 55.A O no hydrogen 3.106 N/A ALA 60.A N ALA 56.A O no hydrogen 2.876 N/A PHE 61.A N SER 57.A O no hydrogen 3.045 N/A LEU 62.A N CYS 58.A O.A no hydrogen 3.256 N/A LEU 62.A N CYS 58.A O.B no hydrogen 3.460 N/A TYR 63.A N LEU 59.A O no hydrogen 3.029 N/A HIS 64.A N ALA 60.A O no hydrogen 2.936 N/A VAL 65.A N PHE 61.A O no hydrogen 3.085 N/A GLY 66.A N TYR 63.A O no hydrogen 3.182 N/A LEU 67.A N LEU 62.A O no hydrogen 2.895 N/A ILE 70.A N ALA 39.A O no hydrogen 3.000 N/A VAL 71.A N PRO 171.A O no hydrogen 3.172 N/A LEU 72.A N ILE 41.A O no hydrogen 2.951 N/A HIS 73.A N LEU 173.A O no hydrogen 2.987 N/A HIS 73.A ND1 GLY 74.A O no hydrogen 3.004 N/A GLY 74.A N VAL 43.A O no hydrogen 2.919 N/A THR 75.A OG1 THR 75.A O no hydrogen 2.686 N/A GLN 78.A NE2 GLY 45.A O no hydrogen 3.573 N/A VAL 79.A N THR 75.A O no hydrogen 3.269 N/A ASN 80.A N GLY 76.A O no hydrogen 3.169 N/A ASN 80.A ND2 TYR 92.A OH no hydrogen 2.906 N/A GLY 81.A N PRO 77.A O no hydrogen 3.046 N/A ARG 82.A N GLN 78.A O no hydrogen 3.086 N/A LEU 83.A N VAL 79.A O no hydrogen 2.947 N/A GLU 84.A N ASN 80.A O no hydrogen 2.997 N/A ALA 85.A N GLY 81.A O no hydrogen 3.086 N/A GLN 86.A N ARG 82.A O no hydrogen 3.179 N/A GLY 87.A N GLU 84.A O no hydrogen 2.891 N/A ILE 88.A N LEU 83.A O no hydrogen 2.821 N/A ILE 93.A N ILE 96.A O no hydrogen 2.942 N/A ILE 96.A N ILE 93.A O no hydrogen 2.839 N/A ARG 97.A NH1 ASN 80.A OD1 no hydrogen 2.883 N/A ARG 97.A NH2 ASN 80.A OD1 no hydrogen 3.049 N/A ILE 98.A N ASP 91.A O no hydrogen 2.892 N/A THR 99.A N TYR 147.A O no hydrogen 2.939 N/A THR 99.A OG1 ARG 97.A O no hydrogen 2.958 N/A GLU 101.A N.A GLU 101.A OE1.A no hydrogen 2.701 N/A HIS 102.A NE2 GLN 86.A OE1 no hydrogen 2.775 N/A THR 103.A N ASP 100.A OD1 no hydrogen 2.985 N/A THR 103.A OG1 ASP 100.A OD1 no hydrogen 2.683 N/A MET 104.A N ASP 100.A O no hydrogen 2.888 N/A ALA 105.A N GLU 101.A O.A no hydrogen 3.167 N/A ALA 105.A N GLU 101.A O.B no hydrogen 3.144 N/A VAL 106.A N HIS 102.A O no hydrogen 3.272 N/A VAL 107.A N THR 103.A O no hydrogen 2.766 N/A ARG 108.A N MET 104.A O no hydrogen 2.793 N/A LYS 109.A N ALA 105.A O no hydrogen 3.092 N/A CYS 110.A N VAL 106.A O no hydrogen 2.903 N/A CYS 110.A SG GLN 78.A O no hydrogen 3.866 N/A CYS 110.A SG VAL 106.A O no hydrogen 3.438 N/A PHE 111.A N VAL 107.A O no hydrogen 2.928 N/A LEU 112.A N ARG 108.A O no hydrogen 3.043 N/A GLU 113.A N LYS 109.A O no hydrogen 3.080 N/A GLN 114.A N CYS 110.A O no hydrogen 2.948 N/A ASN 115.A N PHE 111.A O no hydrogen 2.850 N/A ASN 115.A ND2 HIS 73.A NE2 no hydrogen 2.920 N/A ASN 115.A ND2 ILE 172.A O no hydrogen 3.034 N/A LEU 116.A N LEU 112.A O no hydrogen 2.993 N/A LYS 117.A N GLU 113.A O no hydrogen 2.853 N/A LYS 117.A NZ GLN 114.A OE1 no hydrogen 3.195 N/A LEU 118.A N GLN 114.A O no hydrogen 3.148 N/A VAL 119.A N ASN 115.A O no hydrogen 3.058 N/A THR 120.A N LEU 116.A O no hydrogen 2.786 N/A THR 120.A OG1 LEU 116.A O no hydrogen 2.964 N/A ALA 121.A N LYS 117.A O no hydrogen 2.958 N/A LEU 122.A N LEU 118.A O no hydrogen 3.010 N/A GLU 123.A N VAL 119.A O no hydrogen 2.936 N/A GLN 124.A N THR 120.A O no hydrogen 2.834 N/A LEU 125.A N LEU 122.A O no hydrogen 2.952 N/A GLY 126.A N GLU 123.A O no hydrogen 2.945 N/A VAL 127.A N LEU 122.A O no hydrogen 2.982 N/A ALA 129.A N GLU 123.A OE2 no hydrogen 3.045 N/A ARG 130.A N LEU 170.A O no hydrogen 2.914 N/A ILE 132.A N ILE 172.A O no hydrogen 2.881 N/A GLY 135.A N GLU 178.A OE1 no hydrogen 3.014 N/A THR 138.A N SER 155.A O no hydrogen 3.157 N/A ALA 139.A N GLU 178.A O no hydrogen 2.900 N/A ASP 140.A N ASN 152.A O no hydrogen 3.141 N/A LEU 142.A N VAL 150.A O no hydrogen 3.032 N/A LYS 146.A N ASP 143.A OD1 no hydrogen 3.234 N/A TYR 147.A N ASP 143.A O no hydrogen 2.776 N/A TYR 147.A OH ASP 94.A OD2 no hydrogen 3.185 N/A LYS 148.A N LYS 144.A O no hydrogen 2.884 N/A LEU 149.A N THR 99.A O no hydrogen 2.768 N/A VAL 150.A N LYS 148.A O no hydrogen 2.645 N/A GLY 151.A N ASN 186.A O no hydrogen 2.815 N/A ASN 152.A N ASP 140.A O no hydrogen 2.736 N/A LYS 154.A N THR 138.A O no hydrogen 2.818 N/A SER 155.A N THR 138.A O no hydrogen 3.408 N/A THR 157.A N VAL 136.A O no hydrogen 2.724 N/A LYS 158.A NZ VAL 199.A O no hydrogen 3.363 N/A GLU 159.A N.A GLU 159.A OE1.A no hydrogen 2.832 N/A GLU 162.A N LYS 158.A O no hydrogen 3.037 N/A ALA 163.A N GLU 159.A O.A no hydrogen 2.784 N/A ALA 163.A N GLU 159.A O.B no hydrogen 2.779 N/A SER 164.A N PRO 160.A O no hydrogen 3.106 N/A SER 164.A OG ALA 169.A O no hydrogen 2.807 N/A ILE 165.A N ILE 161.A O no hydrogen 3.127 N/A LYS 166.A N GLU 162.A O no hydrogen 2.879 N/A ALA 167.A N ALA 163.A O no hydrogen 2.889 N/A GLY 168.A N ILE 165.A O no hydrogen 2.950 N/A ALA 169.A N SER 164.A O no hydrogen 2.849 N/A LEU 170.A N ARG 128.A O no hydrogen 2.865 N/A ILE 172.A N ARG 130.A O no hydrogen 2.954 N/A LEU 173.A N VAL 71.A O no hydrogen 2.736 N/A SER 175.A OG VAL 187.A O no hydrogen 2.716 N/A ALA 177.A N LEU 185.A O no hydrogen 2.969 N/A GLU 178.A N PHE 137.A O no hydrogen 2.973 N/A THR 179.A N GLN 183.A O no hydrogen 3.022 N/A GLY 182.A N THR 179.A O no hydrogen 2.973 N/A GLN 183.A N THR 179.A OG1 no hydrogen 3.003 N/A GLN 183.A NE2 MET 184.A O no hydrogen 2.804 N/A LEU 185.A N ALA 177.A O no hydrogen 2.824 N/A ASN 186.A N LEU 149.A O no hydrogen 2.968 N/A ASN 186.A ND2 THR 99.A OG1 no hydrogen 3.105 N/A ASP 190.A N ASN 188.A OD1 no hydrogen 2.838 N/A ALA 192.A N ASN 188.A O no hydrogen 3.009 N/A ALA 193.A N ALA 189.A O no hydrogen 2.969 N/A GLY 194.A N ASP 190.A O no hydrogen 3.271 N/A GLU 195.A N VAL 191.A O no hydrogen 3.109 N/A LEU 196.A N ALA 192.A O no hydrogen 3.140 N/A ALA 197.A N ALA 193.A O no hydrogen 2.966 N/A ARG 198.A N GLY 194.A O no hydrogen 2.907 N/A VAL 199.A N GLU 195.A O no hydrogen 3.313 N/A VAL 199.A N LEU 196.A O no hydrogen 3.174 N/A PHE 200.A N LEU 196.A O no hydrogen 2.888 N/A GLU 201.A N ALA 197.A O no hydrogen 2.763 N/A LEU 203.A N GLN 37.A O no hydrogen 2.795 N/A LYS 204.A N PHE 38.A O no hydrogen 2.853 N/A LYS 204.A NZ TYR 29.A OH no hydrogen 2.679 N/A LYS 204.A NZ LEU 277.A O no hydrogen 3.027 N/A VAL 206.A N VAL 40.A O no hydrogen 2.978 N/A TYR 207.A N ALA 266.A O no hydrogen 2.789 N/A TYR 207.A OH ASP 190.A O no hydrogen 2.920 N/A LEU 208.A N LYS 42.A O no hydrogen 2.839 N/A ASN 209.A N ILE 268.A O no hydrogen 3.152 N/A ASN 209.A ND2 GLY 213.A O no hydrogen 3.061 N/A GLY 212.A N ASN 209.A OD1 no hydrogen 2.892 N/A GLY 213.A N ASN 209.A OD1 no hydrogen 3.087 N/A ILE 214.A N THR 285.A OG1 no hydrogen 2.836 N/A ASN 216.A N GLU 221.A O no hydrogen 2.739 N/A SER 218.A N ASN 216.A OD1 no hydrogen 3.050 N/A SER 218.A OG ASN 216.A OD1 no hydrogen 2.596 N/A THR 219.A N ASN 216.A OD1 no hydrogen 3.236 N/A GLY 220.A N ASN 216.A O no hydrogen 2.532 N/A GLU 221.A N THR 219.A OG1 no hydrogen 3.154 N/A LYS 222.A NZ GLY 212.A O no hydrogen 2.607 N/A ILE 223.A N ILE 214.A O no hydrogen 2.989 N/A ILE 226.A N MET 286.A O no hydrogen 2.874 N/A ASN 227.A N GLU 231.A OE2 no hydrogen 2.814 N/A ASN 227.A ND2 TYR 291.A O no hydrogen 3.288 N/A LEU 228.A N ARG 288.A O no hydrogen 3.037 N/A ASP 229.A N ARG 289.A O no hydrogen 2.893 N/A GLU 230.A N ASN 227.A O no hydrogen 3.243 N/A GLU 231.A N ASN 227.A O no hydrogen 2.770 N/A TYR 232.A N LEU 228.A O no hydrogen 2.902 N/A LEU 235.A N GLU 231.A O no hydrogen 2.940 N/A MET 236.A N TYR 232.A O no hydrogen 3.055 N/A LYS 237.A N ASP 234.A O no hydrogen 3.263 N/A GLN 238.A N LEU 235.A O no hydrogen 3.236 N/A GLN 238.A NE2 ASP 234.A O no hydrogen 2.669 N/A VAL 241.A N GLN 238.A O no hydrogen 3.316 N/A LYS 246.A N LYS 242.A O no hydrogen 2.904 N/A LYS 246.A NZ MET 236.A O no hydrogen 3.247 N/A LEU 247.A N TYR 243.A O no hydrogen 2.913 N/A LYS 248.A N GLY 244.A O no hydrogen 3.038 N/A LYS 248.A NZ ASP 190.A OD1 no hydrogen 3.191 N/A ILE 249.A N THR 245.A O no hydrogen 2.835 N/A ARG 250.A N LYS 246.A O no hydrogen 2.853 N/A GLU 251.A N LEU 247.A O no hydrogen 3.025 N/A ILE 252.A N LYS 248.A O no hydrogen 3.099 N/A LYS 253.A N ILE 249.A O no hydrogen 2.958 N/A LYS 253.A NZ ASP 257.A OD2 no hydrogen 2.681 N/A GLU 254.A N ARG 250.A O no hydrogen 3.023 N/A LEU 255.A N GLU 251.A O no hydrogen 2.804 N/A LEU 256.A N ILE 252.A O no hydrogen 2.834 N/A ASP 257.A N LYS 253.A O no hydrogen 3.008 N/A TYR 258.A N LEU 255.A O no hydrogen 3.146 N/A LEU 259.A N LEU 255.A O no hydrogen 3.044 N/A ARG 261.A NH2 GLY 290.A O no hydrogen 2.845 N/A SER 263.A N PRO 260.A O no hydrogen 3.040 N/A VAL 265.A N ILE 287.A O no hydrogen 2.893 N/A ALA 266.A N ILE 205.A O no hydrogen 2.978 N/A ILE 267.A N THR 285.A O no hydrogen 2.852 N/A ILE 268.A N TYR 207.A O no hydrogen 2.958 N/A ASN 269.A ND2 GLU 210.A O no hydrogen 2.798 N/A GLN 271.A N ASN 269.A OD1 no hydrogen 3.123 N/A ASP 272.A N ASN 269.A O no hydrogen 3.302 N/A LEU 273.A N VAL 270.A O no hydrogen 3.145 N/A GLU 276.A N ASP 272.A O no hydrogen 3.224 N/A LEU 277.A N LEU 273.A O no hydrogen 2.828 N/A PHE 278.A N GLN 274.A O no hydrogen 2.909 N/A THR 279.A N LYS 275.A O no hydrogen 2.889 N/A THR 279.A OG1 LYS 275.A O no hydrogen 2.892 N/A SER 281.A N LYS 275.A O no hydrogen 3.328 N/A ALA 283.A N SER 281.A OG no hydrogen 3.015 N/A THR 285.A N ILE 267.A O no hydrogen 2.836 N/A THR 285.A OG1 ILE 223.A O no hydrogen 2.626 N/A MET 286.A N SER 224.A O no hydrogen 2.759 N/A ILE 287.A N VAL 265.A O no hydrogen 2.772 N/A ARG 288.A N ILE 226.A O no hydrogen 3.192 N/A