Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3zcl_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 6.A N ASP 3.A O no hydrogen 3.288 N/A LEU 7.A N LEU 4.A O no hydrogen 3.107 N/A LEU 11.A N ASN 8.A OD1 no hydrogen 3.057 N/A VAL 12.A N ASN 8.A O no hydrogen 2.936 N/A GLN 13.A N PRO 9.A O no hydrogen 3.010 N/A ALA 14.A N GLU 10.A O no hydrogen 3.171 N/A VAL 15.A N LEU 11.A O no hydrogen 2.929 N/A GLN 16.A N VAL 12.A O no hydrogen 2.816 N/A HIS 17.A N ALA 14.A O no hydrogen 3.181 N/A VAL 18.A N VAL 15.A O no hydrogen 2.963 N/A ILE 20.A N ILE 91.A O no hydrogen 2.793 N/A SER 24.A N GLY 21.A O no hydrogen 2.853 N/A LEU 25.A N PRO 22.A O no hydrogen 3.192 N/A ILE 26.A N THR 45.A O no hydrogen 2.867 N/A HIS 28.A N HIS 43.A O no hydrogen 2.856 N/A GLU 31.A N HIS 28.A O no hydrogen 3.002 N/A ILE 33.A N VAL 41.A O no hydrogen 2.819 N/A GLY 36.A N GLY 39.A O no hydrogen 2.938 N/A HIS 37.A N ASP 174.A OD1 no hydrogen 2.738 N/A PHE 38.A N ASP 174.A OD2 no hydrogen 2.956 N/A VAL 41.A N GLY 34.A O no hydrogen 2.803 N/A TYR 42.A N VAL 55.A O no hydrogen 2.857 N/A HIS 43.A N GLU 31.A O no hydrogen 3.142 N/A GLY 44.A N CYS 53.A O no hydrogen 2.960 N/A THR 45.A N ILE 26.A O no hydrogen 2.749 N/A LEU 46.A N ILE 51.A O no hydrogen 2.699 N/A LEU 47.A N SER 24.A O no hydrogen 2.721 N/A ASP 48.A N LYS 49.A O no hydrogen 2.882 N/A ILE 51.A N LEU 46.A O no hydrogen 2.725 N/A CYS 53.A N GLY 44.A O no hydrogen 2.978 N/A ALA 54.A N LEU 103.A O no hydrogen 2.870 N/A VAL 55.A N TYR 42.A O no hydrogen 2.865 N/A LYS 56.A N VAL 101.A O no hydrogen 2.753 N/A LYS 56.A NZ SER 57.A O no hydrogen 3.339 N/A LYS 56.A NZ ASP 174.A OD2 no hydrogen 2.737 N/A SER 57.A N CYS 40.A O no hydrogen 2.890 N/A ASN 59.A N SER 57.A OG no hydrogen 3.130 N/A ARG 60.A N PHE 38.A O no hydrogen 2.992 N/A ILE 61.A N LEU 58.A O no hydrogen 2.894 N/A GLU 66.A N ASP 63.A OD2 no hydrogen 3.231 N/A VAL 67.A N ASP 63.A O no hydrogen 2.963 N/A SER 68.A N ILE 64.A O no hydrogen 2.938 N/A GLN 69.A N GLY 65.A O no hydrogen 3.091 N/A GLN 69.A NE2 GLU 73.A OE2 no hydrogen 2.683 N/A PHE 70.A N GLU 66.A O no hydrogen 2.905 N/A LEU 71.A N VAL 67.A O no hydrogen 2.929 N/A THR 72.A N SER 68.A O no hydrogen 2.862 N/A THR 72.A OG1 SER 68.A O no hydrogen 2.685 N/A GLU 73.A N GLN 69.A O no hydrogen 2.961 N/A GLY 74.A N PHE 70.A O no hydrogen 3.086 N/A GLY 74.A N LEU 71.A O no hydrogen 3.219 N/A ILE 75.A N LEU 71.A O no hydrogen 2.896 N/A MET 77.A N GLY 74.A O no hydrogen 2.995 N/A LYS 78.A N ILE 75.A O no hydrogen 3.007 N/A LYS 78.A NZ ASP 79.A OD1 no hydrogen 2.925 N/A ASP 79.A N ILE 76.A O no hydrogen 2.839 N/A PHE 80.A N MET 77.A O no hydrogen 3.185 N/A SER 81.A N TYR 140.A OH no hydrogen 2.906 N/A ASN 84.A N HIS 82.A ND1 no hydrogen 2.960 N/A ASN 84.A ND2 GLN 133.A OE1 no hydrogen 3.077 N/A ASN 84.A ND2 VAL 164.A O no hydrogen 2.996 N/A VAL 85.A N HIS 82.A O no hydrogen 3.087 N/A LEU 86.A N VAL 166.A O no hydrogen 2.928 N/A LEU 89.A N VAL 102.A O no hydrogen 2.931 N/A GLY 90.A N VAL 102.A O no hydrogen 3.238 N/A ILE 91.A N VAL 18.A O no hydrogen 2.890 N/A CYS 92.A N LEU 100.A O no hydrogen 2.840 N/A CYS 92.A SG ILE 20.A O no hydrogen 3.489 N/A ARG 94.A NE SER 98.A O no hydrogen 2.898 N/A ARG 94.A NH2 SER 98.A O no hydrogen 2.894 N/A SER 98.A N ASN 59.A OD1 no hydrogen 3.244 N/A SER 98.A OG LEU 58.A O no hydrogen 3.387 N/A SER 98.A OG ILE 61.A O no hydrogen 2.696 N/A LEU 100.A N CYS 92.A O no hydrogen 3.040 N/A VAL 101.A N LYS 56.A O no hydrogen 2.954 N/A VAL 102.A N GLY 90.A O no hydrogen 2.844 N/A LEU 103.A N ALA 54.A O no hydrogen 2.864 N/A HIS 108.A N LEU 158.A O no hydrogen 3.023 N/A HIS 108.A ND1 ASP 159.A O no hydrogen 2.731 N/A GLY 109.A N MET 106.A O no hydrogen 3.022 N/A LEU 111.A N CYS 156.A O no hydrogen 2.749 N/A ARG 112.A N ALA 153.A O no hydrogen 3.265 N/A ARG 112.A NE GLY 226.A O no hydrogen 3.222 N/A ARG 112.A NH2 GLY 226.A O no hydrogen 2.951 N/A ASN 113.A N ASP 110.A OD2 no hydrogen 2.969 N/A ASN 113.A ND2 ASP 110.A OD1 no hydrogen 2.743 N/A PHE 114.A N ASP 110.A O no hydrogen 3.088 N/A ILE 115.A N LEU 111.A O no hydrogen 3.088 N/A ARG 116.A N ARG 112.A O no hydrogen 3.025 N/A ARG 116.A NH1 GLY 226.A O no hydrogen 2.893 N/A ASN 117.A N ASN 113.A O no hydrogen 3.094 N/A THR 119.A N ASN 117.A OD1 no hydrogen 2.770 N/A THR 119.A OG1 ASN 117.A OD1 no hydrogen 2.688 N/A HIS 120.A N ASN 117.A O no hydrogen 3.099 N/A THR 123.A N ASP 126.A OD2 no hydrogen 2.933 N/A ASP 126.A N THR 123.A OG1 no hydrogen 3.052 N/A LEU 127.A N THR 123.A O no hydrogen 2.933 N/A ILE 128.A N VAL 124.A O no hydrogen 2.906 N/A GLY 129.A N LYS 125.A O no hydrogen 2.912 N/A PHE 130.A N ASP 126.A O no hydrogen 3.001 N/A GLY 131.A N LEU 127.A O no hydrogen 3.039 N/A LEU 132.A N ILE 128.A O no hydrogen 2.895 N/A GLN 133.A N GLY 129.A O no hydrogen 3.099 N/A GLN 133.A NE2 PHE 162.A O no hydrogen 3.317 N/A VAL 134.A N PHE 130.A O no hydrogen 3.050 N/A ALA 135.A N GLY 131.A O no hydrogen 2.969 N/A LYS 136.A N LEU 132.A O no hydrogen 3.008 N/A GLY 137.A N GLN 133.A O no hydrogen 3.037 N/A MET 138.A N VAL 134.A O no hydrogen 2.918 N/A LYS 139.A N ALA 135.A O no hydrogen 2.852 N/A TYR 140.A N LYS 136.A O no hydrogen 3.176 N/A LEU 141.A N GLY 137.A O no hydrogen 3.130 N/A ALA 142.A N MET 138.A O no hydrogen 2.820 N/A SER 143.A N LYS 139.A O no hydrogen 3.069 N/A SER 143.A OG TYR 140.A O no hydrogen 2.558 N/A LYS 144.A N TYR 140.A O no hydrogen 3.220 N/A LYS 144.A N LEU 141.A O no hydrogen 3.028 N/A LYS 145.A N ALA 142.A O no hydrogen 2.915 N/A PHE 146.A N LEU 141.A O no hydrogen 2.944 N/A HIS 148.A N ASP 211.A OD2 no hydrogen 2.831 N/A ARG 149.A N ASP 211.A OD1 no hydrogen 3.039 N/A ALA 153.A N GLU 221.A OE2 no hydrogen 2.959 N/A ARG 154.A NE TYR 181.A OH no hydrogen 3.086 N/A ARG 154.A NH2 ASP 150.A OD1 no hydrogen 3.216 N/A ARG 154.A NH2 TYR 181.A OH no hydrogen 3.411 N/A ASN 155.A N ALA 152.A O no hydrogen 2.921 N/A ASN 155.A ND2 ASP 150.A O no hydrogen 2.831 N/A ASN 155.A ND2 TYR 181.A OH no hydrogen 3.563 N/A CYS 156.A N ALA 153.A O no hydrogen 3.334 N/A CYS 156.A SG ALA 152.A O no hydrogen 3.800 N/A MET 157.A N LYS 165.A O no hydrogen 2.876 N/A LEU 158.A N GLY 109.A O no hydrogen 2.938 N/A ASP 159.A N THR 163.A O no hydrogen 3.089 N/A GLU 160.A N GLU 160.A OE1 no hydrogen 2.600 N/A LYS 161.A N ASP 159.A OD1 no hydrogen 2.861 N/A PHE 162.A N ASP 159.A O no hydrogen 2.924 N/A THR 163.A N ASP 159.A OD1 no hydrogen 2.967 N/A VAL 164.A N GLN 133.A OE1 no hydrogen 2.780 N/A LYS 165.A N MET 157.A O no hydrogen 2.717 N/A LYS 165.A NZ PRO 83.A O no hydrogen 2.715 N/A VAL 166.A N ASN 84.A O no hydrogen 2.880 N/A ALA 167.A N ASN 155.A O no hydrogen 3.001 N/A ALA 172.A N PHE 169.A O no hydrogen 3.018 N/A ARG 173.A N GLY 170.A O no hydrogen 3.100 N/A ASP 174.A N ASP 168.A OD1 no hydrogen 2.876 N/A MET 175.A N ASP 174.A OD1 no hydrogen 2.649 N/A TYR 176.A OH ALA 172.A O no hydrogen 2.719 N/A GLU 179.A N ASP 177.A OD1 no hydrogen 3.240 N/A TYR 180.A N ASP 177.A O no hydrogen 3.369 N/A TYR 181.A N LYS 178.A O no hydrogen 3.273 N/A TYR 181.A OH ASP 150.A OD1 no hydrogen 3.387 N/A TYR 181.A OH ASP 150.A OD2 no hydrogen 2.498 N/A SER 182.A N LEU 191.A O no hydrogen 2.840 N/A HIS 184.A N SER 182.A OG no hydrogen 3.020 N/A HIS 184.A ND1 THR 235.A OG1 no hydrogen 2.794 N/A ASN 185.A N VAL 183.A O no hydrogen 2.796 N/A ASN 185.A ND2 SER 182.A O no hydrogen 2.957 N/A ASN 185.A ND2 ALA 189.A O no hydrogen 2.877 N/A LYS 186.A NZ GLN 202.A O no hydrogen 2.736 N/A THR 187.A N ASN 185.A OD1 no hydrogen 2.843 N/A THR 187.A OG1 ASN 185.A OD1 no hydrogen 2.539 N/A GLY 188.A N ASN 185.A O no hydrogen 3.110 N/A ALA 189.A N THR 187.A OG1 no hydrogen 3.134 N/A LEU 191.A N SER 182.A O no hydrogen 3.021 N/A VAL 193.A N LEU 191.A O no hydrogen 2.863 N/A LYS 194.A NZ TYR 230.A O no hydrogen 2.786 N/A LYS 194.A NZ VAL 233.A O no hydrogen 2.795 N/A TRP 195.A N PRO 192.A O no hydrogen 2.879 N/A TRP 195.A NE1 GLU 221.A OE2 no hydrogen 2.865 N/A MET 196.A N VAL 193.A O no hydrogen 3.333 N/A GLU 199.A N GLU 199.A OE1 no hydrogen 2.846 N/A SER 200.A N ALA 197.A O no hydrogen 2.959 N/A SER 200.A OG LYS 205.A O no hydrogen 2.800 N/A LEU 201.A N ALA 197.A O no hydrogen 3.143 N/A GLN 202.A N LEU 198.A O no hydrogen 3.101 N/A GLN 202.A NE2 LEU 198.A O no hydrogen 3.636 N/A THR 203.A N GLU 199.A O no hydrogen 2.819 N/A THR 203.A OG1 GLU 199.A O no hydrogen 2.609 N/A GLN 204.A N SER 200.A O no hydrogen 2.767 N/A LYS 205.A N THR 203.A OG1 no hydrogen 3.353 N/A THR 207.A N SER 210.A OG no hydrogen 2.728 N/A LYS 209.A NZ ARG 273.A O no hydrogen 2.764 N/A SER 210.A N THR 207.A O no hydrogen 3.084 N/A SER 210.A N THR 207.A OG1 no hydrogen 3.120 N/A SER 210.A OG THR 207.A O no hydrogen 2.750 N/A ASP 211.A N THR 207.A O no hydrogen 3.057 N/A VAL 212.A N THR 208.A O no hydrogen 2.951 N/A TRP 213.A N LYS 209.A O no hydrogen 3.295 N/A SER 214.A N SER 210.A O no hydrogen 3.115 N/A SER 214.A OG TRP 195.A O no hydrogen 2.775 N/A SER 214.A OG SER 210.A O no hydrogen 3.260 N/A PHE 215.A N ASP 211.A O no hydrogen 2.849 N/A GLY 216.A N VAL 212.A O no hydrogen 3.056 N/A VAL 217.A N TRP 213.A O no hydrogen 3.216 N/A LEU 218.A N SER 214.A O no hydrogen 2.890 N/A LEU 219.A N PHE 215.A O no hydrogen 2.839 N/A TRP 220.A N GLY 216.A O no hydrogen 3.120 N/A TRP 220.A NE1 LEU 249.A O no hydrogen 2.761 N/A GLU 221.A N VAL 217.A O no hydrogen 2.866 N/A LEU 222.A N LEU 218.A O no hydrogen 2.908 N/A MET 223.A N LEU 219.A O no hydrogen 3.004 N/A THR 224.A N TRP 220.A O no hydrogen 3.058 N/A THR 224.A OG1 TRP 220.A O no hydrogen 3.098 N/A THR 224.A OG1 GLU 221.A O no hydrogen 3.092 N/A ARG 225.A N LEU 222.A O no hydrogen 2.965 N/A ARG 225.A NE ILE 115.A O no hydrogen 2.846 N/A ARG 225.A NH2 ILE 115.A O no hydrogen 2.834 N/A GLY 226.A N GLU 221.A O no hydrogen 2.764 N/A ALA 227.A N THR 224.A OG1 no hydrogen 3.112 N/A ASP 232.A N ASP 232.A OD1 no hydrogen 2.535 N/A VAL 233.A N TYR 230.A O no hydrogen 3.108 N/A THR 235.A OG1 HIS 184.A ND1 no hydrogen 2.794 N/A PHE 236.A N ASN 234.A OD1 no hydrogen 2.943 N/A ASP 237.A N ASN 234.A O no hydrogen 2.776 N/A TYR 241.A N ASP 237.A O no hydrogen 2.981 N/A TYR 241.A OH ARG 247.A O no hydrogen 3.256 N/A LEU 242.A N ILE 238.A O no hydrogen 3.134 N/A LEU 243.A N THR 239.A O no hydrogen 2.908 N/A GLN 244.A N VAL 240.A O no hydrogen 2.987 N/A GLY 245.A N LEU 242.A O no hydrogen 2.865 N/A ARG 246.A N TYR 241.A O no hydrogen 3.253 N/A ARG 246.A NE GLN 244.A OE1 no hydrogen 2.845 N/A ARG 247.A NE TRP 266.A O no hydrogen 3.092 N/A ARG 247.A NH1 LEU 242.A O no hydrogen 3.038 N/A ARG 247.A NH1 ARG 246.A O no hydrogen 2.851 N/A ARG 247.A NH2 TRP 266.A O no hydrogen 2.952 N/A GLN 250.A NE2 CYS 254.A O no hydrogen 2.908 N/A GLN 250.A NE2 ASP 256.A OD1 no hydrogen 2.914 N/A CYS 254.A N PRO 251.A O no hydrogen 3.082 N/A CYS 254.A SG PRO 255.A O no hydrogen 3.496 N/A LEU 258.A N PRO 255.A O no hydrogen 2.908 N/A TYR 259.A N PRO 255.A O no hydrogen 3.108 N/A TYR 259.A OH LEU 248.A O no hydrogen 2.667 N/A GLU 260.A N ASP 256.A O no hydrogen 3.047 N/A VAL 261.A N PRO 257.A O no hydrogen 3.158 N/A MET 262.A N LEU 258.A O no hydrogen 3.011 N/A LEU 263.A N TYR 259.A O no hydrogen 2.929 N/A LYS 264.A N GLU 260.A O no hydrogen 3.003 N/A CYS 265.A N VAL 261.A O no hydrogen 3.119 N/A CYS 265.A SG VAL 261.A O no hydrogen 3.369 N/A TRP 266.A N LEU 263.A O no hydrogen 3.054 N/A HIS 267.A N LYS 264.A O no hydrogen 3.343 N/A GLU 271.A N GLU 271.A OE1 no hydrogen 2.691 N/A MET 272.A N LYS 269.A O no hydrogen 2.923 N/A ARG 273.A N ALA 270.A O no hydrogen 3.163 N/A ARG 273.A NE LYS 209.A O no hydrogen 3.113 N/A ARG 273.A NH1 GLU 199.A OE1 no hydrogen 3.480 N/A ARG 273.A NH1 HIS 267.A O no hydrogen 2.648 N/A ARG 273.A NH2 GLU 199.A OE1 no hydrogen 3.427 N/A ARG 273.A NH2 GLU 199.A OE2 no hydrogen 2.603 N/A ARG 273.A NH2 LYS 209.A O no hydrogen 2.933 N/A GLU 278.A N SER 275.A OG no hydrogen 3.043 N/A LEU 279.A N SER 275.A O no hydrogen 2.964 N/A VAL 280.A N PHE 276.A O no hydrogen 2.922 N/A SER 281.A N SER 277.A O no hydrogen 3.223 N/A SER 281.A OG SER 277.A O no hydrogen 3.280 N/A ARG 282.A N GLU 278.A O no hydrogen 2.883 N/A ARG 282.A NE GLU 278.A OE2 no hydrogen 2.736 N/A ARG 282.A NH2 GLU 278.A OE2 no hydrogen 3.202 N/A ILE 283.A N LEU 279.A O no hydrogen 2.875 N/A SER 284.A N VAL 280.A O no hydrogen 2.895 N/A ALA 285.A N SER 281.A O no hydrogen 3.271 N/A ILE 286.A N ARG 282.A O no hydrogen 3.215 N/A PHE 287.A N ILE 283.A O no hydrogen 2.774 N/A SER 288.A N SER 284.A O no hydrogen 2.953 N/A SER 288.A OG SER 284.A O no hydrogen 2.903 N/A THR 289.A N ILE 286.A O no hydrogen 3.118 N/A THR 289.A OG1 ILE 286.A O no hydrogen 2.601 N/A PHE 290.A N PHE 287.A O no hydrogen 2.988 N/A ILE 291.A N PHE 287.A O no hydrogen 3.372 N/A