Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4zak_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 4.A N CYS 98.A O no hydrogen 2.889 N/A ARG 5.A N TRP 25.A O no hydrogen 2.786 N/A CYS 6.A N ALA 96.A O no hydrogen 2.501 N/A LEU 7.A N VAL 23.A O no hydrogen 2.840 N/A GLN 8.A N LEU 94.A O no hydrogen 2.873 N/A GLN 8.A NE2 SER 10.A OG no hydrogen 2.886 N/A MET 9.A N ASP 21.A O no hydrogen 2.918 N/A SER 10.A N ILE 92.A O no hydrogen 2.718 N/A SER 10.A OG THR 20.A OG1 no hydrogen 2.666 N/A SER 11.A N ARG 19.A O no hydrogen 2.988 N/A SER 11.A OG GLU 91.A OE1 no hydrogen 2.506 N/A SER 11.A OG GLU 91.A OE2 no hydrogen 3.189 N/A PHE 12.A N ILE 90.A O no hydrogen 2.793 N/A ALA 13.A N TRP 17.A O no hydrogen 3.246 N/A SER 16.A N ASN 14.A OD1 no hydrogen 3.463 N/A SER 16.A OG ASN 14.A OD1 no hydrogen 3.152 N/A TRP 17.A N ASN 14.A OD1 no hydrogen 3.061 N/A ARG 19.A N SER 11.A O no hydrogen 3.107 N/A ARG 19.A NE ASP 21.A OD1 no hydrogen 2.817 N/A ARG 19.A NH2 ASP 21.A OD1 no hydrogen 3.378 N/A ARG 19.A NH2 ASP 21.A OD2 no hydrogen 3.193 N/A THR 20.A N ASN 36.A OD1 no hydrogen 2.765 N/A THR 20.A OG1 SER 10.A OG no hydrogen 2.666 N/A ASP 21.A N MET 9.A O no hydrogen 3.005 N/A SER 22.A N TRP 34.A O no hydrogen 2.988 N/A VAL 23.A N LEU 7.A O no hydrogen 3.001 N/A VAL 24.A N HIS 32.A O no hydrogen 3.131 N/A TRP 25.A N ARG 5.A O no hydrogen 2.862 N/A LEU 26.A N LEU 29.A O no hydrogen 2.924 N/A GLY 27.A N THR 3.A O no hydrogen 3.028 N/A LEU 29.A N LEU 26.A O no hydrogen 3.468 N/A GLN 30.A N GLU 231.A OE1 no hydrogen 3.286 N/A GLN 30.A NE2 HIS 32.A O no hydrogen 2.864 N/A THR 31.A N VAL 24.A O no hydrogen 2.855 N/A THR 31.A OG1 HIS 32.A ND1 no hydrogen 2.758 N/A HIS 32.A ND1 THR 31.A OG1 no hydrogen 2.758 N/A ARG 33.A N SER 42.A O no hydrogen 2.928 N/A TRP 34.A N SER 22.A O no hydrogen 2.774 N/A TRP 34.A NE1 SER 38.A O no hydrogen 3.085 N/A SER 35.A OG ASP 37.A OD2 no hydrogen 2.656 N/A ASN 36.A N ASP 21.A OD2 no hydrogen 2.959 N/A ASP 37.A N SER 35.A OG no hydrogen 3.289 N/A SER 38.A N SER 35.A O no hydrogen 3.179 N/A SER 38.A OG THR 40.A O no hydrogen 2.591 N/A THR 40.A N SER 38.A OG no hydrogen 3.197 N/A ILE 41.A N GLN 61.A OE1 no hydrogen 2.745 N/A SER 42.A N ARG 33.A O no hydrogen 2.688 N/A THR 44.A N THR 31.A O no hydrogen 3.073 N/A THR 44.A OG1 GLN 30.A O no hydrogen 2.827 N/A LYS 45.A N SER 48.A OG no hydrogen 2.964 N/A LYS 45.A NZ GLN 30.A O no hydrogen 3.239 N/A LYS 45.A NZ GLU 231.A OE1 no hydrogen 3.166 N/A LYS 45.A NZ GLU 231.A OE2 no hydrogen 2.662 N/A TRP 47.A NE1 ASP 176.A OD2 no hydrogen 3.017 N/A SER 48.A N LYS 45.A O no hydrogen 3.319 N/A SER 48.A OG THR 31.A O no hydrogen 2.665 N/A SER 48.A OG LYS 45.A O no hydrogen 2.760 N/A GLN 49.A NE2 LEU 52.A O no hydrogen 2.817 N/A GLN 49.A NE2 ASN 54.A OD1 no hydrogen 2.957 N/A GLY 50.A N TRP 47.A O no hydrogen 3.051 N/A LEU 52.A N GLN 49.A O no hydrogen 3.322 N/A SER 53.A N GLN 56.A OE1 no hydrogen 2.746 N/A SER 53.A OG GLN 56.A OE1 no hydrogen 3.078 N/A GLN 56.A N SER 53.A OG no hydrogen 3.376 N/A TRP 57.A N SER 53.A O no hydrogen 2.938 N/A GLU 58.A N ASN 54.A O no hydrogen 2.935 N/A LYS 59.A N GLN 55.A O no hydrogen 3.103 N/A LEU 60.A N GLN 56.A O no hydrogen 3.059 N/A GLN 61.A N TRP 57.A O no hydrogen 2.751 N/A HIS 62.A N GLU 58.A O no hydrogen 2.978 N/A MET 63.A N LYS 59.A O no hydrogen 3.339 N/A PHE 64.A N LEU 60.A O no hydrogen 3.339 N/A GLN 65.A N GLN 61.A O no hydrogen 2.832 N/A GLN 65.A NE2 ALA 39.A O no hydrogen 2.709 N/A VAL 66.A N HIS 62.A O no hydrogen 3.058 N/A TYR 67.A N MET 63.A O no hydrogen 2.876 N/A TYR 67.A OH GLN 8.A OE1 no hydrogen 2.437 N/A ARG 68.A N PHE 64.A O no hydrogen 2.858 N/A ARG 68.A NH1 SER 35.A O no hydrogen 2.984 N/A ARG 68.A NH1 SER 38.A O no hydrogen 3.267 N/A ARG 68.A NH2 SER 38.A O no hydrogen 2.979 N/A SER 70.A N VAL 66.A O no hydrogen 2.931 N/A SER 70.A OG VAL 66.A O no hydrogen 2.716 N/A PHE 71.A N TYR 67.A O no hydrogen 2.610 N/A THR 72.A N ARG 68.A O no hydrogen 3.226 N/A THR 72.A OG1 ARG 68.A O no hydrogen 2.760 N/A ARG 73.A N VAL 69.A O no hydrogen 3.188 N/A ASP 74.A N SER 70.A O no hydrogen 2.919 N/A ILE 75.A N PHE 71.A O no hydrogen 3.064 N/A GLN 76.A N THR 72.A O no hydrogen 3.298 N/A GLU 77.A N ARG 73.A O no hydrogen 2.862 N/A LEU 78.A N ASP 74.A O no hydrogen 2.830 N/A VAL 79.A N ILE 75.A O no hydrogen 2.863 N/A LYS 80.A N GLN 76.A O no hydrogen 3.330 N/A LYS 80.A NZ GLU 77.A OE1 no hydrogen 2.903 N/A MET 81.A N GLU 77.A O no hydrogen 3.120 N/A MET 82.A N LEU 78.A O no hydrogen 3.059 N/A SER 83.A N VAL 79.A O no hydrogen 3.071 N/A SER 83.A OG LYS 80.A O no hydrogen 3.129 N/A LYS 85.A N MET 82.A O no hydrogen 3.131 N/A ILE 90.A N PHE 12.A O no hydrogen 2.933 N/A GLU 91.A N GLN 115.A OE1 no hydrogen 2.924 N/A ILE 92.A N SER 10.A O no hydrogen 2.889 N/A GLN 93.A N ALA 113.A O no hydrogen 3.072 N/A LEU 94.A N GLN 8.A O no hydrogen 2.888 N/A SER 95.A N HIS 111.A O no hydrogen 2.764 N/A ALA 96.A N CYS 6.A O no hydrogen 2.977 N/A GLY 97.A N PHE 109.A O no hydrogen 3.113 N/A CYS 98.A N PHE 4.A O no hydrogen 3.137 N/A GLU 99.A N GLU 107.A O no hydrogen 2.906 N/A MET 100.A N TYR 2.A O no hydrogen 2.916 N/A TYR 101.A N ALA 105.A O no hydrogen 2.949 N/A TYR 101.A OH GLU 107.A OE1 no hydrogen 2.879 N/A GLU 107.A N GLU 99.A O no hydrogen 3.132 N/A SER 108.A OG LEU 158.A O no hydrogen 2.451 N/A PHE 109.A N GLY 97.A O no hydrogen 2.802 N/A HIS 111.A N SER 95.A O no hydrogen 2.855 N/A VAL 112.A N VAL 120.A O no hydrogen 2.662 N/A ALA 113.A N GLN 93.A O no hydrogen 2.744 N/A PHE 114.A N LYS 117.A O no hydrogen 2.805 N/A GLN 115.A N GLU 91.A O no hydrogen 2.886 N/A GLN 115.A NE2 PRO 89.A O no hydrogen 3.346 N/A LYS 117.A N PHE 114.A O no hydrogen 3.143 N/A VAL 119.A N VAL 112.A O no hydrogen 3.027 N/A VAL 120.A N VAL 112.A O no hydrogen 3.262 N/A ARG 121.A N GLN 128.A O no hydrogen 3.021 N/A PHE 122.A N LEU 110.A O no hydrogen 3.075 N/A TRP 123.A N SER 126.A O no hydrogen 2.963 N/A SER 126.A N TRP 123.A O no hydrogen 3.336 N/A TRP 127.A N ASN 145.A OD1 no hydrogen 2.720 N/A GLN 128.A N ARG 121.A O no hydrogen 3.029 N/A VAL 130.A N VAL 119.A O no hydrogen 2.958 N/A ALA 133.A N VAL 130.A O no hydrogen 3.230 N/A LEU 137.A N PRO 134.A O no hydrogen 3.329 N/A ASP 138.A N SER 135.A O no hydrogen 2.981 N/A LEU 139.A N TRP 136.A O no hydrogen 3.359 N/A ILE 141.A N LEU 137.A O no hydrogen 2.915 N/A LYS 142.A N ASP 138.A O no hydrogen 3.023 N/A VAL 143.A N LEU 139.A O no hydrogen 3.000 N/A LEU 144.A N PRO 140.A O no hydrogen 2.891 N/A ASN 145.A N ILE 141.A O no hydrogen 2.998 N/A ASN 145.A ND2 TRP 127.A O no hydrogen 2.827 N/A ALA 146.A N VAL 143.A O no hydrogen 3.201 N/A ASP 147.A N LEU 144.A O no hydrogen 3.288 N/A THR 150.A N ASP 147.A OD1 no hydrogen 3.169 N/A THR 150.A OG1 ASP 147.A OD2 no hydrogen 2.674 N/A SER 151.A N ASP 147.A O no hydrogen 3.282 N/A SER 151.A OG THR 125.A O no hydrogen 2.671 N/A ALA 152.A N GLN 148.A O no hydrogen 3.053 N/A THR 153.A N GLY 149.A O no hydrogen 3.108 N/A THR 153.A OG1 GLY 149.A O no hydrogen 2.798 N/A VAL 154.A N THR 150.A O no hydrogen 2.860 N/A GLN 155.A N SER 151.A O no hydrogen 2.921 N/A GLN 155.A NE2 THR 125.A O no hydrogen 3.582 N/A GLN 155.A NE2 SER 151.A O no hydrogen 3.640 N/A GLN 155.A NE2 SER 151.A OG no hydrogen 3.165 N/A MET 156.A N ALA 152.A O no hydrogen 3.085 N/A LEU 157.A N THR 153.A O no hydrogen 2.830 N/A LEU 158.A N VAL 154.A O no hydrogen 2.859 N/A ASN 159.A N GLN 155.A O no hydrogen 2.872 N/A ASP 160.A N MET 156.A O no hydrogen 3.042 N/A THR 161.A N MET 156.A O no hydrogen 3.056 N/A THR 161.A OG1 MET 156.A O no hydrogen 3.406 N/A CYS 162.A N LEU 157.A O no hydrogen 3.035 N/A LEU 164.A N ASP 160.A O no hydrogen 3.262 N/A PHE 165.A N THR 161.A O no hydrogen 2.861 N/A VAL 166.A N CYS 162.A O no hydrogen 2.873 N/A ARG 167.A N PRO 163.A O no hydrogen 2.897 N/A GLY 168.A N LEU 164.A O no hydrogen 3.219 N/A LEU 169.A N PHE 165.A O no hydrogen 2.948 N/A LEU 170.A N VAL 166.A O no hydrogen 2.919 N/A ALA 172.A N GLY 168.A O no hydrogen 3.045 N/A GLY 173.A N LEU 169.A O no hydrogen 2.926 N/A LYS 174.A N GLU 171.A O no hydrogen 3.437 N/A LEU 177.A N GLY 173.A O no hydrogen 2.998 N/A GLU 178.A N LYS 174.A O no hydrogen 2.913 N/A LYS 179.A N ASP 176.A O no hydrogen 3.298 N/A GLU 181.A N TYR 202.A O no hydrogen 2.943 N/A VAL 184.A N SER 199.A O no hydrogen 2.966 N/A TRP 186.A N HIS 197.A O no hydrogen 3.068 N/A SER 188.A N VAL 195.A O no hydrogen 3.103 N/A SER 188.A OG HIS 197.A NE2 no hydrogen 2.700 N/A VAL 190.A N GLN 193.A O no hydrogen 2.979 N/A GLN 193.A N VAL 190.A O no hydrogen 2.913 N/A LEU 194.A N LEU 239.A O no hydrogen 2.977 N/A VAL 195.A N SER 188.A O no hydrogen 2.770 N/A CYS 196.A N ALA 237.A O no hydrogen 2.985 N/A HIS 197.A N TRP 186.A O no hydrogen 2.898 N/A HIS 197.A ND1 TYR 234.A OH no hydrogen 2.773 N/A HIS 197.A NE2 SER 188.A OG no hydrogen 2.700 N/A VAL 198.A N LEU 235.A O no hydrogen 2.879 N/A SER 199.A N VAL 184.A O no hydrogen 3.028 N/A GLY 200.A N TRP 233.A O no hydrogen 2.840 N/A TYR 202.A N GLU 181.A O no hydrogen 3.203 N/A TYR 202.A OH ASP 28.A OD1 no hydrogen 2.662 N/A TRP 207.A N LYS 254.A O no hydrogen 3.105 N/A MET 209.A N ARG 252.A O no hydrogen 3.300 N/A TRP 210.A NE1 ALA 237.A O no hydrogen 2.891 N/A MET 211.A N ALA 250.A O no hydrogen 2.698 N/A ARG 212.A N GLN 215.A O no hydrogen 3.075 N/A GLN 215.A N ARG 212.A O no hydrogen 3.312 N/A GLN 217.A N TRP 210.A O no hydrogen 2.973 N/A THR 220.A OG1 GLN 217.A O no hydrogen 3.055 N/A HIS 221.A N THR 238.A O no hydrogen 2.962 N/A GLY 223.A N GLN 236.A O no hydrogen 2.886 N/A LEU 226.A N TYR 234.A O no hydrogen 2.754 N/A ASN 228.A N THR 232.A O no hydrogen 2.927 N/A ASN 228.A ND2 SER 199.A OG no hydrogen 3.281 N/A ASN 228.A ND2 THR 232.A OG1 no hydrogen 3.202 N/A THR 232.A OG1 ASP 230.A OD1 no hydrogen 2.609 N/A TRP 233.A N PHE 201.A O no hydrogen 3.024 N/A TRP 233.A NE1 ASP 28.A OD2 no hydrogen 2.811 N/A TYR 234.A N LEU 226.A O no hydrogen 2.681 N/A TYR 234.A OH HIS 197.A ND1 no hydrogen 2.773 N/A TYR 234.A OH GLN 236.A OE1 no hydrogen 3.012 N/A LEU 235.A N VAL 198.A O no hydrogen 2.850 N/A ALA 237.A N CYS 196.A O no hydrogen 3.036 N/A THR 238.A N HIS 221.A O no hydrogen 2.910 N/A THR 238.A OG1 HIS 221.A O no hydrogen 3.419 N/A LEU 239.A N LEU 194.A O no hydrogen 2.947 N/A VAL 241.A N ARG 192.A O no hydrogen 3.037 N/A GLY 244.A N GLU 246.A OE1 no hydrogen 2.767 N/A GLU 245.A N GLU 242.A O no hydrogen 3.217 N/A ALA 250.A N MET 211.A O no hydrogen 2.736 N/A CYS 251.A N LEU 265.A O no hydrogen 2.984 N/A ARG 252.A N MET 209.A O no hydrogen 3.144 N/A VAL 253.A N ILE 263.A O no hydrogen 3.013 N/A LYS 254.A N TRP 207.A O no hydrogen 2.937 N/A LYS 254.A NZ ASP 262.A OD2 no hydrogen 2.813 N/A HIS 255.A ND1 SER 257.A OG no hydrogen 2.705 N/A HIS 255.A NE2 PRO 203.A O no hydrogen 2.937 N/A SER 256.A OG GLN 180.A OE1 no hydrogen 2.726 N/A SER 257.A N HIS 255.A ND1 no hydrogen 3.104 N/A SER 257.A OG GLU 181.A O no hydrogen 3.194 N/A SER 257.A OG HIS 255.A ND1 no hydrogen 2.705 N/A LEU 258.A N HIS 255.A O no hydrogen 2.993 N/A ILE 263.A N VAL 253.A O no hydrogen 3.143 N/A LEU 265.A N CYS 251.A O no hydrogen 3.157 N/A TRP 267.A N LEU 249.A O no hydrogen 3.149 N/A