Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4g0j_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 1.A N VAL 105.A O no hydrogen 3.151 N/A GLU 2.A N GLU 2.A OE1 no hydrogen 2.596 N/A LEU 3.A N ARG 103.A O no hydrogen 3.185 N/A ALA 4.A N LEU 101.A O no hydrogen 2.663 N/A CYS 5.A N GLU 2.A O no hydrogen 2.914 N/A CYS 5.A SG GLU 2.A OE1 no hydrogen 3.395 N/A PHE 6.A N LEU 3.A O no hydrogen 3.149 N/A CYS 7.A SG LEU 3.A O no hydrogen 3.803 N/A TYR 8.A N ILE 19.A O no hydrogen 3.119 N/A SER 15.A N GLU 12.A O no hydrogen 3.336 N/A LYS 17.A N HIS 10.A O no hydrogen 2.927 N/A LYS 17.A NZ GLU 12.A OE2 no hydrogen 3.005 N/A PHE 18.A N ASN 88.A OD1 no hydrogen 2.591 N/A ILE 19.A N TYR 8.A O no hydrogen 3.103 N/A PHE 21.A N PHE 6.A O no hydrogen 3.329 N/A ILE 26.A N ASN 22.A O no hydrogen 3.367 N/A LYS 27.A N ASN 23.A O no hydrogen 3.163 N/A LYS 27.A NZ GLU 72.A OE2 no hydrogen 3.023 N/A ALA 28.A N LEU 24.A O no hydrogen 2.749 N/A MET 29.A N ALA 25.A O no hydrogen 2.916 N/A LEU 30.A N ILE 26.A O no hydrogen 3.025 N/A THR 31.A N ALA 28.A O no hydrogen 3.061 N/A THR 31.A OG1 ALA 28.A O no hydrogen 2.692 N/A ALA 32.A N MET 29.A O no hydrogen 2.821 N/A ASP 38.A N ASP 35.A O no hydrogen 2.884 N/A LYS 41.A N ASP 38.A O no hydrogen 2.861 N/A SER 45.A OG GLY 49.A O no hydrogen 3.108 N/A TYR 48.A N SER 45.A OG no hydrogen 3.217 N/A ALA 51.A N TYR 43.A O no hydrogen 2.826 N/A GLN 55.A N MET 39.A O no hydrogen 3.037 N/A PHE 56.A N PRO 53.A O no hydrogen 2.865 N/A ARG 59.A N PHE 56.A O no hydrogen 3.095 N/A ARG 59.A NE GLU 2.A OE2 no hydrogen 3.067 N/A ARG 59.A NH2 GLU 2.A OE2 no hydrogen 2.930 N/A TYR 60.A N LYS 57.A O no hydrogen 3.425 N/A TYR 60.A OH CYS 5.A O no hydrogen 2.624 N/A ASN 61.A N MET 69.A O no hydrogen 2.969 N/A ASN 61.A ND2 ASN 70.A OD1 no hydrogen 2.951 N/A THR 62.A N ASN 65.A O no hydrogen 2.929 N/A THR 62.A OG1 ASP 64.A OD1 no hydrogen 3.225 N/A ASP 64.A N ASP 64.A OD1 no hydrogen 2.542 N/A ASN 65.A N THR 62.A O no hydrogen 3.444 N/A ASN 65.A ND2 LYS 58.A O no hydrogen 2.626 N/A ASN 65.A ND2 TYR 60.A O no hydrogen 3.100 N/A ARG 67.A N ASN 65.A OD1 no hydrogen 3.129 N/A GLY 68.A N ASN 61.A OD1 no hydrogen 2.303 N/A MET 69.A N ARG 59.A O no hydrogen 3.126 N/A ASN 70.A N LEU 175.A O no hydrogen 2.942 N/A ASN 70.A ND2 GLN 174.A O no hydrogen 3.062 N/A THR 73.A N ASN 70.A O no hydrogen 3.029 N/A THR 73.A OG1 ASN 70.A O no hydrogen 3.128 N/A PHE 76.A N THR 73.A O no hydrogen 2.861 N/A PHE 76.A N THR 73.A OG1 no hydrogen 3.363 N/A LYS 78.A N ILE 74.A O no hydrogen 3.334 N/A LYS 78.A NZ GLU 118.A OE1 no hydrogen 3.354 N/A VAL 79.A N MET 75.A O no hydrogen 2.995 N/A ALA 80.A N PHE 76.A O no hydrogen 2.968 N/A MET 81.A N THR 77.A O no hydrogen 2.765 N/A LEU 82.A N LYS 78.A O no hydrogen 2.906 N/A ILE 83.A N VAL 79.A O no hydrogen 2.811 N/A CYS 84.A N ALA 80.A O no hydrogen 2.801 N/A CYS 84.A SG PHE 18.A O no hydrogen 3.182 N/A GLU 85.A N MET 81.A O no hydrogen 2.726 N/A ALA 86.A N LEU 82.A O no hydrogen 3.327 N/A LEU 87.A N ILE 83.A O no hydrogen 2.983 N/A ASN 88.A N CYS 84.A O no hydrogen 3.054 N/A ASN 88.A ND2 PHE 18.A O no hydrogen 3.319 N/A SER 89.A N ALA 86.A O no hydrogen 2.949 N/A SER 89.A OG ALA 86.A O no hydrogen 2.441 N/A LEU 90.A N LEU 87.A O no hydrogen 2.829 N/A ASN 96.A N THR 93.A O no hydrogen 3.053 N/A VAL 97.A N THR 93.A O no hydrogen 2.913 N/A SER 98.A OG ASN 99.A OD1 no hydrogen 3.185 N/A VAL 100.A N ASN 96.A O no hydrogen 2.937 N/A LEU 101.A N VAL 97.A O no hydrogen 3.110 N/A SER 102.A N SER 98.A O no hydrogen 2.951 N/A SER 102.A OG SER 98.A O no hydrogen 2.537 N/A SER 102.A OG ASN 99.A O no hydrogen 3.256 N/A ARG 103.A N VAL 100.A O no hydrogen 3.386 N/A VAL 105.A N ALA 1.A O no hydrogen 2.812 N/A ARG 108.A NE MET 176.A O no hydrogen 3.008 N/A HIS 109.A N SER 106.A OG no hydrogen 2.748 N/A LEU 110.A N SER 106.A O no hydrogen 3.155 N/A GLU 111.A N ILE 107.A O no hydrogen 2.870 N/A ASN 112.A N ARG 108.A O no hydrogen 3.068 N/A ASN 112.A ND2 GLU 152.A OE1 no hydrogen 3.094 N/A LEU 113.A N HIS 109.A O no hydrogen 3.230 N/A VAL 114.A N LEU 110.A O no hydrogen 2.938 N/A ILE 115.A N GLU 111.A O no hydrogen 3.005 N/A ARG 116.A N ASN 112.A O no hydrogen 3.035 N/A ARG 116.A NE ASP 122.A OD2 no hydrogen 2.851 N/A ARG 116.A NH1 ALA 151.A O no hydrogen 2.381 N/A ARG 116.A NH2 ASP 122.A OD1 no hydrogen 3.068 N/A ARG 116.A NH2 ASP 122.A OD2 no hydrogen 3.519 N/A LYS 117.A N LEU 113.A O no hydrogen 2.810 N/A GLU 118.A N VAL 114.A O no hydrogen 3.137 N/A ASP 122.A N ASN 119.A O no hydrogen 3.153 N/A LEU 124.A N ASP 122.A OD1 no hydrogen 2.723 N/A HIS 126.A N ILE 123.A O no hydrogen 2.730 N/A SER 127.A N ILE 123.A O no hydrogen 2.517 N/A LEU 130.A N SER 127.A OG no hydrogen 3.225 N/A LEU 131.A N SER 127.A O no hydrogen 3.034 N/A LEU 132.A N LYS 128.A O no hydrogen 2.909 N/A LYS 133.A N ASP 129.A O no hydrogen 3.330 N/A LYS 133.A NZ GLU 144.A OE1 no hydrogen 3.169 N/A LYS 133.A NZ GLU 144.A OE2 no hydrogen 2.689 N/A SER 134.A N LEU 130.A O no hydrogen 3.143 N/A SER 134.A OG LEU 130.A O no hydrogen 2.953 N/A THR 135.A N LEU 131.A O no hydrogen 3.009 N/A THR 135.A OG1 LEU 131.A O no hydrogen 3.304 N/A LEU 136.A N LEU 132.A O no hydrogen 2.592 N/A ILE 137.A N LYS 133.A O no hydrogen 3.197 N/A ALA 138.A N SER 134.A O no hydrogen 3.441 N/A ILE 139.A N THR 135.A O no hydrogen 2.869 N/A GLY 140.A N ILE 137.A O no hydrogen 2.837 N/A GLN 141.A N LEU 136.A O no hydrogen 2.729 N/A THR 147.A N THR 150.A OG1 no hydrogen 3.090 N/A THR 147.A OG1 THR 150.A OG1 no hydrogen 2.964 N/A THR 148.A N LEU 190.A O no hydrogen 3.174 N/A THR 148.A OG1 THR 189.A OG1 no hydrogen 2.502 N/A THR 148.A OG1 ASN 191.A OD1 no hydrogen 2.783 N/A THR 150.A N THR 147.A O no hydrogen 3.249 N/A THR 150.A OG1 THR 147.A O no hydrogen 3.279 N/A THR 150.A OG1 THR 147.A OG1 no hydrogen 2.964 N/A ALA 151.A N THR 148.A O no hydrogen 3.107 N/A GLU 152.A N GLU 146.A OE2 no hydrogen 2.880 N/A GLU 155.A N LYS 167.A O no hydrogen 3.072 N/A VAL 157.A N MET 165.A O no hydrogen 2.733 N/A ASN 160.A N PHE 163.A O no hydrogen 2.896 N/A THR 164.A N THR 189.A O no hydrogen 3.107 N/A THR 164.A OG1 GLN 159.A OE1 no hydrogen 3.478 N/A THR 164.A OG1 ASN 191.A OD1 no hydrogen 2.673 N/A MET 165.A N PHE 158.A O no hydrogen 2.657 N/A TRP 166.A N LYS 187.A O no hydrogen 2.868 N/A TRP 166.A NE1 THR 189.A OG1 no hydrogen 3.030 N/A LYS 167.A N GLU 155.A O no hydrogen 2.688 N/A LEU 168.A N GLU 185.A O no hydrogen 2.933 N/A THR 169.A OG1 HIS 173.A NE2 no hydrogen 3.423 N/A TYR 170.A OH GLU 152.A OE1 no hydrogen 2.825 N/A TYR 170.A OH GLU 152.A OE2 no hydrogen 3.157 N/A GLU 172.A N THR 169.A O no hydrogen 3.377 N/A GLN 174.A N GLU 111.A OE2 no hydrogen 2.798 N/A LEU 175.A N GLU 111.A OE1 no hydrogen 2.845 N/A ILE 178.A N TYR 170.A O no hydrogen 2.808 N/A ASN 182.A N ASP 180.A OD1 no hydrogen 2.949 N/A LYS 187.A N TRP 166.A O no hydrogen 3.035 N/A LYS 187.A NZ GLU 146.A OE1 no hydrogen 3.039 N/A LYS 187.A NZ GLU 146.A OE2 no hydrogen 2.585 N/A LYS 187.A NZ GLU 152.A OE2 no hydrogen 3.248 N/A VAL 188.A N TYR 225.A O no hydrogen 2.730 N/A THR 189.A N THR 164.A O no hydrogen 3.209 N/A THR 189.A OG1 THR 148.A OG1 no hydrogen 2.502 N/A ASN 191.A N ALA 162.A O no hydrogen 3.166 N/A ASN 191.A ND2 PHE 163.A O no hydrogen 3.025 N/A LYS 194.A NZ GLU 192.A OE1 no hydrogen 3.029 N/A VAL 201.A N SER 197.A O no hydrogen 2.954 N/A LYS 202.A N ASP 198.A O no hydrogen 2.873 N/A GLU 203.A N VAL 199.A O no hydrogen 3.020 N/A LEU 204.A N HIS 200.A O no hydrogen 2.950 N/A VAL 205.A N VAL 201.A O no hydrogen 3.039 N/A ALA 206.A N LYS 202.A O no hydrogen 2.626 N/A GLU 207.A N GLU 203.A O no hydrogen 2.886 N/A LEU 208.A N LEU 204.A O no hydrogen 2.987 N/A ARG 209.A N VAL 205.A O no hydrogen 3.173 N/A ARG 209.A N ALA 206.A O no hydrogen 3.395 N/A TRP 210.A N ALA 206.A O no hydrogen 3.177 N/A GLN 211.A N GLU 207.A O no hydrogen 2.964 N/A GLN 211.A NE2 GLN 211.A O no hydrogen 3.574 N/A PHE 215.A N TYR 212.A O no hydrogen 3.075 N/A ALA 216.A N VAL 228.A O no hydrogen 2.432 N/A ILE 218.A N ARG 226.A O no hydrogen 3.076 N/A THR 219.A OG1 HIS 224.A O no hydrogen 3.062 N/A HIS 220.A NE2 HIS 236.A ND1 no hydrogen 2.574 N/A GLY 221.A N THR 219.A OG1 no hydrogen 3.273 N/A HIS 224.A N LYS 222.A O no hydrogen 2.718 N/A TYR 225.A N VAL 188.A O no hydrogen 3.474 N/A ARG 226.A NH2 HIS 224.A NE2 no hydrogen 2.538 N/A ILE 227.A N TYR 186.A O no hydrogen 2.565 N/A LYS 229.A NZ ASN 182.A O no hydrogen 3.449 N/A SER 232.A N LYS 229.A O no hydrogen 3.110 N/A HIS 236.A N SER 232.A O no hydrogen 3.073 N/A HIS 236.A ND1 HIS 220.A NE2 no hydrogen 2.574 N/A ALA 237.A N VAL 233.A O no hydrogen 2.842 N/A ALA 237.A N ALA 234.A O no hydrogen 2.781 N/A ASP 238.A N ALA 234.A O no hydrogen 3.234 N/A ARG 239.A N ASN 235.A O no hydrogen 3.174 N/A VAL 240.A N HIS 236.A O no hydrogen 3.088 N/A TYR 241.A N ALA 237.A O no hydrogen 3.153 N/A TYR 241.A OH ASN 279.A O no hydrogen 3.104 N/A ALA 242.A N ASP 238.A O no hydrogen 3.018 N/A THR 243.A N ARG 239.A O no hydrogen 3.323 N/A THR 243.A OG1 ARG 239.A O no hydrogen 2.974 N/A PHE 244.A N VAL 240.A O no hydrogen 3.401 N/A SER 246.A N ALA 242.A O no hydrogen 3.166 N/A SER 246.A OG ALA 242.A O no hydrogen 3.367 N/A VAL 248.A N LYS 245.A O no hydrogen 3.189 N/A ASN 254.A ND2 THR 243.A O no hydrogen 3.609 N/A ASP 255.A N ASN 253.A O no hydrogen 2.716 N/A ASN 257.A N GLY 221.A O no hydrogen 2.891 N/A LEU 258.A N PHE 256.A O no hydrogen 2.660 N/A ARG 262.A N ASP 260.A OD1 no hydrogen 2.326 N/A ILE 263.A N ASP 260.A O no hydrogen 2.974 N/A ILE 264.A N ASP 260.A O no hydrogen 3.237 N/A TRP 265.A N VAL 217.A O no hydrogen 3.123 N/A ASN 267.A ND2 LEU 288.A O no hydrogen 2.566 N/A TRP 268.A NE1 THR 219.A O no hydrogen 2.699 N/A TYR 269.A N TRP 265.A O no hydrogen 3.061 N/A ALA 270.A N GLN 266.A O no hydrogen 2.922 N/A PHE 271.A N ASN 267.A O no hydrogen 2.816 N/A THR 272.A N TRP 268.A O no hydrogen 2.775 N/A THR 272.A OG1 TRP 268.A O no hydrogen 2.916 N/A SER 273.A N TYR 269.A O no hydrogen 3.016 N/A SER 273.A OG TYR 269.A O no hydrogen 2.601 N/A SER 274.A N ALA 270.A O no hydrogen 3.269 N/A MET 275.A N PHE 271.A O no hydrogen 3.408 N/A LYS 276.A N THR 272.A O no hydrogen 3.146 N/A GLN 277.A N SER 274.A O no hydrogen 2.958 N/A GLY 278.A N MET 275.A O no hydrogen 3.006 N/A ASN 279.A N SER 274.A O no hydrogen 3.114 N/A CYS 284.A SG PHE 271.A O no hydrogen 3.923 N/A CYS 284.A SG THR 280.A O no hydrogen 3.292 N/A LYS 285.A N LEU 281.A O no hydrogen 2.937 N/A ARG 286.A N ASP 282.A O no hydrogen 3.022 N/A LEU 287.A N CYS 284.A O no hydrogen 2.966 N/A LEU 288.A N LYS 285.A O no hydrogen 3.208 N/A