Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3wdg_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N GLU 49.A OE1 no hydrogen 3.276 N/A TRP 3.A NE1 THR 46.A O no hydrogen 2.826 N/A ILE 6.A N GLU 2.A O no hydrogen 3.199 N/A PHE 7.A N TRP 3.A O no hydrogen 2.736 N/A HIS 8.A N SER 4.A O no hydrogen 2.976 N/A ASP 9.A N GLN 5.A O no hydrogen 3.094 N/A ILE 10.A N ILE 6.A O no hydrogen 2.996 N/A THR 11.A N PHE 7.A O no hydrogen 2.846 N/A THR 11.A OG1 PHE 7.A O no hydrogen 2.969 N/A THR 11.A OG1 HIS 8.A O no hydrogen 3.359 N/A THR 12.A N HIS 8.A O no hydrogen 3.157 N/A THR 12.A OG1 HIS 8.A O no hydrogen 2.802 N/A LYS 13.A N ASP 9.A O no hydrogen 3.144 N/A LYS 13.A NZ GLU 140.A OE2 no hydrogen 3.062 N/A HIS 14.A N ILE 10.A O no hydrogen 3.079 N/A HIS 14.A NE2 GLU 140.A OE2 no hydrogen 2.793 N/A LYS 17.A N ASP 15.A OD1 no hydrogen 3.057 N/A LYS 17.A NZ ASP 21.A OD2 no hydrogen 3.357 N/A HIS 20.A N PHE 16.A O no hydrogen 3.005 N/A ASP 21.A N LYS 17.A O no hydrogen 2.949 N/A PHE 22.A N ALA 18.A O no hydrogen 2.954 N/A LEU 23.A N MET 19.A O no hydrogen 2.813 N/A GLU 24.A N HIS 20.A O no hydrogen 2.809 N/A LYS 25.A N ASP 21.A O no hydrogen 3.291 N/A GLU 26.A N PHE 22.A O no hydrogen 2.938 N/A TYR 27.A N LEU 23.A O no hydrogen 2.822 N/A TYR 27.A OH PRO 34.A O no hydrogen 2.649 N/A SER 28.A N GLU 24.A O no hydrogen 3.177 N/A SER 28.A OG GLU 24.A O no hydrogen 3.190 N/A THR 29.A N LYS 25.A O no hydrogen 3.028 N/A THR 29.A OG1 LYS 25.A O no hydrogen 2.711 N/A ALA 30.A N GLU 26.A O no hydrogen 2.870 N/A TYR 33.A N VAL 121.A O no hydrogen 2.781 N/A ARG 36.A NH1 GLU 24.A OE1 no hydrogen 3.011 N/A ARG 36.A NH2 GLU 24.A OE1 no hydrogen 3.427 N/A GLU 37.A N GLU 37.A OE1 no hydrogen 2.811 N/A ASN 38.A N ASP 35.A O no hydrogen 2.892 N/A ILE 39.A N ARG 36.A O no hydrogen 3.308 N/A GLN 41.A N ASN 38.A O no hydrogen 2.983 N/A GLN 41.A NE2 ASN 38.A OD1 no hydrogen 3.598 N/A ASP 44.A N TYR 40.A O no hydrogen 3.037 N/A LEU 45.A N GLN 41.A O no hydrogen 2.922 N/A THR 46.A N ALA 42.A O no hydrogen 3.110 N/A THR 46.A OG1 ALA 108.A O no hydrogen 2.778 N/A THR 46.A OG1 VAL 112.A O no hydrogen 3.171 N/A ASN 50.A N PRO 47.A O no hydrogen 2.996 N/A ILE 51.A N PHE 48.A O no hydrogen 3.213 N/A LYS 52.A N GLY 111.A O no hydrogen 2.801 N/A LYS 52.A NZ SER 209.A O no hydrogen 2.810 N/A VAL 53.A N GLY 111.A O no hydrogen 3.200 N/A VAL 54.A N VAL 153.A O no hydrogen 2.610 N/A ILE 55.A N LEU 113.A O no hydrogen 2.993 N/A LEU 56.A N ILE 155.A O no hydrogen 3.469 N/A GLY 57.A N LEU 115.A O no hydrogen 2.829 N/A TYR 61.A OH PHE 72.A O no hydrogen 2.569 N/A HIS 68.A ND1 GLN 41.A OE1 no hydrogen 2.833 N/A HIS 68.A NE2 SER 73.A OG no hydrogen 2.566 N/A ALA 71.A N LEU 114.A O no hydrogen 2.822 N/A SER 73.A N ALA 71.A O no hydrogen 2.808 N/A SER 73.A OG HIS 68.A NE2 no hydrogen 2.566 N/A SER 73.A OG VAL 74.A O no hydrogen 3.396 N/A VAL 74.A N PRO 102.A O no hydrogen 3.108 N/A GLN 75.A N GLN 66.A O no hydrogen 3.121 N/A ALA 78.A N GLN 75.A O no hydrogen 2.882 N/A ARG 85.A N PRO 81.A O no hydrogen 2.980 N/A ASN 86.A N PRO 82.A O no hydrogen 3.051 N/A ASN 86.A ND2 PRO 181.A O no hydrogen 2.895 N/A MET 87.A N SER 83.A O no hydrogen 2.895 N/A TYR 88.A N LEU 84.A O no hydrogen 2.890 N/A TYR 88.A OH THR 101.A O no hydrogen 2.498 N/A LYS 89.A N ARG 85.A O no hydrogen 2.989 N/A LYS 89.A NZ ASP 93.A OD1 no hydrogen 3.424 N/A LYS 89.A NZ ASP 93.A OD2 no hydrogen 2.543 N/A GLU 90.A N ASN 86.A O no hydrogen 2.914 N/A LEU 91.A N MET 87.A O no hydrogen 2.842 N/A ALA 92.A N TYR 88.A O no hydrogen 2.924 N/A ASP 93.A N LYS 89.A O no hydrogen 2.954 N/A ASP 94.A N GLU 90.A O no hydrogen 2.761 N/A ASP 94.A N LEU 91.A O no hydrogen 3.264 N/A ILE 95.A N LEU 91.A O no hydrogen 2.877 N/A GLY 96.A N LEU 91.A O no hydrogen 3.263 N/A ARG 99.A NE TYR 88.A OH no hydrogen 3.064 N/A ARG 99.A NH1 ASP 106.A OD2 no hydrogen 2.738 N/A ARG 99.A NH1 TRP 213.A O no hydrogen 3.133 N/A ARG 99.A NH2 ASP 106.A OD1 no hydrogen 2.758 N/A ARG 99.A NH2 ASP 106.A OD2 no hydrogen 3.225 N/A GLN 100.A N GLU 215.A OE1 no hydrogen 2.715 N/A THR 101.A N GLU 215.A OE1 no hydrogen 2.918 N/A HIS 103.A N THR 101.A OG1 no hydrogen 3.254 N/A HIS 103.A ND1 VAL 74.A O no hydrogen 2.983 N/A LEU 104.A N SER 73.A OG no hydrogen 2.831 N/A GLN 105.A NE2 GLN 41.A OE1 no hydrogen 3.037 N/A TRP 107.A N ASP 106.A OD1 no hydrogen 2.965 N/A TRP 107.A NE1 TRP 213.A O no hydrogen 2.886 N/A ALA 108.A N LEU 104.A O no hydrogen 3.192 N/A ARG 109.A N GLN 105.A O no hydrogen 2.959 N/A GLU 110.A N ASP 106.A O no hydrogen 3.003 N/A GLY 111.A N ALA 108.A O no hydrogen 3.102 N/A VAL 112.A N TRP 107.A O no hydrogen 3.017 N/A LEU 113.A N VAL 53.A O no hydrogen 2.857 N/A LEU 115.A N ILE 55.A O no hydrogen 3.081 N/A THR 117.A N GLY 57.A O no hydrogen 3.147 N/A THR 117.A OG1 GLY 57.A O no hydrogen 3.430 N/A THR 117.A OG1 GLN 58.A O no hydrogen 3.439 N/A VAL 118.A N GLN 58.A O no hydrogen 3.056 N/A THR 120.A OG1 HIS 129.A ND1 no hydrogen 2.682 N/A VAL 121.A N TYR 33.A O no hydrogen 2.834 N/A ARG 122.A N SER 128.A OG no hydrogen 3.085 N/A ARG 122.A NE GLU 125.A OE1 no hydrogen 3.486 N/A ARG 122.A NE GLU 125.A OE2 no hydrogen 2.781 N/A ARG 122.A NH1 GLU 26.A OE1 no hydrogen 2.797 N/A ARG 122.A NH2 GLU 125.A OE1 no hydrogen 3.041 N/A GLN 123.A N ILE 31.A O no hydrogen 2.861 N/A GLY 124.A N HIS 62.A O no hydrogen 2.888 N/A GLU 125.A N ARG 122.A O no hydrogen 3.084 N/A ASN 127.A N ASP 59.A OD2 no hydrogen 2.947 N/A SER 128.A N GLU 125.A O no hydrogen 3.161 N/A SER 128.A OG GLU 125.A O no hydrogen 2.508 N/A HIS 129.A ND1 THR 120.A OG1 no hydrogen 2.682 N/A HIS 129.A NE2 GLU 26.A OE1 no hydrogen 2.995 N/A ARG 130.A N ASN 127.A O no hydrogen 3.076 N/A ASP 131.A N GLU 135.A OE1 no hydrogen 3.033 N/A ASP 131.A N GLU 135.A OE2 no hydrogen 2.894 N/A TRP 134.A NE1 THR 120.A OG1 no hydrogen 2.864 N/A GLU 135.A N GLU 135.A OE1 no hydrogen 2.885 N/A PHE 137.A N GLY 133.A O no hydrogen 3.148 N/A THR 138.A N TRP 134.A O no hydrogen 2.781 N/A THR 138.A OG1 ASN 116.A O no hydrogen 3.358 N/A THR 138.A OG1 THR 117.A O no hydrogen 3.556 N/A ASP 139.A N GLU 135.A O no hydrogen 2.825 N/A GLU 140.A N THR 136.A O no hydrogen 3.080 N/A ILE 141.A N PHE 137.A O no hydrogen 2.928 N/A ILE 142.A N THR 138.A O no hydrogen 2.984 N/A LYS 143.A N ASP 139.A O no hydrogen 3.140 N/A ALA 144.A N GLU 140.A O no hydrogen 2.964 N/A VAL 145.A N ILE 141.A O no hydrogen 2.954 N/A SER 146.A N ILE 142.A O no hydrogen 2.956 N/A ASP 147.A N LYS 143.A O no hydrogen 2.728 N/A TYR 148.A N ALA 144.A O no hydrogen 2.860 N/A LYS 149.A N VAL 145.A O no hydrogen 3.146 N/A LYS 149.A NZ PHE 48.A O no hydrogen 3.021 N/A LYS 149.A NZ ILE 51.A O no hydrogen 3.494 N/A HIS 151.A ND1 LYS 172.A O no hydrogen 2.701 N/A VAL 152.A N HIS 173.A ND1 no hydrogen 2.974 N/A VAL 153.A N LYS 52.A O no hydrogen 3.001 N/A PHE 154.A N CYS 174.A O no hydrogen 2.734 N/A ILE 155.A N VAL 54.A O no hydrogen 2.675 N/A LEU 156.A N ILE 176.A O no hydrogen 2.689 N/A GLY 158.A N SER 178.A O no hydrogen 3.021 N/A LYS 159.A NZ GLN 162.A OE1 no hydrogen 3.542 N/A GLN 162.A N GLY 158.A O no hydrogen 3.256 N/A GLN 162.A NE2 LEU 156.A O no hydrogen 3.343 N/A GLN 163.A N LYS 159.A O no hydrogen 3.041 N/A GLN 163.A N PRO 160.A O no hydrogen 3.183 N/A LYS 164.A N ALA 161.A O no hydrogen 2.990 N/A LYS 164.A NZ ASP 139.A OD1 no hydrogen 2.910 N/A ILE 165.A N GLN 162.A O no hydrogen 3.139 N/A LEU 167.A N LYS 164.A O no hydrogen 2.925 N/A ILE 168.A N ILE 165.A O no hydrogen 3.111 N/A ASP 169.A N SER 146.A OG no hydrogen 2.962 N/A SER 171.A N ASP 169.A OD1 no hydrogen 3.023 N/A SER 171.A OG ASP 169.A OD1 no hydrogen 2.700 N/A LYS 172.A N ASP 169.A O no hydrogen 3.179 N/A LYS 172.A NZ SER 146.A O no hydrogen 3.037 N/A LYS 172.A NZ LYS 149.A O no hydrogen 2.995 N/A HIS 173.A N ASP 169.A O no hydrogen 2.932 N/A HIS 173.A NE2 SER 146.A O no hydrogen 2.732 N/A CYS 174.A N VAL 152.A O no hydrogen 2.983 N/A ILE 176.A N PHE 154.A O no hydrogen 2.888 N/A SER 178.A N LEU 156.A O no hydrogen 3.345 N/A SER 178.A OG VAL 179.A O no hydrogen 2.653 N/A SER 182.A N HIS 180.A ND1 no hydrogen 2.997 N/A LEU 184.A N SER 182.A OG no hydrogen 3.150 N/A SER 185.A N SER 182.A O no hydrogen 2.898 N/A SER 185.A OG HIS 180.A O no hydrogen 2.602 N/A SER 185.A OG SER 182.A O no hydrogen 3.463 N/A ALA 186.A N SER 182.A O no hydrogen 2.794 N/A ARG 188.A N SER 185.A O no hydrogen 3.000 N/A PHE 190.A N ALA 186.A O no hydrogen 2.923 N/A PHE 191.A N ALA 186.A O no hydrogen 3.189 N/A GLY 192.A N GLU 90.A OE1 no hydrogen 2.807 N/A SER 193.A N PHE 190.A O no hydrogen 3.050 N/A SER 193.A OG PHE 190.A O no hydrogen 2.659 N/A LYS 194.A N GLU 90.A OE2 no hydrogen 2.783 N/A TYR 196.A OH MET 87.A O no hydrogen 2.636 N/A SER 197.A N ASP 94.A OD2 no hydrogen 2.973 N/A SER 197.A OG ASP 94.A OD1 no hydrogen 2.528 N/A SER 197.A OG ASP 94.A OD2 no hydrogen 3.367 N/A SER 197.A OG LYS 194.A O no hydrogen 3.558 N/A LYS 198.A N LYS 194.A O no hydrogen 3.036 N/A LYS 198.A NZ SER 193.A O no hydrogen 2.775 N/A ALA 199.A N PRO 195.A O no hydrogen 2.974 N/A ASN 200.A N TYR 196.A O no hydrogen 3.202 N/A ASN 200.A ND2 ILE 211.A O no hydrogen 3.085 N/A THR 201.A N SER 197.A O no hydrogen 2.847 N/A THR 201.A OG1 SER 197.A O no hydrogen 3.103 N/A TYR 202.A N LYS 198.A O no hydrogen 3.103 N/A LEU 203.A N ALA 199.A O no hydrogen 2.948 N/A GLU 204.A N ASN 200.A O no hydrogen 2.979 N/A SER 205.A N THR 201.A O no hydrogen 3.136 N/A SER 205.A N TYR 202.A O no hydrogen 2.947 N/A SER 205.A OG TYR 202.A O no hydrogen 2.611 N/A VAL 206.A N LEU 203.A O no hydrogen 3.125 N/A GLY 207.A N GLU 204.A O no hydrogen 3.194 N/A LYS 208.A N LEU 203.A O no hydrogen 2.865 N/A ILE 211.A N ASN 200.A OD1 no hydrogen 2.725 N/A ASN 212.A N GLU 110.A OE1 no hydrogen 2.841 N/A CYS 214.A N ASN 212.A OD1 no hydrogen 3.131 N/A SER 216.A N ASP 106.A OD2 no hydrogen 3.066 N/A