Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3mcw_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 6.A N GLU 111.A OE2.A no hydrogen 3.038 N/A SER 6.A N GLU 111.A OE2.B no hydrogen 2.458 N/A SER 6.A OG.A GLU 111.A OE2.A no hydrogen 3.316 N/A SER 6.A OG.A GLU 111.A OE2.B no hydrogen 2.080 N/A SER 7.A N GLU 111.A OE1.A no hydrogen 3.106 N/A SER 7.A N GLU 111.A OE1.B no hydrogen 2.585 N/A SER 7.A N GLU 111.A OE2.B no hydrogen 3.166 N/A SER 7.A OG GLU 111.A OE1.A no hydrogen 3.041 N/A SER 7.A OG GLU 111.A OE1.B no hydrogen 2.396 N/A LYS 9.A N SER 7.A OG no hydrogen 3.146 N/A LYS 9.A NZ ASN 107.A O no hydrogen 2.991 N/A LEU 11.A N GLU 111.A O no hydrogen 2.970 N/A LEU 12.A N PRO 50.A O no hydrogen 3.013 N/A LEU 13.A N VAL 113.A O no hydrogen 2.814 N/A LEU 14.A N ILE 52.A O no hydrogen 3.102 N/A ILE 15.A N ALA 115.A O no hydrogen 2.858 N/A ASP 16.A N ILE 54.A O no hydrogen 2.884 N/A GLN 17.A NE2 HIS 56.A O no hydrogen 2.995 N/A GLN 17.A NE2 HIS 72.A O no hydrogen 2.970 N/A GLN 18.A N ALA 73.A O no hydrogen 2.876 N/A GLN 18.A NE2 PHE 74.A O no hydrogen 3.009 N/A ALA 19.A N GLY 71.A O no hydrogen 2.804 N/A VAL 20.A N GLN 17.A O no hydrogen 3.226 N/A ASP 21.A N GLN 18.A O no hydrogen 2.960 N/A ASP 22.A N ALA 19.A O no hydrogen 3.037 N/A SER 24.A N ASP 22.A OD1 no hydrogen 2.958 N/A SER 24.A OG.A ASP 22.A OD1 no hydrogen 2.756 N/A SER 24.A OG.B ASP 22.A OD1 no hydrogen 3.135 N/A TRP 25.A N ASP 22.A O no hydrogen 3.132 N/A TRP 25.A NE1 ALA 19.A O no hydrogen 2.992 N/A GLY 26.A N PRO 23.A O no hydrogen 2.969 N/A ARG 28.A NE ASN 29.A O no hydrogen 3.094 N/A ARG 28.A NH1 GLU 34.A OE1 no hydrogen 3.543 N/A ARG 28.A NH1 GLU 34.A OE2 no hydrogen 2.830 N/A ARG 28.A NH2 HIS 30.A O no hydrogen 2.847 N/A ARG 28.A NH2 GLU 34.A OE1 no hydrogen 2.887 N/A ARG 28.A NH2 GLU 34.A OE2 no hydrogen 3.540 N/A ASN 29.A N THR 145.A O no hydrogen 3.289 N/A ASN 29.A ND2 ASP 159.A OD1.B no hydrogen 2.979 N/A HIS 30.A ND1 CYS 143.A O no hydrogen 2.868 N/A ALA 33.A N HIS 30.A O no hydrogen 2.945 N/A GLU 34.A N GLU 34.A OE1 no hydrogen 2.777 N/A ALA 36.A N GLN 32.A O no hydrogen 3.001 N/A CYS 37.A N ALA 33.A O no hydrogen 2.899 N/A CYS 37.A SG ALA 33.A O no hydrogen 3.512 N/A CYS 37.A SG GLY 142.A O no hydrogen 3.085 N/A ALA 38.A N GLU 34.A O no hydrogen 2.845 N/A GLY 39.A N GLN 35.A O no hydrogen 2.981 N/A LEU 40.A N ALA 36.A O no hydrogen 3.099 N/A LEU 41.A N CYS 37.A O no hydrogen 2.878 N/A GLN 42.A N ALA 38.A O no hydrogen 2.905 N/A ALA 43.A N GLY 39.A O no hydrogen 3.129 N/A TRP 44.A N LEU 40.A O no hydrogen 2.903 N/A TRP 44.A NE1 PRO 10.A O no hydrogen 2.895 N/A ARG 45.A N LEU 41.A O no hydrogen 2.942 N/A ARG 45.A NE GLU 84.A OE2 no hydrogen 2.770 N/A ARG 45.A NH1 GLN 42.A OE1.B no hydrogen 2.946 N/A ARG 45.A NH2 GLU 79.A O no hydrogen 2.953 N/A ARG 45.A NH2 GLU 84.A OE1 no hydrogen 2.887 N/A ARG 45.A NH2 GLU 84.A OE2 no hydrogen 3.426 N/A ALA 46.A N GLN 42.A O no hydrogen 2.860 N/A ARG 47.A N ALA 43.A O no hydrogen 2.977 N/A GLY 48.A N ARG 45.A O no hydrogen 3.126 N/A LEU 49.A N TRP 44.A O no hydrogen 3.012 N/A ILE 52.A N LEU 12.A O no hydrogen 2.844 N/A HIS 53.A N THR 85.A O no hydrogen 2.966 N/A HIS 53.A NE2 GLU 84.A OE1 no hydrogen 2.866 N/A ILE 54.A N LEU 14.A O no hydrogen 2.832 N/A ARG 55.A N ILE 87.A O no hydrogen 2.962 N/A ARG 55.A NE ASP 57.A OD1 no hydrogen 2.845 N/A ARG 55.A NH2 ASP 57.A OD1 no hydrogen 3.441 N/A ARG 55.A NH2 ASP 57.A OD2 no hydrogen 2.903 N/A HIS 56.A N GLN 17.A OE1 no hydrogen 2.872 N/A ASP 57.A N LYS 89.A O no hydrogen 2.897 N/A SER 58.A OG.A SER 63.A OG no hydrogen 3.116 N/A GLU 60.A N SER 58.A OG.B no hydrogen 2.865 N/A SER 63.A N GLU 60.A O no hydrogen 3.113 N/A SER 63.A OG SER 58.A OG.A no hydrogen 3.116 N/A TYR 65.A N SER 63.A OG no hydrogen 2.922 N/A ARG 66.A N SER 63.A O no hydrogen 3.055 N/A GLN 69.A NE2 THR 64.A O no hydrogen 2.810 N/A GLN 69.A NE2 ARG 66.A O no hydrogen 2.852 N/A GLY 71.A N GLN 69.A OE1 no hydrogen 2.931 N/A HIS 72.A N GLN 69.A O no hydrogen 3.058 N/A HIS 72.A NE2 ASP 57.A OD1 no hydrogen 2.676 N/A ALA 73.A N PRO 70.A O no hydrogen 3.119 N/A LYS 75.A NZ ASP 21.A OD1 no hydrogen 2.782 N/A LYS 75.A NZ ASP 21.A OD2 no hydrogen 3.332 N/A LYS 75.A NZ GLU 34.A OE2 no hydrogen 2.686 N/A GLU 77.A N GLU 77.A OE1 no hydrogen 2.855 N/A VAL 78.A N LYS 75.A O no hydrogen 3.050 N/A GLU 79.A N PRO 76.A O no hydrogen 3.394 N/A ARG 81.A N GLU 84.A OE1 no hydrogen 3.007 N/A GLU 84.A N ARG 81.A O no hydrogen 3.063 N/A ILE 87.A N HIS 53.A O no hydrogen 2.881 N/A LYS 89.A N ARG 55.A O no hydrogen 2.862 N/A LYS 89.A NZ ASP 16.A OD2 no hydrogen 2.840 N/A LYS 89.A NZ HIS 56.A ND1 no hydrogen 2.951 N/A LYS 89.A NZ THR 91.A O no hydrogen 2.874 N/A LYS 89.A NZ ASN 92.A O no hydrogen 3.201 N/A LYS 89.A NZ SER 122.A OG no hydrogen 3.187 N/A ALA 94.A N THR 126.A OG1 no hydrogen 2.954 N/A PHE 95.A N SER 93.A OG no hydrogen 3.160 N/A ILE 96.A N SER 93.A O no hydrogen 3.267 N/A THR 98.A OG1.A ALA 94.A O no hydrogen 2.852 N/A THR 98.A OG1.A PHE 95.A O no hydrogen 3.449 N/A THR 98.A OG1.B ALA 94.A O no hydrogen 2.562 N/A LEU 100.A N THR 98.A OG1.A no hydrogen 2.990 N/A LEU 100.A N THR 98.A OG1.B no hydrogen 3.249 N/A LEU 103.A N GLY 99.A O.A no hydrogen 3.039 N/A LEU 103.A N GLY 99.A O.B no hydrogen 3.069 N/A LEU 104.A N LEU 100.A O no hydrogen 2.959 N/A ARG 105.A N GLU 101.A O no hydrogen 2.960 N/A ARG 105.A NE GLU 101.A OE2 no hydrogen 2.842 N/A ARG 105.A NH2 GLU 101.A OE2 no hydrogen 2.937 N/A ARG 105.A NH2 LEU 132.A O no hydrogen 2.781 N/A ALA 106.A N ALA 102.A O no hydrogen 2.937 N/A ASN 107.A N LEU 103.A O no hydrogen 3.343 N/A ASN 107.A N LEU 104.A O no hydrogen 3.231 N/A ASN 107.A ND2 LEU 103.A O no hydrogen 2.966 N/A GLY 108.A N ARG 105.A O no hydrogen 3.218 N/A TRP 109.A N LEU 104.A O no hydrogen 2.878 N/A LEU 112.A N ALA 135.A O no hydrogen 2.841 N/A VAL 113.A N LEU 11.A O no hydrogen 2.778 N/A VAL 114.A N CYS 137.A O no hydrogen 2.868 N/A ALA 115.A N LEU 13.A O no hydrogen 3.138 N/A VAL 117.A N ILE 15.A O no hydrogen 2.980 N/A THR 119.A N PHE 144.A O no hydrogen 2.908 N/A THR 119.A OG1 HIS 162.A ND1 no hydrogen 2.879 N/A SER 120.A OG THR 145.A OG1 no hydrogen 2.802 N/A ASN 121.A N SER 118.A O no hydrogen 3.181 N/A ASN 121.A N SER 118.A OG no hydrogen 3.046 N/A SER 122.A OG ASP 16.A OD2 no hydrogen 3.460 N/A SER 122.A OG ASN 92.A O no hydrogen 3.382 N/A VAL 123.A N SER 118.A O no hydrogen 3.036 N/A ALA 125.A N ASN 121.A O no hydrogen 2.880 N/A THR 126.A N SER 122.A O no hydrogen 3.057 N/A THR 126.A OG1 ASN 92.A O no hydrogen 3.534 N/A THR 126.A OG1 SER 122.A O no hydrogen 2.847 N/A VAL 127.A N VAL 123.A O no hydrogen 2.857 N/A ARG 128.A N GLU 124.A O no hydrogen 2.890 N/A ARG 128.A NE GLU 124.A OE2 no hydrogen 2.853 N/A ARG 128.A NH2 GLU 124.A OE2 no hydrogen 2.836 N/A GLY 130.A N VAL 127.A O no hydrogen 2.924 N/A ASN 131.A N ARG 128.A O no hydrogen 3.113 N/A GLY 133.A N GLY 130.A O no hydrogen 3.016 N/A PHE 134.A N ALA 129.A O no hydrogen 3.031 N/A ALA 135.A N LEU 110.A O no hydrogen 2.923 N/A CYS 137.A N LEU 112.A O no hydrogen 2.808 N/A LEU 138.A N ARG 174.A O no hydrogen 2.899 N/A ALA 139.A N VAL 114.A O no hydrogen 2.884 N/A GLU 140.A N CYS 176.A O no hydrogen 2.960 N/A GLY 142.A N ALA 139.A O no hydrogen 2.932 N/A CYS 143.A N GLU 140.A O no hydrogen 3.109 N/A CYS 143.A SG ALA 139.A O no hydrogen 3.542 N/A PHE 144.A N GLY 116.A O no hydrogen 3.419 N/A THR 145.A N ASN 29.A OD1 no hydrogen 2.881 N/A THR 145.A OG1 SER 120.A OG no hydrogen 2.802 N/A PHE 146.A N THR 145.A OG1 no hydrogen 2.781 N/A ASP 147.A N PRO 27.A O no hydrogen 2.949 N/A LYS 148.A N ARG 156.A O no hydrogen 3.012 N/A ASP 150.A N ARG 154.A O no hydrogen 2.861 N/A HIS 152.A N ASP 150.A OD1 no hydrogen 2.852 N/A GLY 153.A N ASP 150.A O no hydrogen 3.060 N/A ARG 154.A N ASP 150.A OD1 no hydrogen 2.988 N/A ARG 156.A N LYS 148.A O no hydrogen 2.956 N/A SER 157.A N GLU 160.A OE1 no hydrogen 2.929 N/A SER 157.A OG GLU 160.A OE1 no hydrogen 3.534 N/A ALA 158.A N ASP 147.A OD1 no hydrogen 2.787 N/A GLU 160.A N SER 157.A OG no hydrogen 3.053 N/A VAL 161.A N SER 157.A O no hydrogen 2.909 N/A HIS 162.A N ALA 158.A O no hydrogen 2.875 N/A HIS 162.A ND1 THR 119.A OG1 no hydrogen 2.879 N/A HIS 162.A NE2 GLU 140.A OE1 no hydrogen 2.849 N/A ALA 163.A N ASP 159.A O no hydrogen 2.902 N/A SER 164.A OG.A GLU 124.A OE1 no hydrogen 2.600 N/A SER 164.A OG.B THR 119.A O no hydrogen 3.340 N/A SER 164.A OG.B GLU 124.A OE1 no hydrogen 2.840 N/A LEU 165.A N HIS 162.A O no hydrogen 2.908 N/A ALA 166.A N ALA 163.A O no hydrogen 3.147 N/A LEU 168.A N SER 164.A O no hydrogen 2.914 N/A ASP 169.A N LEU 165.A O no hydrogen 2.881 N/A GLY 170.A N CYS 173.A O no hydrogen 2.801 N/A TYR 172.A N LEU 168.A O no hydrogen 2.936 N/A CYS 173.A N LEU 168.A O no hydrogen 3.174 N/A CYS 173.A SG LEU 168.A O no hydrogen 3.680 N/A ARG 174.A N VAL 136.A O no hydrogen 2.862 N/A ARG 174.A NH2 ALA 1.A O no hydrogen 2.978 N/A VAL 175.A N ASP 169.A OD1 no hydrogen 2.951 N/A CYS 176.A N LEU 138.A O no hydrogen 2.912 N/A CYS 176.A SG.A LEU 138.A O no hydrogen 3.817 N/A CYS 176.A SG.B ARG 174.A O no hydrogen 3.516 N/A GLY 177.A N ASP 180.A OD2.A no hydrogen 2.872 N/A SER 178.A N ASP 141.A OD1 no hydrogen 2.813 N/A SER 178.A OG ASP 141.A OD1 no hydrogen 3.566 N/A SER 178.A OG ASP 141.A OD2 no hydrogen 2.617 N/A ILE 181.A N GLY 177.A O no hydrogen 3.116 N/A LEU 182.A N SER 178.A O no hydrogen 2.911 N/A ALA 183.A N ALA 179.A O no hydrogen 3.013 N/A ALA 184.A N ASP 180.A O no hydrogen 2.956 N/A LEU 185.A N ILE 181.A O no hydrogen 2.986 N/A ASN 187.A N ALA 184.A O no hydrogen 3.041 N/A ILE 188.A N LEU 185.A O no hydrogen 3.294 N/A ALA 191.A N ILE 188.A O no hydrogen 3.029 N/A ALA 192.A N ALA 189.A O no hydrogen 3.340 N/A