Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3kcg_H.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 1.A N ARG 132.A O no hydrogen 2.871 N/A VAL 1.A N ASP 184.A OD1 no hydrogen 3.534 N/A VAL 1.A N ASP 184.A OD2 no hydrogen 2.701 N/A VAL 2.A N ASP 179.A O no hydrogen 2.860 N/A GLU 5.A N.A TYR 145.A O no hydrogen 3.045 N/A GLU 5.A N.B TYR 145.A O no hydrogen 3.052 N/A ALA 7.A N LEU 143.A O no hydrogen 2.826 N/A LYS 8.A N GLN 11.A OE1 no hydrogen 2.880 N/A GLN 11.A N LYS 8.A O no hydrogen 2.997 N/A GLN 15.A N PHE 12.A O no hydrogen 3.009 N/A GLN 15.A NE2 VAL 16.A O no hydrogen 3.071 N/A VAL 16.A N GLY 28.A O no hydrogen 3.005 N/A VAL 17.A N VAL 52.A O no hydrogen 3.141 N/A LEU 18.A N CYS 26.A O no hydrogen 2.962 N/A ASN 19.A N THR 50.A O.A no hydrogen 2.936 N/A ASN 19.A N THR 50.A O.B no hydrogen 2.930 N/A GLY 20.A N VAL 22.A O no hydrogen 2.938 N/A ALA 24.A N ASN 19.A OD1 no hydrogen 2.786 N/A PHE 25.A N LEU 18.A O no hydrogen 3.146 N/A CYS 26.A SG PHE 25.A O no hydrogen 3.079 N/A GLY 27.A N ALA 185.A O no hydrogen 2.766 N/A GLY 28.A N VAL 16.A O no hydrogen 3.120 N/A SER 29.A N VAL 37.A O no hydrogen 2.918 N/A ILE 30.A N TRP 14.A O no hydrogen 2.874 N/A VAL 31.A N TRP 35.A O no hydrogen 2.850 N/A ASN 32.A N TRP 35.A O no hydrogen 3.414 N/A ASN 32.A ND2 THR 232.A O no hydrogen 2.887 N/A GLU 33.A N GLU 33.A OE1 no hydrogen 2.627 N/A LYS 34.A N ASN 32.A OD1 no hydrogen 2.909 N/A LYS 34.A NZ LEU 95.A O no hydrogen 2.877 N/A LYS 34.A NZ ASP 96.A O no hydrogen 3.246 N/A TRP 35.A N ASN 32.A O no hydrogen 3.295 N/A ILE 36.A N LEU 93.A O no hydrogen 2.923 N/A VAL 37.A N SER 29.A O no hydrogen 2.892 N/A THR 38.A N ALA 91.A O no hydrogen 2.915 N/A THR 38.A OG1 GLY 27.A O no hydrogen 2.808 N/A ALA 39.A N THR 38.A OG1 no hydrogen 2.736 N/A HIS 41.A N ASP 89.A OD1 no hydrogen 2.827 N/A HIS 41.A ND1 ASP 89.A OD2 no hydrogen 2.736 N/A CYS 42.A N ALA 39.A O no hydrogen 3.198 N/A CYS 42.A SG ALA 185.A O no hydrogen 3.552 N/A VAL 43.A N ALA 40.A O no hydrogen 3.182 N/A VAL 47.A N GLU 44.A O no hydrogen 3.009 N/A THR 50.A N.A ASN 19.A O no hydrogen 2.999 N/A THR 50.A N.B ASN 19.A O no hydrogen 3.021 N/A THR 50.A OG1.B ARG 68.A O no hydrogen 3.488 N/A VAL 51.A N ARG 68.A O no hydrogen 2.775 N/A VAL 52.A N VAL 17.A O no hydrogen 3.070 N/A ALA 53.A N GLN 66.A O no hydrogen 2.843 N/A HIS 56.A N GLU 55.A OE2 no hydrogen 2.972 N/A HIS 56.A N GLU 62.A OE1 no hydrogen 3.300 N/A ASN 57.A N GLU 62.A OE1 no hydrogen 2.945 N/A ILE 58.A N LEU 141.A O no hydrogen 2.938 N/A GLU 59.A N ASN 57.A OD1 no hydrogen 2.784 N/A GLU 60.A N ASN 57.A O no hydrogen 3.258 N/A GLU 62.A N GLU 65.A OE1 no hydrogen 3.166 N/A GLU 62.A N GLU 65.A OE2 no hydrogen 2.838 N/A THR 64.A N GLU 65.A OE1 no hydrogen 3.156 N/A THR 64.A OG1 GLY 54.A O no hydrogen 2.708 N/A GLU 65.A N GLU 65.A OE1 no hydrogen 2.848 N/A GLN 66.A N ALA 53.A O no hydrogen 2.908 N/A GLN 66.A NE2 VAL 100.A O no hydrogen 2.854 N/A ARG 68.A N VAL 51.A O no hydrogen 2.814 N/A ARG 68.A NE GLU 97.A O.A no hydrogen 2.855 N/A ARG 68.A NE GLU 97.A O.B no hydrogen 2.878 N/A ARG 68.A NE PRO 98.A O no hydrogen 3.349 N/A ARG 68.A NH1 LYS 67.A O no hydrogen 2.869 N/A ARG 68.A NH2 PRO 98.A O no hydrogen 3.038 N/A ASN 69.A N ASP 96.A OD1 no hydrogen 3.049 N/A ASN 69.A ND2 ILE 49.A O no hydrogen 3.330 N/A VAL 70.A N ILE 49.A O no hydrogen 3.094 N/A ILE 71.A N GLU 94.A O no hydrogen 2.808 N/A ILE 74.A N LEU 92.A O no hydrogen 2.773 N/A HIS 76.A N ILE 90.A O no hydrogen 2.958 N/A ASN 78.A N HIS 76.A ND1 no hydrogen 2.997 N/A TYR 79.A N HIS 76.A O no hydrogen 2.957 N/A TYR 79.A OH LYS 85.A O no hydrogen 3.096 N/A ILE 83.A N ASN 80.A O no hydrogen 3.036 N/A ASN 84.A N.A ALA 81A.A O no hydrogen 3.210 N/A ASN 84.A N.B ALA 81A.A O no hydrogen 3.213 N/A LYS 85.A NZ TYR 86.A OH no hydrogen 3.168 N/A TYR 86.A N ASN 84.A OD1.A no hydrogen 2.507 N/A ASN 87.A N ASN 84.A OD1.B no hydrogen 2.860 N/A HIS 88.A ND1 TYR 224.A OH no hydrogen 2.867 N/A ILE 90.A N HIS 88.A O no hydrogen 2.808 N/A ALA 91.A N THR 38.A O no hydrogen 2.899 N/A LEU 92.A N ILE 74.A O no hydrogen 2.860 N/A LEU 93.A N ILE 36.A O no hydrogen 2.800 N/A GLU 94.A N ARG 72.A O.A no hydrogen 2.913 N/A GLU 94.A N ARG 72.A O.B no hydrogen 2.920 N/A LEU 95.A N LYS 34.A O no hydrogen 2.882 N/A ASP 96.A N ASN 69.A O no hydrogen 2.895 N/A LEU 99.A N GLU 33.A O no hydrogen 2.810 N/A VAL 100.A N GLN 66.A OE1 no hydrogen 2.771 N/A ASN 102.A N VAL 105.A O no hydrogen 2.927 N/A TYR 104.A N ASN 102.A OD1 no hydrogen 2.817 N/A VAL 105.A N ASN 102.A O no hydrogen 3.157 N/A THR 106.A N PRO 13.A O no hydrogen 3.040 N/A THR 106.A OG1 ASN 102.A O no hydrogen 2.811 N/A ILE 108.A N ILE 30.A O no hydrogen 2.939 N/A CYS 109.A N SER 197.A O no hydrogen 3.271 N/A LYS 113.A NZ GLU 114.A OE2 no hydrogen 2.574 N/A TYR 115.A N ASP 112.A OD1 no hydrogen 2.734 N/A THR 116.A N ASP 112.A O no hydrogen 2.928 N/A THR 116.A OG1 ASP 112.A O no hydrogen 2.797 N/A PHE 119.A N TYR 115.A O no hydrogen 2.768 N/A LEU 120.A N THR 116.A O no hydrogen 2.940 N/A LYS 121.A N.A ASN 117A.A O no hydrogen 3.034 N/A LYS 121.A N.B ASN 117A.A O no hydrogen 3.061 N/A PHE 122.A N PHE 119.A O no hydrogen 3.062 N/A GLY 123.A N LEU 120.A O no hydrogen 3.111 N/A GLY 125.A N VAL 148.A O no hydrogen 3.116 N/A TYR 126.A N VAL 190.A O no hydrogen 2.777 N/A VAL 127.A N LEU 146.A O no hydrogen 2.882 N/A SER 128.A OG GLN 15.A OE1 no hydrogen 2.563 N/A GLY 129.A N GLN 144.A O no hydrogen 2.939 N/A TRP 130.A NE1 HIS 56.A O no hydrogen 2.950 N/A GLY 131.A N ASP 184.A OD1 no hydrogen 2.815 N/A ARG 132.A N GLN 182.A O no hydrogen 2.787 N/A ARG 132.A NE GLY 137.A O no hydrogen 2.806 N/A VAL 133.A N ARG 138.A O no hydrogen 3.030 N/A GLY 137.A N PHE 134.A O no hydrogen 2.738 N/A SER 139.A OG.A TRP 130.A O no hydrogen 2.742 N/A SER 139.A OG.A ALA 140.A O no hydrogen 3.236 N/A ALA 140.A N TRP 130.A O no hydrogen 3.273 N/A ALA 140.A N GLY 131.A O no hydrogen 3.158 N/A LEU 143.A N HIS 56.A O no hydrogen 3.007 N/A GLN 144.A N GLY 129.A O no hydrogen 3.092 N/A GLN 144.A NE2 ASP 6.A OD1 no hydrogen 2.811 N/A GLN 144.A NE2 VAL 142.A O no hydrogen 2.990 N/A TYR 145.A N GLU 5.A O.A no hydrogen 2.969 N/A TYR 145.A N GLU 5.A O.B no hydrogen 3.010 N/A LEU 146.A N VAL 127.A O no hydrogen 2.869 N/A ARG 147.A NE.B SER 124.A OG no hydrogen 2.434 N/A VAL 148.A N GLY 125.A O no hydrogen 2.803 N/A LEU 150.A N GLY 123.A O no hydrogen 2.979 N/A VAL 151.A N CYS 170.A O.A no hydrogen 2.940 N/A VAL 151.A N CYS 170.A O.B no hydrogen 2.864 N/A ARG 153.A NH1.A ILE 164.A O no hydrogen 2.992 N/A ARG 153.A NH1.B MET 168.A O no hydrogen 3.381 N/A ARG 153.A NH2.A ILE 164.A O no hydrogen 2.887 N/A ARG 153.A NH2.B TYR 165.A O no hydrogen 2.937 N/A ARG 153.A NH2.B MET 168.A O no hydrogen 2.493 N/A THR 155.A N ASP 152.A OD1 no hydrogen 2.639 N/A THR 155.A OG1 ASP 152.A OD1 no hydrogen 2.715 N/A THR 155.A OG1 ASP 152.A OD2 no hydrogen 2.776 N/A CYS 156.A N ASP 152.A O no hydrogen 3.190 N/A LEU 157.A N ARG 153.A O.A no hydrogen 2.894 N/A LEU 157.A N ARG 153.A O.B no hydrogen 2.853 N/A ARG 158.A N ALA 154.A O no hydrogen 3.201 N/A SER 159.A N CYS 156.A O no hydrogen 2.859 N/A SER 159.A OG CYS 156.A O no hydrogen 2.558 N/A THR 160.A OG1 GLU 207.A OE1 no hydrogen 2.853 N/A PHE 162.A N THR 160.A OG1 no hydrogen 2.968 N/A ASN 167.A ND2 ASN 87.A OD1 no hydrogen 3.603 N/A MET 168.A N TYR 165.A O no hydrogen 2.987 N/A PHE 169.A N TYR 218.A O no hydrogen 2.848 N/A ALA 171.A N GLY 216.A O no hydrogen 3.087 N/A GLY 172.A N PRO 149.A O no hydrogen 3.030 N/A HIS 174.A ND1 TYR 215.A OH no hydrogen 2.429 N/A GLU 175.A N GLU 175.A OE1 no hydrogen 2.516 N/A GLY 176.A N PHE 173A.A O no hydrogen 3.120 N/A GLY 177.A N ALA 210.A O no hydrogen 2.852 N/A ASP 179.A N VAL 2.A O no hydrogen 3.168 N/A SER 180.A N.A ASP 179.A OD1 no hydrogen 2.730 N/A SER 180.A N.B ASP 179.A OD1 no hydrogen 2.727 N/A SER 180.A OG.A ASP 179.A OD1 no hydrogen 3.519 N/A SER 180.A OG.A TYR 218.A OH no hydrogen 2.908 N/A SER 180.A OG.B TYR 218.A OH no hydrogen 3.084 N/A CYS 181.A N ASP 184.A OD2 no hydrogen 2.802 N/A CYS 181.A SG GLN 182.A OE1 no hydrogen 3.431 N/A ASP 184.A N CYS 181.A O no hydrogen 2.972 N/A GLY 186.A N ILE 203.A O no hydrogen 2.886 N/A GLY 187.A N ASP 184.A O no hydrogen 2.973 N/A HIS 189.A N GLY 201.A O no hydrogen 3.033 N/A HIS 189.A ND1 THR 200.A OG1 no hydrogen 2.775 N/A VAL 190.A N TYR 126.A O no hydrogen 2.868 N/A THR 191.A N PHE 198.A O no hydrogen 2.877 N/A THR 191.A OG1 THR 200.A OG1 no hydrogen 2.942 N/A VAL 193.A N THR 196.A O no hydrogen 2.731 N/A THR 196.A N VAL 193.A O no hydrogen 3.002 N/A PHE 198.A N THR 191.A O no hydrogen 2.876 N/A LEU 199.A N CYS 109.A O no hydrogen 2.873 N/A THR 200.A N HIS 189.A O no hydrogen 2.865 N/A THR 200.A OG1 HIS 189.A ND1 no hydrogen 2.775 N/A THR 200.A OG1 HIS 189.A O no hydrogen 3.145 N/A THR 200.A OG1 THR 191.A OG1 no hydrogen 2.942 N/A GLY 201.A N HIS 189.A O no hydrogen 3.024 N/A ILE 202.A N THR 219.A O no hydrogen 3.112 N/A ILE 203.A N GLY 187.A O no hydrogen 2.995 N/A SER 204.A OG ASP 89.A OD2 no hydrogen 2.663 N/A TRP 205.A N ILE 217.A O no hydrogen 3.117 N/A CYS 209.A SG SER 180.A O.A no hydrogen 3.898 N/A CYS 209.A SG SER 180.A O.B no hydrogen 3.874 N/A CYS 209.A SG GLN 182.A OE1 no hydrogen 3.181 N/A ALA 210.A N ASP 179.A OD2 no hydrogen 2.962 N/A GLY 213.A N HIS 174.A O no hydrogen 2.954 N/A LYS 214.A N MET 211A.A O no hydrogen 3.123 N/A LYS 214.A NZ SER 159.A O no hydrogen 2.757 N/A LYS 214.A NZ GLU 207.A OE1 no hydrogen 2.856 N/A LYS 214.A NZ GLU 207.A OE2 no hydrogen 3.345 N/A TYR 215.A OH HIS 174.A ND1 no hydrogen 2.429 N/A GLY 216.A N ALA 171.A O no hydrogen 2.988 N/A ILE 217.A N TRP 205.A O no hydrogen 2.783 N/A TYR 218.A N PHE 169.A O no hydrogen 2.786 N/A TYR 218.A OH SER 180.A OG.B no hydrogen 3.084 N/A THR 219.A N ILE 202.A O no hydrogen 2.912 N/A THR 219.A OG1 ASP 89.A O no hydrogen 2.823 N/A LYS 220.A N ASN 167.A O no hydrogen 2.816 N/A LYS 220.A NZ ASN 166.A O no hydrogen 3.270 N/A VAL 221.A N THR 200.A O no hydrogen 3.444 N/A ARG 223.A N LYS 220.A O no hydrogen 3.365 N/A ARG 223.A NE ASN 167.A OD1 no hydrogen 2.657 N/A ARG 223.A NH1 ASN 167.A OD1 no hydrogen 2.934 N/A TYR 224.A N VAL 221.A O no hydrogen 2.736 N/A TYR 224.A OH HIS 88.A ND1 no hydrogen 2.867 N/A ILE 228.A N TYR 224.A O no hydrogen 2.967 N/A LYS 229.A N VAL 225.A O no hydrogen 2.928 N/A LYS 229.A NZ ILE 110.A O no hydrogen 2.895 N/A GLU 230.A N ASN 226.A O no hydrogen 2.965 N/A LYS 231.A N TRP 227.A O no hydrogen 2.943 N/A THR 232.A N ILE 228.A O no hydrogen 3.013 N/A THR 232.A OG1 ILE 228.A O no hydrogen 2.651 N/A LYS 233.A NZ GLU 230.A O no hydrogen 3.477 N/A ASN 117A.A N LYS 113.A O no hydrogen 3.227 N/A ALA 82B.A N ASN 80.A OD1 no hydrogen 3.123 N/A ILE 118B.A N GLU 114.A O no hydrogen 3.076 N/A