Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3i14_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 4.A N ILE 13.A O no hydrogen 2.897 N/A ASN 6.A N ILE 11.A O no hydrogen 2.930 N/A SER 12.A N THR 24.A O no hydrogen 2.923 N/A ILE 13.A N ILE 4.A O no hydrogen 2.851 N/A SER 14.A N VAL 22.A O no hydrogen 2.861 N/A GLN 15.A N THR 2.A O no hydrogen 2.790 N/A GLN 15.A NE2 ASN 17.A O no hydrogen 3.023 N/A GLN 15.A NE2 LYS 18.A O no hydrogen 3.502 N/A LEU 16.A N VAL 20.A O no hydrogen 2.857 N/A LYS 18.A NZ ASN 19.A OD1 no hydrogen 3.419 N/A ASN 19.A N ASN 17.A OD1 no hydrogen 2.617 N/A ASN 19.A ND2 LYS 18.A O no hydrogen 2.690 N/A VAL 20.A N ASN 17.A O no hydrogen 3.260 N/A TRP 21.A N VAL 33.A O no hydrogen 2.888 N/A VAL 22.A N SER 14.A O no hydrogen 2.782 N/A HIS 23.A N GLY 31.A O no hydrogen 2.870 N/A HIS 23.A ND1 GLU 25.A OE2 no hydrogen 2.413 N/A HIS 23.A NE2 ASP 44.A O no hydrogen 2.817 N/A THR 24.A N SER 12.A O no hydrogen 2.770 N/A THR 24.A OG1 ASN 30.A OD1 no hydrogen 2.803 N/A GLU 25.A N SER 29.A O no hydrogen 2.934 N/A LEU 26.A N THR 10.A O no hydrogen 2.902 N/A SER 29.A N GLU 25.A O no hydrogen 2.974 N/A ASN 30.A N GLY 197.A O no hydrogen 2.866 N/A ASN 30.A ND2 PRO 196.A O no hydrogen 2.919 N/A ASN 30.A ND2 GLY 199.A O no hydrogen 2.807 N/A GLY 31.A N HIS 23.A O no hydrogen 2.799 N/A LEU 32.A N VAL 43.A O no hydrogen 2.893 N/A VAL 33.A N TRP 21.A O no hydrogen 2.731 N/A LEU 34.A N VAL 41.A O no hydrogen 2.787 N/A ASN 35.A N ASN 19.A O no hydrogen 2.772 N/A THR 36.A N GLY 39.A O no hydrogen 3.162 N/A THR 36.A OG1 GLY 39.A O no hydrogen 2.673 N/A LYS 38.A N THR 36.A OG1 no hydrogen 3.059 N/A GLY 39.A N THR 36.A O no hydrogen 3.226 N/A LEU 40.A N ARG 66.A O no hydrogen 2.807 N/A VAL 41.A N LEU 34.A O no hydrogen 3.015 N/A LEU 42.A N ASP 69.A O no hydrogen 2.936 N/A VAL 43.A N LEU 32.A O no hydrogen 2.863 N/A ASP 44.A N ILE 71.A O no hydrogen 2.765 N/A SER 46.A N THR 52.A OG1 no hydrogen 3.172 N/A SER 46.A OG GLU 25.A OE1 no hydrogen 2.616 N/A TRP 47.A NE1 GLU 25.A O no hydrogen 2.992 N/A LEU 51.A N ASP 48.A OD1 no hydrogen 2.854 N/A THR 52.A N ASP 48.A O no hydrogen 3.068 N/A THR 52.A OG1 ASP 48.A O no hydrogen 2.842 N/A LYS 53.A N ASP 49.A O no hydrogen 2.894 N/A GLU 54.A N LYS 50.A O no hydrogen 3.121 N/A LEU 55.A N LEU 51.A O no hydrogen 2.859 N/A ILE 56.A N THR 52.A O no hydrogen 2.978 N/A GLU 57.A N LYS 53.A O no hydrogen 2.965 N/A MET 58.A N GLU 54.A O no hydrogen 2.918 N/A VAL 59.A N LEU 55.A O no hydrogen 3.062 N/A GLU 60.A N ILE 56.A O no hydrogen 2.831 N/A LYS 61.A N GLU 57.A O no hydrogen 3.167 N/A LYS 62.A N MET 58.A O no hydrogen 3.054 N/A PHE 63.A N VAL 59.A O no hydrogen 2.909 N/A GLN 64.A NE2 LYS 61.A O no hydrogen 2.944 N/A LYS 65.A NZ ASN 35.A OD1 no hydrogen 2.892 N/A LYS 65.A NZ THR 36.A O no hydrogen 3.010 N/A ARG 66.A NH2 GLU 60.A OE1 no hydrogen 2.918 N/A VAL 67.A N GLU 60.A OE2 no hydrogen 2.792 N/A THR 68.A N LEU 40.A O no hydrogen 2.883 N/A THR 68.A OG1 LEU 40.A O no hydrogen 3.471 N/A THR 68.A OG1 ASP 69.A OD1 no hydrogen 2.704 N/A VAL 70.A N LYS 92.A O no hydrogen 2.808 N/A ILE 71.A N LEU 42.A O no hydrogen 2.873 N/A ILE 72.A N HIS 94.A O no hydrogen 2.933 N/A THR 73.A N ASP 44.A OD1 no hydrogen 2.945 N/A THR 73.A OG1 ASP 44.A OD1 no hydrogen 3.269 N/A THR 73.A OG1 ASP 44.A OD2 no hydrogen 2.645 N/A HIS 74.A NE2 HIS 76.A ND1 no hydrogen 3.097 N/A ALA 75.A N ASP 140.A OD2 no hydrogen 2.916 N/A HIS 76.A NE2 ASP 171.A OD2 no hydrogen 2.720 N/A ARG 79.A N.A HIS 76.A O.A no hydrogen 2.808 N/A ARG 79.A N.B HIS 76.A O.A no hydrogen 2.155 N/A ARG 79.A N.B HIS 76.A O.B no hydrogen 2.869 N/A ARG 79.A NH1 ASN 30.A O no hydrogen 2.909 N/A ARG 79.A NH2 ASN 30.A O no hydrogen 3.507 N/A ARG 79.A NH2 GLY 197.A O no hydrogen 2.958 N/A ILE 80.A N HIS 76.A O.A no hydrogen 2.518 N/A ILE 80.A N HIS 76.A O.B no hydrogen 2.876 N/A GLY 81.A N ALA 77.A O.A no hydrogen 3.143 N/A ILE 83.A N ILE 80.A O no hydrogen 2.941 N/A THR 85.A N ASP 49.A OD1 no hydrogen 2.997 N/A THR 85.A OG1 ASP 49.A OD1 no hydrogen 2.677 N/A LEU 86.A N GLY 82.A O no hydrogen 3.138 N/A LYS 87.A N ILE 83.A O no hydrogen 2.967 N/A LYS 87.A NZ GLU 110.A O no hydrogen 2.585 N/A GLU 88.A N LYS 84.A O no hydrogen 3.063 N/A ARG 89.A N THR 85.A O no hydrogen 3.166 N/A ARG 89.A NH1 GLU 57.A OE2 no hydrogen 3.346 N/A ARG 89.A NH2 GLU 57.A OE2 no hydrogen 2.966 N/A GLY 90.A N LYS 87.A O no hydrogen 3.223 N/A ILE 91.A N LEU 86.A O no hydrogen 2.933 N/A LYS 92.A N THR 68.A O no hydrogen 3.080 N/A HIS 94.A N VAL 70.A O no hydrogen 2.785 N/A HIS 94.A ND1 ASP 114.A OD2 no hydrogen 2.563 N/A HIS 94.A NE2 ASP 69.A OD2 no hydrogen 2.649 N/A SER 95.A N ASP 114.A OD1 no hydrogen 3.173 N/A SER 95.A OG THR 96.A O no hydrogen 2.875 N/A THR 96.A OG1 THR 99.A OG1 no hydrogen 3.074 N/A THR 99.A N THR 96.A OG1 no hydrogen 2.985 N/A THR 99.A OG1 THR 96.A OG1 no hydrogen 3.074 N/A THR 99.A OG1 ASP 140.A OD2 no hydrogen 2.706 N/A ALA 100.A N THR 96.A O no hydrogen 3.070 N/A GLU 101.A N.A ALA 97.A O no hydrogen 2.884 N/A GLU 101.A N.B ALA 97.A O no hydrogen 2.974 N/A LEU 102.A N LEU 98.A O no hydrogen 2.939 N/A ALA 103.A N THR 99.A O no hydrogen 2.916 N/A LYS 104.A N ALA 100.A O no hydrogen 3.004 N/A LYS 105.A N GLU 101.A O.A no hydrogen 3.074 N/A LYS 105.A N GLU 101.A O.B no hydrogen 2.756 N/A ASN 106.A N LEU 102.A O no hydrogen 3.049 N/A GLY 107.A N LYS 104.A O no hydrogen 2.993 N/A TYR 108.A N ALA 103.A O no hydrogen 2.925 N/A LEU 112.A N ALA 93.A O no hydrogen 2.806 N/A GLY 113.A N SER 95.A OG no hydrogen 3.175 N/A LEU 115.A N SER 95.A O no hydrogen 2.893 N/A GLN 116.A N THR 119.A OG1 no hydrogen 2.830 N/A GLN 116.A NE2 ASP 114.A O no hydrogen 3.098 N/A THR 119.A N THR 130.A O no hydrogen 3.035 N/A ASN 120.A ND2 GLU 129.A OE1 no hydrogen 3.049 N/A LEU 121.A N VAL 128.A O no hydrogen 2.813 N/A PHE 123.A N MET 126.A O no hydrogen 2.874 N/A MET 126.A N PHE 123.A O no hydrogen 2.947 N/A LYS 127.A N GLN 148.A OE1 no hydrogen 2.935 N/A VAL 128.A N LEU 121.A O no hydrogen 2.967 N/A GLU 129.A N TRP 145.A O no hydrogen 2.822 N/A THR 130.A N THR 119.A O no hydrogen 2.838 N/A PHE 131.A N VAL 143.A O no hydrogen 2.940 N/A TYR 132.A N THR 117.A O no hydrogen 2.845 N/A TYR 132.A OH GLU 139.A O.A no hydrogen 2.721 N/A TYR 132.A OH GLU 139.A O.B no hydrogen 2.682 N/A GLY 136.A N THR 138.A O no hydrogen 2.918 N/A THR 138.A N ASN 141.A OD1 no hydrogen 3.136 N/A THR 138.A OG1 ASP 140.A OD1 no hydrogen 2.805 N/A ASN 141.A ND2 GLY 134.A O no hydrogen 2.878 N/A ASN 141.A ND2 ASN 141.A O no hydrogen 2.791 N/A ILE 142.A N THR 73.A O no hydrogen 2.977 N/A VAL 143.A N PHE 131.A O no hydrogen 2.914 N/A VAL 144.A N VAL 153.A O no hydrogen 3.085 N/A TRP 145.A N GLU 129.A O no hydrogen 2.777 N/A LEU 146.A N ILE 151.A O no hydrogen 2.941 N/A GLN 148.A NE2 ASN 125.A O no hydrogen 2.787 N/A TYR 149.A N LEU 146.A O no hydrogen 3.104 N/A ASN 150.A ND2 ASN 190.A O no hydrogen 2.747 N/A ILE 151.A N LEU 146.A O no hydrogen 3.474 N/A LEU 152.A N ALA 193.A O no hydrogen 2.898 N/A VAL 153.A N VAL 144.A O no hydrogen 2.732 N/A GLY 154.A N VAL 195.A O no hydrogen 2.818 N/A CYS 156.A SG.A ASP 78.A OD2.A no hydrogen 3.404 N/A CYS 156.A SG.A HIS 198.A NE2 no hydrogen 3.574 N/A VAL 158.A N GLY 155.A O.A no hydrogen 3.236 N/A VAL 158.A N GLY 155.A O.B no hydrogen 3.018 N/A LYS 159.A N THR 210.A OG1 no hydrogen 2.945 N/A LYS 159.A NZ LEU 166.A O no hydrogen 2.874 N/A SER 160.A OG SER 162.A OG no hydrogen 2.820 N/A SER 162.A OG SER 160.A OG no hydrogen 2.820 N/A ALA 163.A N SER 160.A O no hydrogen 2.977 N/A LYS 164.A NZ THR 161.A O no hydrogen 2.689 N/A GLY 167.A N ASP 165.A OD1 no hydrogen 2.917 N/A ALA 170.A N ASN 168.A OD1 no hydrogen 3.074 N/A ALA 172.A N VAL 169.A O no hydrogen 3.120 N/A TYR 173.A N GLY 136.A O no hydrogen 2.848 N/A GLU 176.A N.A TYR 173.A O no hydrogen 3.246 N/A GLU 176.A N.B GLU 176.A OE2.B no hydrogen 2.563 N/A TRP 177.A N TYR 173.A O no hydrogen 2.931 N/A TRP 177.A NE1 LEU 157.A O no hydrogen 2.812 N/A SER 180.A N GLU 176.A O.A no hydrogen 2.933 N/A SER 180.A N GLU 176.A O.B no hydrogen 2.870 N/A SER 180.A OG PRO 133.A O no hydrogen 3.491 N/A SER 180.A OG LYS 135.A O no hydrogen 2.683 N/A SER 180.A OG GLU 176.A O.A no hydrogen 3.133 N/A SER 180.A OG GLU 176.A O.B no hydrogen 3.227 N/A ILE 181.A N.A TRP 177.A O no hydrogen 2.932 N/A ILE 181.A N.B TRP 177.A O no hydrogen 2.951 N/A GLU 182.A N SER 178.A O no hydrogen 2.881 N/A ASN 183.A N THR 179.A O no hydrogen 2.815 N/A ASN 183.A ND2 PRO 133.A O no hydrogen 2.868 N/A VAL 184.A N SER 180.A O no hydrogen 3.114 N/A LEU 185.A N ILE 181.A O.A no hydrogen 2.964 N/A LEU 185.A N ILE 181.A O.B no hydrogen 2.925 N/A LYS 186.A N GLU 182.A O no hydrogen 2.887 N/A ARG 187.A N ASN 183.A O no hydrogen 3.095 N/A ARG 187.A NE GLU 129.A OE2 no hydrogen 3.003 N/A ARG 187.A NE TYR 188.A OH no hydrogen 3.407 N/A ARG 187.A NH2 GLU 129.A OE1 no hydrogen 3.163 N/A ARG 187.A NH2 GLU 129.A OE2 no hydrogen 3.224 N/A TYR 188.A N VAL 184.A O no hydrogen 2.953 N/A TYR 188.A OH GLU 129.A OE2 no hydrogen 2.689 N/A ASN 192.A N ASN 150.A O no hydrogen 2.809 N/A ASN 192.A ND2 TYR 149.A O no hydrogen 3.060 N/A VAL 194.A N GLY 202.A O no hydrogen 2.848 N/A VAL 195.A N LEU 152.A O no hydrogen 2.788 N/A GLY 197.A N GLY 155.A O.B no hydrogen 2.924 N/A HIS 198.A ND1 PRO 28.A O no hydrogen 2.590 N/A HIS 198.A NE2 ASP 78.A OD2.A no hydrogen 3.095 N/A GLY 202.A N VAL 194.A O no hydrogen 2.910 N/A GLY 205.A N ASP 203.A OD1 no hydrogen 2.893 N/A LEU 206.A N ASP 203.A O no hydrogen 2.977 N/A LEU 207.A N LYS 204.A O no hydrogen 2.880 N/A LEU 208.A N LYS 204.A O no hydrogen 3.264 N/A HIS 209.A N GLY 205.A O no hydrogen 2.830 N/A HIS 209.A NE2 ALA 163.A O no hydrogen 2.667 N/A THR 210.A N LEU 206.A O no hydrogen 3.041 N/A THR 210.A OG1 LEU 206.A O no hydrogen 2.849 N/A LEU 211.A N LEU 207.A O no hydrogen 2.986 N/A ASP 212.A N LEU 208.A O no hydrogen 3.007 N/A LEU 213.A N HIS 209.A O no hydrogen 2.933 N/A LEU 214.A N THR 210.A O no hydrogen 3.147 N/A LEU 214.A N LEU 211.A O no hydrogen 3.220 N/A LYS 215.A N ASP 212.A O no hydrogen 3.112 N/A