Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2a46_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 1.A ND2 LYS 79.A O no hydrogen 2.858 N/A ASN 1.A ND2 PHE 82.A O no hydrogen 2.802 N/A PHE 3.A N ASN 1.A OD1 no hydrogen 2.470 N/A ILE 4.A N ASN 1.A O no hydrogen 2.818 N/A MET 8.A N GLY 31.A O no hydrogen 2.890 N/A LYS 9.A N ASN 111.A O no hydrogen 2.771 N/A MET 10.A N GLY 29.A O no hydrogen 2.941 N/A THR 11.A N PHE 113.A O no hydrogen 2.980 N/A TYR 12.A N GLY 27.A O no hydrogen 2.844 N/A TYR 12.A OH SER 40.A OG no hydrogen 3.065 N/A HIS 13.A N HIS 115.A O no hydrogen 3.023 N/A HIS 13.A NE2 ASP 15.A OD1 no hydrogen 3.052 N/A MET 14.A N VAL 25.A O no hydrogen 2.894 N/A ASP 15.A N SER 117.A O no hydrogen 2.995 N/A GLY 16.A N PHE 23.A O no hydrogen 2.956 N/A CYS 17.A N PHE 119.A O no hydrogen 2.940 N/A VAL 18.A N HIS 21.A O no hydrogen 2.999 N/A ASN 19.A N GLY 121.A O no hydrogen 2.872 N/A ASN 19.A ND2 PHE 124.A O no hydrogen 2.763 N/A HIS 21.A N VAL 18.A O no hydrogen 2.826 N/A HIS 21.A ND1 VAL 18.A O no hydrogen 3.144 N/A PHE 23.A N GLY 16.A O no hydrogen 3.039 N/A THR 24.A N THR 45.A O no hydrogen 3.091 N/A VAL 25.A N MET 14.A O no hydrogen 2.913 N/A LYS 26.A N LYS 43.A O no hydrogen 3.060 N/A LYS 26.A NZ HIS 13.A ND1 no hydrogen 2.772 N/A GLY 27.A N TYR 12.A O no hydrogen 3.048 N/A GLU 28.A N THR 41.A O no hydrogen 2.994 N/A GLY 29.A N MET 10.A O no hydrogen 2.892 N/A ASN 30.A N THR 39.A O no hydrogen 2.965 N/A GLY 31.A N MET 8.A O no hydrogen 2.936 N/A LYS 32.A N THR 37.A O no hydrogen 2.860 N/A TYR 34.A OH ILE 4.A O no hydrogen 2.798 N/A GLU 35.A N LYS 32.A O no hydrogen 3.019 N/A GLY 36.A N LYS 32.A O no hydrogen 2.980 N/A GLY 36.A N PRO 33.A O no hydrogen 3.339 N/A THR 37.A N LYS 32.A O no hydrogen 3.301 N/A GLN 38.A N GLU 210.A O no hydrogen 3.177 N/A THR 39.A N ASN 30.A O no hydrogen 3.033 N/A THR 39.A OG1 THR 209.A OG1 no hydrogen 2.715 N/A SER 40.A N LEU 208.A O no hydrogen 2.886 N/A SER 40.A OG TYR 12.A OH no hydrogen 3.065 N/A THR 41.A N GLU 28.A O no hydrogen 2.778 N/A THR 41.A OG1 GLN 207.A OE1 no hydrogen 3.408 N/A PHE 42.A N VAL 206.A O no hydrogen 2.813 N/A LYS 43.A N LYS 26.A O no hydrogen 2.879 N/A LYS 43.A NZ SER 205.A OG.A no hydrogen 3.343 N/A VAL 44.A N ASN 204.A O no hydrogen 2.748 N/A THR 45.A N THR 24.A O no hydrogen 2.854 N/A ALA 47.A N TYR 22.A O no hydrogen 2.776 N/A GLY 49.A N MET 46.A O no hydrogen 2.874 N/A LEU 52.A N ASN 204.A OD1 no hydrogen 3.093 N/A SER 55.A N VAL 130.A O no hydrogen 2.856 N/A SER 55.A OG THR 135.A OG1 no hydrogen 2.676 N/A ASP 57.A N SER 55.A OG no hydrogen 3.036 N/A ILE 58.A N SER 55.A O no hydrogen 3.154 N/A LEU 59.A N PHE 56.A O no hydrogen 2.831 N/A SER 60.A N PHE 56.A O no hydrogen 3.120 N/A SER 60.A OG ASP 57.A O no hydrogen 3.320 N/A VAL 62.A N LEU 59.A O no hydrogen 2.822 N/A PHE 63.A N LEU 59.A O no hydrogen 3.419 N/A ARG 65.A N TYR 88.A OH no hydrogen 2.798 N/A ARG 65.A NE THR 68.A OG1 no hydrogen 2.748 N/A ARG 65.A NH2 PHE 67.A O no hydrogen 3.126 N/A ARG 65.A NH2 THR 68.A OG1 no hydrogen 3.269 N/A ARG 65.A NH2 GLU 210.A OE1 no hydrogen 3.426 N/A ARG 65.A NH2 GLU 210.A OE2 no hydrogen 2.902 N/A CYS 66.A N ASN 64.A OD1 no hydrogen 2.863 N/A CYS 66.A SG PHE 78.A O no hydrogen 3.634 N/A PHE 67.A N ASN 64.A O no hydrogen 3.118 N/A THR 68.A OG1 ARG 65.A O no hydrogen 2.658 N/A ALA 69.A N ALA 212.A O no hydrogen 2.994 N/A TYR 70.A OH HIS 188.A NE2 no hydrogen 2.717 N/A MET 74.A N PRO 71.A O no hydrogen 2.944 N/A TYR 77.A OH TYR 176.A O no hydrogen 2.625 N/A LYS 79.A N ASP 76.A OD1 no hydrogen 2.919 N/A LYS 79.A NZ PRO 33.A O no hydrogen 3.130 N/A LYS 79.A NZ CYS 66.A O no hydrogen 2.941 N/A LYS 79.A NZ ASP 76.A OD2 no hydrogen 3.175 N/A GLN 80.A N ASP 76.A O no hydrogen 3.117 N/A GLN 80.A NE2 ASP 76.A O no hydrogen 3.120 N/A GLN 80.A NE2 THR 183.A O no hydrogen 2.924 N/A ALA 81.A N PHE 78.A O no hydrogen 3.212 N/A PHE 82.A N LYS 79.A O no hydrogen 3.386 N/A GLY 85.A N ALA 81.A O no hydrogen 2.903 N/A MET 86.A N ILE 106.A O no hydrogen 3.239 N/A SER 87.A N LYS 177.A O no hydrogen 2.891 N/A TYR 88.A N TRP 104.A O no hydrogen 2.823 N/A GLU 89.A N SER 175.A O no hydrogen 3.012 N/A ARG 90.A N ALA 102.A O no hydrogen 2.812 N/A ARG 90.A NE THR 174.A OG1 no hydrogen 2.731 N/A ARG 90.A NH1 THR 61.A O no hydrogen 2.811 N/A ARG 90.A NH2 TYR 176.A OH no hydrogen 3.172 N/A THR 91.A N HIS 173.A O no hydrogen 2.845 N/A PHE 92.A N ALA 100.A O no hydrogen 2.865 N/A THR 93.A N GLN 171.A O no hydrogen 2.958 N/A TYR 94.A N GLY 98.A O no hydrogen 2.988 N/A GLU 95.A N ARG 169.A O no hydrogen 2.914 N/A GLY 97.A N TYR 94.A O no hydrogen 3.279 N/A GLY 98.A N ASP 96.A OD1 no hydrogen 3.512 N/A VAL 99.A N VAL 122.A O no hydrogen 3.081 N/A ALA 100.A N PHE 92.A O no hydrogen 2.971 N/A THR 101.A N HIS 120.A O no hydrogen 2.867 N/A ALA 102.A N ARG 90.A O no hydrogen 2.916 N/A SER 103.A N THR 118.A O no hydrogen 3.027 N/A SER 103.A OG THR 118.A OG1.A no hydrogen 3.094 N/A TRP 104.A N TYR 88.A O no hydrogen 3.015 N/A GLU 105.A N LYS 116.A O no hydrogen 2.868 N/A ILE 106.A N MET 86.A O no hydrogen 2.855 N/A SER 107.A N GLU 114.A O no hydrogen 2.956 N/A LYS 109.A N CYS 112.A O no hydrogen 2.997 N/A CYS 112.A N LYS 109.A O no hydrogen 2.955 N/A PHE 113.A N LYS 9.A O no hydrogen 2.928 N/A GLU 114.A N SER 107.A O no hydrogen 2.851 N/A HIS 115.A N THR 11.A O no hydrogen 2.992 N/A HIS 115.A NE2 VAL 62.A O no hydrogen 2.886 N/A LYS 116.A N GLU 105.A O no hydrogen 2.990 N/A SER 117.A N HIS 13.A O no hydrogen 2.952 N/A THR 118.A N SER 103.A O no hydrogen 2.894 N/A THR 118.A OG1.A SER 103.A O no hydrogen 3.207 N/A PHE 119.A N ASP 15.A O no hydrogen 3.095 N/A HIS 120.A N THR 101.A O no hydrogen 2.927 N/A GLY 121.A N CYS 17.A O no hydrogen 2.809 N/A VAL 122.A N VAL 99.A O no hydrogen 2.922 N/A PHE 124.A N ASN 19.A OD1 no hydrogen 3.102 N/A GLY 128.A N PRO 125.A O no hydrogen 2.911 N/A ALA 132.A N GLY 128.A O no hydrogen 2.859 N/A LYS 133.A N VAL 130.A O no hydrogen 3.203 N/A LYS 133.A NZ LEU 52.A O no hydrogen 2.818 N/A LYS 133.A NZ GLY 202.A O no hydrogen 2.821 N/A LYS 134.A N PRO 129.A O no hydrogen 3.007 N/A THR 135.A OG1 SER 55.A OG no hydrogen 2.676 N/A THR 135.A OG1 ASP 57.A OD2 no hydrogen 2.533 N/A THR 136.A N MET 161.A O no hydrogen 2.780 N/A THR 136.A OG1 MET 161.A O no hydrogen 3.309 N/A TRP 138.A NE1 ASP 57.A O no hydrogen 2.933 N/A ASP 139.A N PHE 159.A O no hydrogen 2.831 N/A SER 141.A N HIS 192.A O no hydrogen 3.199 N/A GLU 143.A N VAL 190.A O no hydrogen 2.800 N/A LYS 144.A N ASP 155.A O no hydrogen 2.950 N/A MET 145.A N HIS 188.A O no hydrogen 2.785 N/A THR 146.A N LYS 153.A O no hydrogen 2.923 N/A CYS 148.A N ILE 151.A O no hydrogen 2.930 N/A ILE 151.A N CYS 148.A O no hydrogen 3.213 N/A LYS 153.A N THR 146.A O no hydrogen 2.768 N/A LYS 153.A NZ SER 175.A OG no hydrogen 3.388 N/A GLY 154.A N THR 174.A O no hydrogen 2.868 N/A ASP 155.A N LYS 144.A O no hydrogen 2.885 N/A VAL 156.A N PHE 172.A O no hydrogen 3.136 N/A ALA 158.A N CYS 170.A O no hydrogen 2.836 N/A LEU 160.A N TYR 168.A O no hydrogen 2.876 N/A MET 161.A N GLY 137.A O no hydrogen 2.776 N/A LEU 162.A N GLY 166.A O no hydrogen 2.940 N/A GLN 163.A N LYS 134.A O no hydrogen 2.818 N/A GLY 165.A N LEU 162.A O no hydrogen 2.682 N/A TYR 168.A N LEU 160.A O no hydrogen 2.832 N/A TYR 168.A OH ASP 96.A OD1 no hydrogen 2.650 N/A TYR 168.A OH ASP 96.A OD2 no hydrogen 3.350 N/A ARG 169.A N GLU 95.A OE1 no hydrogen 2.726 N/A CYS 170.A N ALA 158.A O no hydrogen 2.835 N/A CYS 170.A SG GLN 171.A O no hydrogen 3.952 N/A GLN 171.A N THR 93.A O no hydrogen 2.882 N/A GLN 171.A NE2 THR 157.A OG1 no hydrogen 2.711 N/A PHE 172.A N VAL 156.A O no hydrogen 2.849 N/A HIS 173.A N THR 91.A O no hydrogen 2.995 N/A HIS 173.A ND1 ASP 155.A OD2 no hydrogen 2.738 N/A THR 174.A N GLY 154.A O no hydrogen 2.881 N/A SER 175.A N GLU 89.A O no hydrogen 2.840 N/A TYR 176.A N LEU 152.A O no hydrogen 2.817 N/A TYR 176.A OH GLU 143.A OE2 no hydrogen 2.552 N/A LYS 177.A N SER 87.A O no hydrogen 2.903 N/A LYS 177.A NZ GLU 89.A OE2 no hydrogen 2.721 N/A THR 178.A OG1 LYS 180.A O no hydrogen 2.680 N/A LYS 179.A N GLY 85.A O no hydrogen 3.066 N/A LYS 179.A NZ GLU 105.A OE1 no hydrogen 3.303 N/A LYS 179.A NZ GLU 105.A OE2 no hydrogen 2.584 N/A LYS 180.A NZ ASP 84.A OD1 no hydrogen 2.664 N/A THR 183.A N GLN 80.A OE1 no hydrogen 2.835 N/A THR 183.A OG1 GLN 80.A OE1 no hydrogen 3.448 N/A HIS 188.A N MET 145.A O no hydrogen 3.029 N/A HIS 188.A ND1 PRO 186.A O no hydrogen 2.825 N/A HIS 188.A NE2 TYR 70.A OH no hydrogen 2.717 N/A VAL 189.A N HIS 215.A O no hydrogen 3.382 N/A VAL 190.A N GLU 143.A O no hydrogen 2.859 N/A GLU 191.A N VAL 213.A O no hydrogen 2.788 N/A HIS 192.A N SER 141.A O no hydrogen 2.909 N/A HIS 192.A ND1 GLU 210.A OE2 no hydrogen 2.665 N/A HIS 192.A NE2 GLU 143.A OE1 no hydrogen 2.777 N/A ARG 193.A N HIS 211.A O no hydrogen 2.949 N/A ARG 193.A NH1 GLU 191.A OE2 no hydrogen 2.991 N/A ARG 193.A NH1 HIS 192.A O no hydrogen 3.143 N/A ARG 193.A NH2 GLU 191.A OE2 no hydrogen 2.872 N/A ALA 195.A N THR 209.A O no hydrogen 2.792 N/A ARG 196.A NE ASP 57.A OD1 no hydrogen 2.764 N/A ARG 196.A NH1 ASP 198.A OD1 no hydrogen 2.857 N/A ARG 196.A NH2 ASP 57.A OD1 no hydrogen 3.543 N/A ARG 196.A NH2 ASP 57.A OD2 no hydrogen 2.765 N/A ARG 196.A NH2 THR 135.A O no hydrogen 3.006 N/A THR 197.A N GLN 207.A O no hydrogen 2.822 N/A LEU 199.A N SER 205.A O no hydrogen 2.738 N/A GLY 203.A N ASP 200.A O no hydrogen 3.144 N/A ASN 204.A ND2 VAL 44.A O no hydrogen 2.982 N/A ASN 204.A ND2 GLY 50.A O no hydrogen 3.262 N/A SER 205.A N ASP 200.A OD1 no hydrogen 3.168 N/A VAL 206.A N PHE 42.A O no hydrogen 3.012 N/A GLN 207.A N THR 197.A O no hydrogen 2.867 N/A LEU 208.A N SER 40.A O no hydrogen 2.882 N/A THR 209.A N ALA 195.A O no hydrogen 3.007 N/A THR 209.A OG1 THR 39.A OG1 no hydrogen 2.715 N/A GLU 210.A N GLN 38.A O no hydrogen 2.948 N/A HIS 211.A N ARG 193.A O no hydrogen 2.805 N/A ALA 212.A N GLY 36.A O no hydrogen 2.917 N/A VAL 213.A N GLU 191.A O no hydrogen 3.049 N/A ALA 214.A N ALA 69.A O no hydrogen 2.935 N/A HIS 215.A N VAL 189.A O no hydrogen 2.890 N/A HIS 215.A NE2 GLU 191.A OE1 no hydrogen 2.659 N/A