Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4pgt_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 5.A N GLN 57.A O no hydrogen 2.916 N/A VAL 6.A N LYS 30.A O no hydrogen 2.818 N/A VAL 7.A N LYS 55.A O no hydrogen 2.833 N/A TYR 8.A N GLU 32.A O no hydrogen 3.075 N/A VAL 11.A N PHE 9.A O no hydrogen 2.859 N/A ARG 12.A N PRO 202.A O no hydrogen 2.868 N/A ARG 12.A NE TYR 198.A O no hydrogen 2.843 N/A ARG 12.A NH2 TYR 198.A O no hydrogen 3.032 N/A ARG 12.A NH2 VAL 199.A O no hydrogen 2.886 N/A GLY 13.A N ILE 203.A O no hydrogen 2.750 N/A ARG 14.A N TYR 8.A OH no hydrogen 3.084 N/A ARG 14.A NH1 GLU 98.A OE1 no hydrogen 2.730 N/A ARG 14.A NH1 GLU 98.A OE2 no hydrogen 3.160 N/A ARG 14.A NH2 GLU 98.A OE2 no hydrogen 3.104 N/A CYS 15.A N ARG 12.A O no hydrogen 2.898 N/A ARG 19.A N CYS 15.A O no hydrogen 2.946 N/A ARG 19.A NE GLU 31.A OE2 no hydrogen 2.719 N/A ARG 19.A NH1 VAL 11.A O no hydrogen 2.803 N/A ARG 19.A NH2 GLU 31.A OE1 no hydrogen 2.848 N/A MET 20.A N ALA 16.A O no hydrogen 2.901 N/A LEU 21.A N ALA 17.A O no hydrogen 2.911 N/A LEU 22.A N LEU 18.A O no hydrogen 3.053 N/A ALA 23.A N ARG 19.A O no hydrogen 2.760 N/A ASP 24.A N MET 20.A O no hydrogen 2.835 N/A GLN 25.A N LEU 21.A O no hydrogen 2.827 N/A GLN 25.A N LEU 22.A O no hydrogen 3.210 N/A GLN 25.A NE2 TYR 153.A OH no hydrogen 2.863 N/A GLY 26.A N ALA 23.A O no hydrogen 2.812 N/A GLN 27.A N LEU 22.A O no hydrogen 2.925 N/A GLN 27.A NE2 GLN 25.A O no hydrogen 3.199 N/A TRP 29.A NE1 GLU 31.A OE2 no hydrogen 2.694 N/A LYS 30.A N TYR 4.A O no hydrogen 2.787 N/A LYS 30.A NZ GLU 32.A OE2 no hydrogen 3.420 N/A GLU 32.A N VAL 6.A O no hydrogen 2.690 N/A VAL 34.A N TYR 8.A O no hydrogen 3.073 N/A THR 35.A OG1 THR 38.A OG1 no hydrogen 3.083 N/A THR 38.A N THR 35.A OG1 no hydrogen 3.119 N/A THR 38.A OG1 THR 35.A OG1 no hydrogen 3.083 N/A TRP 39.A N THR 35.A O no hydrogen 2.902 N/A GLN 40.A N VAL 36.A O no hydrogen 2.500 N/A GLU 41.A N THR 38.A O no hydrogen 2.939 N/A SER 43.A OG GLU 41.A OE1 no hydrogen 3.266 N/A LYS 45.A NZ GLY 51.A O no hydrogen 3.145 N/A ALA 46.A N GLY 42.A O no hydrogen 2.864 N/A SER 47.A N SER 43.A O no hydrogen 3.264 N/A SER 47.A N LEU 44.A O no hydrogen 2.699 N/A SER 47.A OG SER 43.A O no hydrogen 3.456 N/A SER 47.A OG LEU 44.A O no hydrogen 2.360 N/A CYS 48.A N LYS 45.A O no hydrogen 2.835 N/A CYS 48.A SG LEU 44.A O no hydrogen 3.659 N/A CYS 48.A SG GLN 52.A O no hydrogen 3.647 N/A GLY 51.A N CYS 48.A O no hydrogen 2.802 N/A LYS 55.A N VAL 7.A O no hydrogen 3.203 N/A PHE 56.A N LEU 63.A O no hydrogen 2.745 N/A GLN 57.A N THR 5.A O no hydrogen 2.881 N/A ASP 58.A N LEU 61.A O no hydrogen 2.765 N/A GLY 59.A N PRO 3.A O no hydrogen 2.920 N/A LEU 61.A N ASP 58.A O no hydrogen 2.944 N/A LEU 63.A N PHE 56.A O no hydrogen 2.707 N/A ASN 67.A ND2 GLU 98.A OE1 no hydrogen 2.670 N/A THR 68.A N GLN 65.A O no hydrogen 2.798 N/A ILE 69.A N GLN 65.A O no hydrogen 3.145 N/A LEU 70.A N SER 66.A O no hydrogen 3.002 N/A ARG 71.A N ASN 67.A O no hydrogen 3.090 N/A ARG 71.A NE TYR 80.A OH no hydrogen 3.252 N/A ARG 71.A NE ASP 91.A OD1 no hydrogen 2.647 N/A ARG 71.A NH2 ASP 91.A OD1 no hydrogen 2.689 N/A ARG 71.A NH2 ASP 95.A OD1 no hydrogen 3.239 N/A HIS 72.A N THR 68.A O no hydrogen 2.915 N/A HIS 72.A NE2 ASP 58.A OD2 no hydrogen 2.632 N/A LEU 73.A N ILE 69.A O no hydrogen 2.834 N/A GLY 74.A N LEU 70.A O no hydrogen 2.616 N/A ARG 75.A N ARG 71.A O no hydrogen 2.654 N/A THR 76.A N HIS 72.A O no hydrogen 2.905 N/A THR 76.A OG1 HIS 72.A O no hydrogen 2.820 N/A THR 76.A OG1 LEU 73.A O no hydrogen 3.260 N/A LEU 77.A N LEU 73.A O no hydrogen 2.826 N/A LEU 79.A N GLY 74.A O no hydrogen 2.748 N/A TYR 80.A OH ASP 91.A OD1 no hydrogen 2.613 N/A TYR 80.A OH ASP 91.A OD2 no hydrogen 3.099 N/A LYS 82.A N GLU 86.A OE1 no hydrogen 2.723 N/A LYS 82.A NZ ASP 83.A OD2 no hydrogen 2.849 N/A LYS 82.A NZ GLU 86.A OE2 no hydrogen 2.866 N/A GLU 86.A N ASP 83.A OD1 no hydrogen 2.500 N/A ALA 87.A N ASP 83.A O no hydrogen 2.955 N/A ALA 88.A N GLN 84.A O no hydrogen 3.167 N/A ALA 88.A N GLN 85.A O no hydrogen 3.165 N/A LEU 89.A N GLN 85.A O no hydrogen 3.187 N/A VAL 90.A N GLU 86.A O no hydrogen 2.914 N/A ASP 91.A N ALA 87.A O no hydrogen 3.050 N/A MET 92.A N ALA 88.A O no hydrogen 2.766 N/A VAL 93.A N LEU 89.A O no hydrogen 2.862 N/A ASN 94.A N VAL 90.A O no hydrogen 2.995 N/A ASN 94.A ND2 ASN 67.A OD1 no hydrogen 2.746 N/A ASP 95.A N ASP 91.A O no hydrogen 2.831 N/A GLY 96.A N MET 92.A O no hydrogen 3.239 N/A VAL 97.A N VAL 93.A O no hydrogen 2.918 N/A GLU 98.A N ASN 94.A O no hydrogen 2.827 N/A ASP 99.A N ASP 95.A O no hydrogen 2.923 N/A LEU 100.A N GLY 96.A O no hydrogen 3.140 N/A ARG 101.A N VAL 97.A O no hydrogen 2.808 N/A ARG 101.A NH1 ASP 157.A OD2 no hydrogen 3.286 N/A ARG 101.A NH2 ASN 154.A OD1 no hydrogen 2.953 N/A ARG 101.A NH2 ASP 157.A OD2 no hydrogen 3.043 N/A TYR 103.A N LEU 100.A O no hydrogen 2.957 N/A VAL 104.A N ARG 101.A O no hydrogen 2.970 N/A LEU 106.A N LYS 102.A O no hydrogen 3.055 N/A ILE 107.A N TYR 103.A O no hydrogen 2.876 N/A TYR 108.A N VAL 104.A O no hydrogen 2.959 N/A THR 109.A N SER 105.A O no hydrogen 2.817 N/A THR 109.A OG1 SER 105.A O no hydrogen 2.874 N/A ASN 110.A N LEU 106.A O no hydrogen 3.181 N/A TYR 111.A OH GLN 209.A O no hydrogen 2.637 N/A GLY 114.A N ASN 110.A O no hydrogen 2.756 N/A LYS 115.A N TYR 111.A O no hydrogen 2.981 N/A LYS 115.A NZ LEU 165.A O no hydrogen 3.353 N/A TYR 118.A N GLY 114.A O no hydrogen 2.928 N/A TYR 118.A OH HIS 162.A NE2 no hydrogen 2.929 N/A VAL 119.A N LYS 115.A O no hydrogen 3.023 N/A LYS 120.A N ASP 116.A O no hydrogen 3.099 N/A ALA 121.A N ASP 117.A O no hydrogen 3.180 N/A GLN 125.A N ALA 121.A O no hydrogen 3.326 N/A LEU 126.A N LEU 122.A O no hydrogen 2.934 N/A LEU 126.A N PRO 123.A O no hydrogen 3.122 N/A LYS 127.A N PRO 123.A O no hydrogen 2.940 N/A PHE 129.A N LEU 126.A O no hydrogen 3.101 N/A GLU 130.A N LEU 126.A O no hydrogen 3.415 N/A THR 131.A N LYS 127.A O no hydrogen 2.854 N/A THR 131.A OG1 LYS 127.A O no hydrogen 3.275 N/A LEU 132.A N PRO 128.A O no hydrogen 2.784 N/A LEU 133.A N PHE 129.A O no hydrogen 2.818 N/A SER 134.A N GLU 130.A O no hydrogen 2.796 N/A SER 134.A OG THR 131.A O no hydrogen 3.017 N/A GLN 135.A N THR 131.A O no hydrogen 3.166 N/A GLN 135.A N LEU 132.A O no hydrogen 3.251 N/A ASN 136.A N LEU 133.A O no hydrogen 2.982 N/A ASN 136.A ND2 PHE 142.A O no hydrogen 2.719 N/A ASN 136.A ND2 GLY 145.A O no hydrogen 2.839 N/A GLY 139.A N ASN 136.A O no hydrogen 2.975 N/A LYS 140.A N GLN 137.A O no hydrogen 2.978 N/A THR 141.A OG1 PHE 142.A O no hydrogen 3.561 N/A THR 141.A OG1 GLY 145.A O no hydrogen 2.924 N/A PHE 142.A N THR 141.A OG1 no hydrogen 2.499 N/A ILE 143.A N ASP 152.A OD1 no hydrogen 2.913 N/A SER 149.A N ASP 152.A OD2 no hydrogen 2.823 N/A SER 149.A OG ASP 152.A OD2 no hydrogen 3.355 N/A PHE 150.A N LEU 79.A O no hydrogen 2.997 N/A ASP 152.A N SER 149.A O no hydrogen 2.922 N/A TYR 153.A OH ASP 24.A OD2 no hydrogen 2.628 N/A ASN 154.A N PHE 150.A O no hydrogen 3.105 N/A ASN 154.A ND2 ASN 94.A OD1 no hydrogen 2.830 N/A LEU 155.A N ALA 151.A O no hydrogen 2.688 N/A LEU 156.A N ASP 152.A O no hydrogen 2.731 N/A ASP 157.A N TYR 153.A O no hydrogen 3.017 N/A LEU 158.A N ASN 154.A O no hydrogen 2.949 N/A LEU 159.A N LEU 155.A O no hydrogen 2.847 N/A LEU 160.A N LEU 156.A O no hydrogen 2.797 N/A ILE 161.A N ASP 157.A O no hydrogen 3.084 N/A HIS 162.A N LEU 158.A O no hydrogen 3.277 N/A HIS 162.A ND1 LEU 158.A O no hydrogen 2.776 N/A HIS 162.A NE2 TYR 118.A OH no hydrogen 2.929 N/A GLU 163.A N LEU 159.A O no hydrogen 3.039 N/A VAL 164.A N ILE 161.A O no hydrogen 3.126 N/A LEU 165.A N ILE 161.A O no hydrogen 2.984 N/A ALA 166.A N HIS 162.A O no hydrogen 2.687 N/A CYS 169.A N ALA 166.A O no hydrogen 2.862 N/A CYS 169.A SG HIS 162.A O no hydrogen 3.618 N/A ASP 171.A N GLY 168.A O no hydrogen 2.746 N/A PHE 173.A N LEU 170.A O no hydrogen 3.006 N/A LEU 175.A N GLU 130.A OE2 no hydrogen 2.860 N/A LEU 176.A N GLU 130.A OE1 no hydrogen 2.833 N/A SER 177.A N PHE 173.A O no hydrogen 2.935 N/A ALA 178.A N PRO 174.A O no hydrogen 2.942 N/A TYR 179.A N LEU 175.A O no hydrogen 2.926 N/A TYR 179.A OH ASP 152.A OD1 no hydrogen 2.299 N/A VAL 180.A N LEU 176.A O no hydrogen 3.092 N/A GLY 181.A N SER 177.A O no hydrogen 3.086 N/A ARG 182.A N ALA 178.A O no hydrogen 2.766 N/A ARG 182.A NH2 GLY 139.A O no hydrogen 2.523 N/A ARG 182.A NH2 THR 141.A O no hydrogen 2.863 N/A LEU 183.A N TYR 179.A O no hydrogen 2.827 N/A SER 184.A N VAL 180.A O no hydrogen 2.975 N/A SER 184.A OG VAL 180.A O no hydrogen 2.508 N/A ALA 185.A N GLY 181.A O no hydrogen 3.223 N/A ALA 185.A N ARG 182.A O no hydrogen 2.850 N/A ARG 186.A N LEU 183.A O no hydrogen 3.018 N/A ARG 186.A NH1 ASP 24.A OD2 no hydrogen 2.873 N/A LYS 190.A N ARG 186.A O no hydrogen 2.741 N/A LYS 190.A NZ ALA 185.A O no hydrogen 2.923 N/A ALA 191.A N PRO 187.A O no hydrogen 2.911 N/A PHE 192.A N LYS 188.A O no hydrogen 2.721 N/A LEU 193.A N LEU 189.A O no hydrogen 2.696 N/A ALA 194.A N LYS 190.A O no hydrogen 3.080 N/A SER 195.A N PHE 192.A O no hydrogen 3.111 N/A SER 195.A OG PHE 192.A O no hydrogen 2.713 N/A TYR 198.A N SER 195.A O no hydrogen 2.773 N/A VAL 199.A N SER 195.A O no hydrogen 2.757 N/A ASN 200.A N PRO 196.A O no hydrogen 2.983 N/A LEU 201.A N TYR 198.A O no hydrogen 3.268 N/A ASN 204.A ND2 TYR 103.A OH no hydrogen 2.971 N/A ASN 204.A ND2 LYS 208.A O no hydrogen 2.708 N/A GLY 205.A N TYR 108.A OH no hydrogen 2.837 N/A ASN 206.A ND2 ILE 107.A O no hydrogen 2.921 N/A LYS 208.A N ASN 206.A OD1 no hydrogen 3.128 N/A