Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4y4f_D.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 2.A N ASN 26.A OD1 no hydrogen 3.242 N/A THR 4.A N ASN 23.A O no hydrogen 2.836 N/A THR 4.A OG1 ASN 23.A O no hydrogen 3.268 N/A GLN 5.A NE2 TYR 88.A O no hydrogen 2.960 N/A SER 6.A N SER 21.A O no hydrogen 3.196 N/A ARG 8.A NE GLY 104.A O no hydrogen 3.240 N/A LYS 10.A N ARG 106.A O no hydrogen 2.861 N/A ALA 12.A N LEU 108.A O no hydrogen 2.831 N/A THR 14.A N LEU 110.A O no hydrogen 2.989 N/A THR 14.A OG1 LEU 110.A O no hydrogen 3.046 N/A THR 14.A OG1 GLU 111.A OE1 no hydrogen 3.118 N/A GLY 15.A N ALA 80.A O no hydrogen 2.935 N/A GLY 16.A N VAL 13.A O no hydrogen 3.022 N/A VAL 18.A N LEU 77.A O no hydrogen 3.032 N/A LEU 20.A N LEU 75.A O no hydrogen 2.809 N/A SER 21.A N SER 6.A O no hydrogen 2.880 N/A CYS 22.A SG THR 4.A O no hydrogen 3.701 N/A ASN 23.A N THR 4.A O no hydrogen 2.884 N/A GLN 24.A N GLU 71.A O no hydrogen 3.078 N/A GLN 24.A NE2 HIS 28.A O no hydrogen 3.329 N/A GLN 24.A NE2 GLN 70.A O no hydrogen 3.448 N/A ASN 26.A ND2 ALA 2.A O no hydrogen 2.972 N/A HIS 28.A N GLN 24.A OE1 no hydrogen 2.807 N/A HIS 28.A ND1 SER 92.A OG no hydrogen 2.966 N/A ASN 30.A N GLY 93.A O no hydrogen 3.219 N/A ASN 30.A ND2 ASP 94.A O no hydrogen 2.803 N/A MET 31.A N SER 48.A O no hydrogen 3.027 N/A TYR 32.A N ALA 91.A O no hydrogen 2.621 N/A TRP 33.A N HIS 46.A O no hydrogen 2.788 N/A TRP 33.A NE1 PHE 73.A O no hydrogen 3.225 N/A TYR 34.A N PHE 89.A O no hydrogen 2.743 N/A TYR 34.A OH GLN 99.A OE1 no hydrogen 2.769 N/A ARG 35.A N ARG 43.A O no hydrogen 3.186 N/A ARG 35.A NH1 SER 83.A O no hydrogen 3.206 N/A ARG 35.A NH2 ASP 37.A OD1 no hydrogen 3.158 N/A ARG 35.A NH2 SER 83.A O no hydrogen 3.211 N/A GLN 36.A N VAL 87.A O no hydrogen 2.706 N/A HIS 40.A N ASP 37.A O no hydrogen 2.819 N/A ARG 43.A N ARG 35.A O no hydrogen 3.263 N/A ARG 43.A NH2 ASP 37.A OD2 no hydrogen 2.799 N/A ILE 45.A N TRP 33.A O no hydrogen 2.728 N/A HIS 46.A NE2 TYR 63.A O no hydrogen 3.075 N/A TYR 47.A N GLU 55.A O no hydrogen 2.993 N/A SER 48.A N MET 31.A O no hydrogen 2.906 N/A SER 48.A OG SER 53.A O no hydrogen 2.839 N/A TYR 49.A N SER 53.A OG no hydrogen 3.208 N/A GLY 50.A N SER 48.A OG no hydrogen 3.282 N/A GLY 52.A N ARG 67.A O no hydrogen 2.964 N/A SER 53.A N GLY 50.A O no hydrogen 3.038 N/A GLU 55.A N TYR 47.A O no hydrogen 2.715 N/A GLY 57.A N ILE 45.A O no hydrogen 2.770 N/A ASP 58.A N LEU 44.A O no hydrogen 2.935 N/A ILE 59.A N LEU 44.A O no hydrogen 2.943 N/A TYR 63.A N PRO 60.A O no hydrogen 3.235 N/A TYR 63.A OH TYR 88.A OH no hydrogen 2.587 N/A LYS 64.A N ILE 76.A O no hydrogen 2.800 N/A SER 66.A N SER 74.A O no hydrogen 3.013 N/A ARG 67.A NE SER 69.A O no hydrogen 2.929 N/A ARG 67.A NH1 ASN 29.A O no hydrogen 2.706 N/A ARG 67.A NH1 SER 48.A OG no hydrogen 2.998 N/A ARG 67.A NH2 HIS 28.A O no hydrogen 3.218 N/A ARG 67.A NH2 ASN 29.A O no hydrogen 3.062 N/A ARG 67.A NH2 GLN 70.A O no hydrogen 2.904 N/A GLN 70.A NE2 ASN 27.A OD1 no hydrogen 3.313 N/A GLN 70.A NE2 ASN 29.A OD1 no hydrogen 2.955 N/A ASN 72.A N SER 69.A OG no hydrogen 3.411 N/A PHE 73.A N CYS 22.A O no hydrogen 3.150 N/A SER 74.A N SER 66.A O no hydrogen 2.836 N/A LEU 75.A N LEU 20.A O no hydrogen 2.819 N/A ILE 76.A N LYS 64.A O no hydrogen 2.645 N/A LEU 77.A N VAL 18.A O no hydrogen 2.815 N/A ALA 80.A N GLY 16.A O no hydrogen 3.142 N/A THR 81.A N GLN 84.A OE1 no hydrogen 3.218 N/A THR 81.A OG1 SER 83.A OG no hydrogen 3.285 N/A SER 83.A OG THR 81.A OG1 no hydrogen 3.285 N/A GLN 84.A N THR 81.A O no hydrogen 2.892 N/A GLN 84.A NE2 GLY 62.A O no hydrogen 2.801 N/A THR 85.A N PRO 82.A O no hydrogen 3.241 N/A THR 85.A OG1 PRO 82.A O no hydrogen 3.292 N/A SER 86.A N LEU 107.A O no hydrogen 3.205 N/A SER 86.A OG GLN 36.A O no hydrogen 2.659 N/A SER 86.A OG ASP 37.A OD1 no hydrogen 3.304 N/A SER 86.A OG VAL 87.A O no hydrogen 3.201 N/A VAL 87.A N GLN 36.A O no hydrogen 3.472 N/A TYR 88.A N THR 105.A O no hydrogen 2.668 N/A TYR 88.A OH TYR 63.A OH no hydrogen 2.587 N/A TYR 88.A OH GLN 84.A O no hydrogen 2.599 N/A PHE 89.A N TYR 34.A O no hydrogen 2.910 N/A CYS 90.A N GLN 5.A OE1 no hydrogen 3.501 N/A CYS 90.A SG TYR 32.A O no hydrogen 3.817 N/A CYS 90.A SG ALA 91.A O no hydrogen 3.991 N/A ALA 91.A N TYR 32.A O no hydrogen 2.854 N/A SER 92.A N TYR 100.A O no hydrogen 3.004 N/A SER 92.A OG HIS 28.A ND1 no hydrogen 2.966 N/A GLY 93.A N ASN 30.A O no hydrogen 2.920 N/A GLU 95.A N GLU 95.A OE1 no hydrogen 2.802 N/A GLY 96.A N ASP 94.A OD1 no hydrogen 3.004 N/A TYR 100.A N SER 92.A O no hydrogen 2.805 N/A GLY 102.A N CYS 90.A O no hydrogen 2.741 N/A GLY 104.A N GLN 5.A OE1 no hydrogen 2.815 N/A THR 105.A N TYR 88.A O no hydrogen 2.934 N/A THR 105.A OG1 PRO 7.A O no hydrogen 2.957 N/A ARG 106.A N ARG 8.A O no hydrogen 3.392 N/A LEU 107.A N SER 86.A O no hydrogen 2.902 N/A LEU 108.A N LYS 10.A O no hydrogen 3.008 N/A VAL 109.A N THR 85.A OG1 no hydrogen 3.132 N/A LEU 110.A N ALA 12.A O no hydrogen 2.837 N/A ARG 114.A NH1 ASP 181.A OD2 no hydrogen 3.290 N/A ASN 115.A ND2 ASP 181.A O no hydrogen 2.709 N/A VAL 116.A N LEU 113.A O no hydrogen 3.423 N/A THR 117.A N TYR 147.A O no hydrogen 2.932 N/A THR 117.A OG1 ASN 115.A O no hydrogen 3.290 N/A LYS 120.A N THR 144.A O no hydrogen 2.904 N/A SER 122.A N LEU 142.A O no hydrogen 2.934 N/A PHE 124.A N VAL 140.A O no hydrogen 2.688 N/A ALA 129.A N SER 127.A OG no hydrogen 3.260 N/A ILE 131.A N SER 127.A O no hydrogen 3.263 N/A SER 132.A N LYS 128.A O no hydrogen 3.211 N/A SER 132.A OG LYS 128.A O no hydrogen 3.229 N/A SER 132.A OG ALA 129.A O no hydrogen 3.062 N/A HIS 133.A N ALA 129.A O no hydrogen 3.151 N/A THR 134.A N GLU 130.A O no hydrogen 2.719 N/A THR 134.A OG1 GLU 130.A O no hydrogen 2.587 N/A GLN 135.A N ILE 131.A O no hydrogen 3.041 N/A LYS 136.A N THR 134.A OG1 no hydrogen 3.200 N/A ALA 137.A N VAL 192.A O no hydrogen 2.713 N/A THR 138.A N GLU 130.A OE1 no hydrogen 3.143 N/A THR 138.A OG1 GLU 130.A OE1 no hydrogen 3.442 N/A THR 138.A OG1 GLU 130.A OE2 no hydrogen 2.717 N/A LEU 139.A N LEU 190.A O no hydrogen 2.592 N/A VAL 140.A N PHE 124.A O no hydrogen 3.094 N/A CYS 141.A N SER 188.A O no hydrogen 2.732 N/A ALA 143.A N LEU 186.A O no hydrogen 2.898 N/A THR 144.A N LYS 120.A O no hydrogen 3.180 N/A THR 144.A OG1 LYS 120.A O no hydrogen 3.208 N/A GLY 145.A N GLU 175.A OE2 no hydrogen 3.086 N/A PHE 146.A N TYR 184.A O no hydrogen 3.438 N/A TYR 147.A N THR 117.A O no hydrogen 2.970 N/A HIS 150.A ND1 ASN 9.A OD1 no hydrogen 2.692 N/A VAL 151.A N ASP 149.A O no hydrogen 3.077 N/A GLU 152.A N GLN 209.A O no hydrogen 3.024 N/A SER 154.A N GLN 207.A O no hydrogen 2.795 N/A TRP 155.A NE1 SER 188.A OG no hydrogen 2.849 N/A TRP 156.A N ARG 205.A O no hydrogen 2.849 N/A TRP 156.A NE1 SER 154.A OG no hydrogen 2.797 N/A VAL 157.A N LYS 160.A O no hydrogen 2.850 N/A ASN 158.A N HIS 203.A O no hydrogen 2.954 N/A ASN 158.A ND2 ASN 202.A OD1 no hydrogen 3.204 N/A LYS 160.A N VAL 157.A O no hydrogen 3.193 N/A VAL 162.A N TRP 155.A O no hydrogen 2.967 N/A VAL 166.A N HIS 163.A O no hydrogen 3.190 N/A CYS 167.A N ARG 189.A O no hydrogen 3.267 N/A THR 168.A OG1 SER 188.A OG no hydrogen 3.214 N/A ASP 169.A N SER 187.A O no hydrogen 3.199 N/A LEU 173.A N SER 185.A O no hydrogen 2.947 N/A GLU 175.A N ARG 183.A O no hydrogen 2.818 N/A GLN 176.A N SER 182.A OG no hydrogen 2.838 N/A LEU 179.A N GLN 176.A O no hydrogen 2.829 N/A SER 182.A OG ARG 183.A O no hydrogen 2.985 N/A TYR 184.A N PHE 146.A O no hydrogen 2.680 N/A SER 185.A N LEU 173.A O no hydrogen 2.759 N/A SER 185.A OG GLU 175.A OE2 no hydrogen 2.861 N/A LEU 186.A N ALA 143.A O no hydrogen 2.859 N/A SER 187.A N ASP 169.A OD2 no hydrogen 2.906 N/A SER 187.A OG ASP 169.A OD1 no hydrogen 2.793 N/A SER 187.A OG ASP 169.A OD2 no hydrogen 2.780 N/A SER 188.A N CYS 141.A O no hydrogen 3.168 N/A SER 188.A OG CYS 167.A O no hydrogen 3.206 N/A SER 188.A OG THR 168.A OG1 no hydrogen 3.214 N/A ARG 189.A N CYS 167.A O no hydrogen 3.112 N/A ARG 189.A NH1 ASP 169.A OD1 no hydrogen 2.969 N/A ARG 189.A NH1 SER 187.A OG no hydrogen 2.773 N/A LEU 190.A N LEU 139.A O no hydrogen 2.796 N/A ARG 191.A N GLY 165.A O no hydrogen 2.808 N/A ARG 191.A NE GLU 130.A OE2 no hydrogen 3.215 N/A ARG 191.A NH1 GLU 130.A OE2 no hydrogen 3.107 N/A VAL 192.A N ALA 137.A O no hydrogen 2.864 N/A ALA 194.A N GLN 135.A O no hydrogen 3.215 N/A PHE 196.A N SER 193.A O no hydrogen 3.044 N/A TRP 197.A N SER 193.A O no hydrogen 3.174 N/A GLN 198.A N ALA 194.A O no hydrogen 2.862 N/A ARG 201.A N ASN 199.A OD1 no hydrogen 2.980 N/A ASN 202.A N ASN 199.A O no hydrogen 3.344 N/A ASN 202.A ND2 PHE 196.A O no hydrogen 2.898 N/A HIS 203.A N ASN 158.A OD1 no hydrogen 2.738 N/A PHE 204.A N ALA 235.A O no hydrogen 2.775 N/A ARG 205.A N TRP 156.A O no hydrogen 2.939 N/A ARG 205.A NH2 SER 232.A OG no hydrogen 2.771 N/A CYS 206.A N ALA 233.A O no hydrogen 2.814 N/A GLN 207.A N SER 154.A O no hydrogen 2.849 N/A VAL 208.A N VAL 231.A O no hydrogen 2.798 N/A GLN 209.A N GLU 152.A O no hydrogen 2.918 N/A PHE 210.A N GLN 229.A O no hydrogen 2.663 N/A TYR 211.A N HIS 150.A O no hydrogen 3.189 N/A TYR 211.A OH GLU 152.A OE1 no hydrogen 2.902 N/A GLY 212.A N THR 228.A OG1 no hydrogen 3.118 N/A LEU 213.A N PRO 226.A O no hydrogen 3.063 N/A ASN 216.A ND2 GLU 215.A O no hydrogen 2.949 N/A ASP 217.A N SER 214.A O no hydrogen 3.357 N/A TRP 219.A NE1 ARG 223.A O no hydrogen 2.926 N/A ARG 223.A NH1 VAL 116.A O no hydrogen 3.121 N/A ARG 223.A NH2 VAL 116.A O no hydrogen 2.781 N/A LYS 225.A NZ SER 214.A O no hydrogen 3.216 N/A LYS 225.A NZ ASP 217.A O no hydrogen 3.075 N/A VAL 227.A N LYS 225.A O no hydrogen 2.926 N/A THR 228.A N LEU 213.A O no hydrogen 3.151 N/A THR 228.A OG1 GLY 212.A O no hydrogen 3.250 N/A GLN 229.A N PHE 210.A O no hydrogen 2.988 N/A VAL 231.A N VAL 208.A O no hydrogen 2.834 N/A ALA 233.A N CYS 206.A O no hydrogen 2.958 N/A ALA 235.A N PHE 204.A O no hydrogen 2.744 N/A GLY 237.A N ASN 202.A O no hydrogen 3.036 N/A ARG 238.A N TRP 197.A O no hydrogen 2.978 N/A ARG 238.A NE TRP 236.A O no hydrogen 3.301 N/A ARG 238.A NH2 TRP 236.A O no hydrogen 2.780 N/A