Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ftg_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 3.A N LEU 103.A O no hydrogen 2.753 N/A SER 4.A N ASP 29.A OD1 no hydrogen 3.348 N/A MET 5.A N CYS 101.A O no hydrogen 3.123 N/A ARG 6.A N TYR 27.A O no hydrogen 2.813 N/A TYR 7.A N SER 99.A O no hydrogen 3.102 N/A PHE 8.A N VAL 25.A O no hydrogen 2.917 N/A GLU 9.A N GLN 97.A O no hydrogen 3.101 N/A THR 10.A N ILE 23.A O no hydrogen 2.828 N/A ALA 11.A N LEU 95.A O no hydrogen 2.895 N/A VAL 12.A N ARG 21.A O no hydrogen 2.975 N/A SER 13.A N HIS 93.A O no hydrogen 2.942 N/A SER 13.A OG HIS 93.A O no hydrogen 3.514 N/A ARG 14.A NH2 ASP 39.A OD1 no hydrogen 2.808 N/A ARG 21.A N VAL 12.A O no hydrogen 3.230 N/A TYR 22.A OH GLU 9.A OE1 no hydrogen 2.398 N/A ILE 23.A N THR 10.A O no hydrogen 2.957 N/A SER 24.A N PHE 36.A O no hydrogen 3.204 N/A SER 24.A OG TYR 45.A OH no hydrogen 2.462 N/A VAL 25.A N PHE 8.A O no hydrogen 2.925 N/A GLY 26.A N VAL 34.A O no hydrogen 2.761 N/A TYR 27.A N ARG 6.A O no hydrogen 2.691 N/A VAL 28.A N LYS 31.A O no hydrogen 2.723 N/A ASP 29.A N SER 4.A O no hydrogen 2.551 N/A LYS 31.A N VAL 28.A O no hydrogen 2.303 N/A LYS 31.A NZ GLU 32.A O no hydrogen 3.456 N/A PHE 33.A N GLY 26.A O no hydrogen 3.068 N/A ARG 35.A N GLU 46.A O no hydrogen 3.174 N/A PHE 36.A N SER 24.A O no hydrogen 2.941 N/A SER 38.A N TYR 22.A O no hydrogen 2.908 N/A ASP 39.A N ASP 37.A OD1 no hydrogen 2.976 N/A ARG 44.A NH2 GLU 61.A OE2 no hydrogen 2.618 N/A TYR 45.A N THR 64.A OG1 no hydrogen 3.321 N/A TYR 45.A OH SER 24.A OG no hydrogen 2.462 N/A GLU 46.A N ARG 44.A O no hydrogen 2.814 N/A ARG 48.A N PHE 33.A O no hydrogen 2.798 N/A MET 52.A N ALA 49.A O no hydrogen 3.268 N/A GLU 53.A N PRO 50.A O no hydrogen 3.161 N/A GLU 55.A N MET 52.A O no hydrogen 3.395 N/A TYR 59.A N GLY 56.A O no hydrogen 2.724 N/A TYR 59.A OH TYR 171.A OH no hydrogen 3.338 N/A ARG 62.A NH2 GLU 58.A OE2 no hydrogen 3.267 N/A GLU 63.A N TYR 59.A O no hydrogen 3.163 N/A THR 64.A N TRP 60.A O no hydrogen 2.730 N/A THR 64.A OG1 TRP 60.A O no hydrogen 2.776 N/A GLN 65.A N GLU 61.A O no hydrogen 2.882 N/A LYS 66.A N ARG 62.A O no hydrogen 2.945 N/A LYS 66.A NZ GLU 63.A OE2 no hydrogen 2.609 N/A ALA 67.A N GLU 63.A O no hydrogen 2.926 N/A LYS 68.A N THR 64.A O no hydrogen 3.244 N/A LYS 68.A N GLN 65.A O no hydrogen 2.944 N/A LYS 68.A NZ PRO 43.A O no hydrogen 3.555 N/A GLY 69.A N GLN 65.A O no hydrogen 3.300 N/A GLN 70.A N LYS 66.A O no hydrogen 3.147 N/A GLN 70.A NE2 GLU 9.A OE1 no hydrogen 2.576 N/A GLU 71.A N ALA 67.A O no hydrogen 3.348 N/A GLN 72.A N LYS 68.A O no hydrogen 3.418 N/A TRP 73.A N GLY 69.A O no hydrogen 2.927 N/A PHE 74.A N GLN 70.A O no hydrogen 2.676 N/A ARG 75.A N GLU 71.A O no hydrogen 2.877 N/A ARG 75.A NH1 GLU 19.A OE2 no hydrogen 3.364 N/A ARG 75.A NH1 GLN 72.A OE1 no hydrogen 3.202 N/A VAL 76.A N GLN 72.A O no hydrogen 3.195 N/A SER 77.A N TRP 73.A O no hydrogen 3.031 N/A SER 77.A OG TRP 73.A O no hydrogen 2.929 N/A LEU 78.A N PHE 74.A O no hydrogen 2.862 N/A ARG 79.A N.A ARG 75.A O no hydrogen 3.130 N/A ARG 79.A N.A VAL 76.A O no hydrogen 2.862 N/A ARG 79.A N.B ARG 75.A O no hydrogen 3.092 N/A ARG 79.A N.B VAL 76.A O no hydrogen 2.890 N/A ARG 79.A NH2.B GLU 18.A OE1 no hydrogen 2.862 N/A ASN 80.A N VAL 76.A O no hydrogen 2.946 N/A LEU 81.A N SER 77.A O no hydrogen 3.014 N/A LEU 82.A N ARG 79.A O.B no hydrogen 2.699 N/A TYR 84.A N ASN 80.A O no hydrogen 3.195 N/A TYR 85.A N LEU 81.A O no hydrogen 3.110 N/A TYR 85.A OH ASP 137.A OD1 no hydrogen 2.659 N/A TYR 85.A OH ASP 137.A OD2 no hydrogen 3.228 N/A ASN 86.A N GLY 83.A O no hydrogen 3.056 N/A GLN 87.A N LEU 82.A O no hydrogen 2.923 N/A GLN 87.A NE2 TYR 118.A OH no hydrogen 2.314 N/A SER 92.A OG SER 13.A O no hydrogen 2.477 N/A HIS 93.A N SER 13.A OG no hydrogen 3.238 N/A HIS 93.A ND1 GLU 119.A OE2 no hydrogen 2.759 N/A THR 94.A N.A GLU 119.A OE1 no hydrogen 3.210 N/A THR 94.A N.B GLU 119.A OE1 no hydrogen 3.191 N/A LEU 95.A N ALA 11.A O no hydrogen 2.957 N/A GLN 96.A N ALA 117.A O no hydrogen 2.906 N/A GLN 97.A N GLU 9.A O no hydrogen 2.888 N/A MET 98.A N GLN 115.A O no hydrogen 2.883 N/A SER 99.A N TYR 7.A O no hydrogen 3.441 N/A GLY 100.A N TYR 113.A O no hydrogen 3.059 N/A CYS 101.A N MET 5.A O no hydrogen 3.022 N/A ASP 102.A N ARG 111.A O no hydrogen 2.889 N/A LEU 103.A N HIS 3.A O no hydrogen 2.556 N/A GLY 104.A N ARG 108.A O.A no hydrogen 3.224 N/A GLY 104.A N ARG 108.A O.B no hydrogen 3.237 N/A TRP 107.A N GLY 104.A O no hydrogen 2.596 N/A ARG 108.A N.A ASP 106.A OD2 no hydrogen 3.166 N/A ARG 108.A N.B ASP 106.A OD2 no hydrogen 3.166 N/A ARG 108.A NE.A ASP 106.A OD1 no hydrogen 3.516 N/A LEU 110.A N ASP 102.A O no hydrogen 2.788 N/A TYR 113.A N GLY 100.A O no hydrogen 2.784 N/A TYR 113.A OH ASP 102.A OD2 no hydrogen 2.547 N/A GLN 115.A N MET 98.A O no hydrogen 2.818 N/A PHE 116.A N ILE 124.A O no hydrogen 2.904 N/A ALA 117.A N GLN 96.A O no hydrogen 2.974 N/A TYR 118.A N ARG 121.A O.A no hydrogen 2.851 N/A TYR 118.A N ARG 121.A O.B no hydrogen 2.839 N/A TYR 118.A N ARG 121.A O.C no hydrogen 2.961 N/A GLU 119.A N THR 94.A O.A no hydrogen 2.770 N/A GLU 119.A N THR 94.A O.B no hydrogen 2.938 N/A ARG 121.A N.A TYR 118.A O no hydrogen 2.854 N/A ARG 121.A N.B TYR 118.A O no hydrogen 2.856 N/A ARG 121.A N.C TYR 118.A O no hydrogen 2.878 N/A TYR 123.A N PHE 116.A O no hydrogen 2.801 N/A TYR 123.A OH THR 143.A OG1 no hydrogen 2.553 N/A ILE 124.A N PHE 116.A O no hydrogen 3.398 N/A ALA 125.A N THR 134.A O no hydrogen 3.202 N/A LEU 126.A N LEU 114.A O no hydrogen 2.838 N/A ASN 127.A N THR 132.A O no hydrogen 2.762 N/A ASN 127.A ND2 THR 132.A OG1 no hydrogen 3.169 N/A LEU 130.A N ASN 127.A O no hydrogen 2.857 N/A LYS 131.A N ASP 129.A OD1 no hydrogen 2.626 N/A THR 132.A OG1 ASP 129.A OD1 no hydrogen 3.155 N/A THR 132.A OG1 ASP 129.A OD2 no hydrogen 2.800 N/A THR 134.A N ALA 125.A O no hydrogen 3.101 N/A THR 134.A OG1 ASN 127.A OD1 no hydrogen 2.749 N/A ALA 136.A N TYR 123.A O no hydrogen 2.962 N/A ALA 140.A N ASP 137.A OD2 no hydrogen 2.967 N/A GLN 141.A N ASP 137.A O no hydrogen 3.285 N/A GLN 141.A N MET 138.A O no hydrogen 3.265 N/A GLN 141.A NE2 ALA 135.A O no hydrogen 3.671 N/A GLN 141.A NE2 ASP 137.A O no hydrogen 3.221 N/A ILE 142.A N ALA 139.A O no hydrogen 2.921 N/A THR 143.A OG1 TYR 123.A OH no hydrogen 2.553 N/A ARG 144.A N.A ALA 140.A O no hydrogen 2.759 N/A ARG 144.A N.B ALA 140.A O no hydrogen 2.743 N/A ARG 144.A NE.A TRP 133.A O no hydrogen 3.002 N/A ARG 145.A N GLN 141.A O no hydrogen 2.867 N/A LYS 146.A N ILE 142.A O no hydrogen 2.883 N/A TRP 147.A N THR 143.A O no hydrogen 2.879 N/A TRP 147.A N ARG 144.A O.A no hydrogen 2.748 N/A TRP 147.A N ARG 144.A O.B no hydrogen 2.754 N/A GLU 148.A N ARG 144.A O.A no hydrogen 2.741 N/A GLU 148.A N ARG 144.A O.B no hydrogen 2.777 N/A GLN 149.A N ARG 145.A O no hydrogen 2.948 N/A GLN 149.A NE2 ARG 145.A O no hydrogen 3.529 N/A SER 150.A N GLU 148.A O no hydrogen 2.478 N/A GLY 151.A N GLU 148.A O no hydrogen 3.048 N/A ALA 152.A N TRP 147.A O no hydrogen 3.286 N/A GLU 154.A N GLU 154.A OE1 no hydrogen 2.635 N/A TYR 156.A N ALA 152.A O no hydrogen 3.083 N/A LYS 157.A N ALA 153.A O no hydrogen 2.729 N/A LYS 157.A NZ GLU 161.A OE1 no hydrogen 2.720 N/A LYS 157.A NZ GLU 161.A OE2 no hydrogen 2.913 N/A ALA 158.A N GLU 154.A O no hydrogen 2.687 N/A TYR 159.A N HIS 155.A O no hydrogen 2.974 N/A LEU 160.A N TYR 156.A O no hydrogen 2.604 N/A GLU 161.A N LYS 157.A O no hydrogen 2.765 N/A GLY 162.A N ALA 158.A O no hydrogen 3.326 N/A GLU 163.A N.B GLU 163.A OE1.B no hydrogen 2.557 N/A CYS 164.A N TYR 159.A O no hydrogen 2.911 N/A GLU 166.A N GLY 162.A O no hydrogen 2.920 N/A TRP 167.A N GLU 163.A O.A no hydrogen 2.877 N/A TRP 167.A N GLU 163.A O.B no hydrogen 2.991 N/A LEU 168.A N CYS 164.A O no hydrogen 3.222 N/A HIS 169.A N VAL 165.A O no hydrogen 2.786 N/A HIS 169.A NE2 TRP 107.A O no hydrogen 2.431 N/A ARG 170.A N TRP 167.A O no hydrogen 3.011 N/A ARG 170.A NH2 GLU 55.A OE1 no hydrogen 3.355 N/A ARG 170.A NH2 GLU 55.A OE2 no hydrogen 3.550 N/A TYR 171.A N TRP 167.A O no hydrogen 2.820 N/A TYR 171.A OH TYR 59.A OH no hydrogen 3.338 N/A LEU 172.A N LEU 168.A O no hydrogen 3.032 N/A ASN 174.A N TYR 171.A O no hydrogen 3.181 N/A LEU 179.A N ASN 176.A O.A no hydrogen 3.243 N/A LYS 186.A N LEU 195.A O no hydrogen 2.792 N/A HIS 188.A N TRP 193.A O no hydrogen 3.267 N/A CYS 192.A N ALA 225.A O no hydrogen 2.700 N/A TRP 193.A N HIS 188.A O no hydrogen 2.936 N/A ALA 194.A N LYS 223.A O no hydrogen 2.899 N/A LEU 195.A N LYS 186.A O no hydrogen 3.275 N/A GLY 196.A N PHE 221.A O no hydrogen 3.316 N/A TYR 198.A N ASP 183.A O no hydrogen 2.915 N/A TYR 198.A OH ASP 29.A O no hydrogen 2.925 N/A THR 203.A N TYR 234.A O no hydrogen 3.091 N/A THR 205.A N ARG 232.A O no hydrogen 3.057 N/A TRP 206.A NE1 ALA 225.A O no hydrogen 3.091 N/A GLN 207.A N THR 230.A O no hydrogen 3.031 N/A VAL 211.A N TRP 224.A O no hydrogen 3.409 N/A ARG 214.A N GLN 222.A O no hydrogen 3.210 N/A ARG 214.A NE GLN 222.A OE1 no hydrogen 2.786 N/A ARG 214.A NH2 GLN 222.A OE1 no hydrogen 2.484 N/A ALA 216.A N THR 220.A O no hydrogen 2.925 N/A THR 220.A N ASP 218.A OD1 no hydrogen 2.772 N/A THR 220.A OG1 ASP 218.A OD1 no hydrogen 2.720 N/A THR 220.A OG1 ASP 218.A OD2 no hydrogen 3.270 N/A PHE 221.A N PHE 197.A O no hydrogen 2.996 N/A GLN 222.A N ARG 214.A O no hydrogen 3.195 N/A LYS 223.A N ALA 194.A O no hydrogen 3.177 N/A LYS 223.A NZ VAL 211.A O no hydrogen 3.038 N/A LYS 223.A NZ THR 213.A OG1 no hydrogen 3.165 N/A ALA 225.A N CYS 192.A O no hydrogen 3.192 N/A SER 226.A N GLU 209.A OE2 no hydrogen 2.586 N/A THR 230.A N GLN 207.A O no hydrogen 3.140 N/A CYS 231.A N LEU 244.A O no hydrogen 3.064 N/A ARG 232.A N THR 205.A O no hydrogen 3.048 N/A VAL 233.A N LEU 242.A O no hydrogen 2.975 N/A TYR 234.A N THR 203.A O no hydrogen 2.857 N/A HIS 235.A ND1 ASP 201.A O no hydrogen 3.072 N/A LEU 238.A N HIS 235.A O no hydrogen 3.096 N/A LEU 242.A N VAL 233.A O no hydrogen 3.115 N/A LEU 244.A N CYS 231.A O no hydrogen 3.130 N/A ARG 245.A NE TRP 246.A O no hydrogen 3.111 N/A ARG 245.A NH2 TRP 246.A O no hydrogen 2.581 N/A