Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4wdi_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 4.A N VAL 104.A O no hydrogen 3.032 N/A HIS 4.A ND1 ASP 30.A OD2 no hydrogen 3.328 N/A SER 5.A N ASP 30.A OD1 no hydrogen 2.809 N/A LEU 6.A N CYS 102.A O no hydrogen 2.946 N/A ARG 7.A N TYR 28.A O no hydrogen 3.115 N/A ARG 7.A NH1 ASP 103.A OD2 no hydrogen 2.786 N/A ARG 7.A NH2 ASP 103.A OD1 no hydrogen 2.492 N/A TYR 8.A N PHE 100.A O no hydrogen 2.998 N/A PHE 9.A N VAL 26.A O no hydrogen 3.013 N/A VAL 10.A N ARG 98.A O no hydrogen 2.899 N/A THR 11.A N ILE 24.A O no hydrogen 2.810 N/A ALA 12.A N PHE 96.A O no hydrogen 2.879 N/A VAL 13.A N ARG 22.A O no hydrogen 2.769 N/A SER 14.A N HIS 94.A O no hydrogen 3.070 N/A ARG 15.A NE GLU 20.A O no hydrogen 2.394 N/A ARG 15.A NH1 ASP 40.A OD1 no hydrogen 2.928 N/A ARG 15.A NH1 ASP 40.A OD2 no hydrogen 3.489 N/A ARG 15.A NH2 ASP 40.A OD1 no hydrogen 2.840 N/A ARG 22.A N VAL 13.A O no hydrogen 2.926 N/A ARG 22.A NE ASP 38.A OD1 no hydrogen 3.379 N/A ARG 22.A NH2 ASP 38.A OD1 no hydrogen 3.304 N/A ARG 22.A NH2 ASP 38.A OD2 no hydrogen 3.061 N/A PHE 23.A N SER 39.A OG no hydrogen 3.039 N/A ILE 24.A N THR 11.A O no hydrogen 2.814 N/A ALA 25.A N PHE 37.A O no hydrogen 2.844 N/A VAL 26.A N PHE 9.A O no hydrogen 3.159 N/A GLY 27.A N VAL 35.A O no hydrogen 2.884 N/A TYR 28.A N ARG 7.A O no hydrogen 2.907 N/A VAL 29.A N THR 32.A O no hydrogen 2.744 N/A ASP 30.A N SER 5.A O no hydrogen 2.893 N/A THR 32.A N VAL 29.A O no hydrogen 3.043 N/A THR 32.A OG1 TYR 210.A OH no hydrogen 2.830 N/A GLN 33.A NE2 VAL 35.A O no hydrogen 3.329 N/A PHE 34.A N GLY 27.A O no hydrogen 2.847 N/A VAL 35.A N GLY 27.A O no hydrogen 3.501 N/A ARG 36.A N GLU 47.A O no hydrogen 2.762 N/A ARG 36.A NE GLU 47.A OE2 no hydrogen 2.654 N/A ARG 36.A NH2 GLU 47.A OE2 no hydrogen 3.292 N/A PHE 37.A N ALA 25.A O no hydrogen 2.624 N/A SER 39.A N PHE 23.A O no hydrogen 3.028 N/A SER 39.A OG PHE 23.A O no hydrogen 3.454 N/A ASP 40.A N ASP 38.A OD1 no hydrogen 3.365 N/A ALA 41.A N ASP 38.A O no hydrogen 3.327 N/A PHE 46.A N THR 65.A OG1 no hydrogen 3.420 N/A GLU 47.A N ARG 36.A O no hydrogen 2.477 N/A ARG 49.A N PHE 34.A O no hydrogen 2.959 N/A MET 53.A N ALA 50.A O no hydrogen 2.741 N/A GLU 54.A N PRO 51.A O no hydrogen 2.909 N/A GLN 55.A N TRP 52.A O no hydrogen 3.469 N/A GLN 55.A NE2 TRP 52.A O no hydrogen 3.343 N/A GLN 55.A NE2 LEU 175.A O no hydrogen 2.922 N/A GLU 56.A N MET 53.A O no hydrogen 2.948 N/A TYR 60.A OH TYR 172.A OH no hydrogen 2.449 N/A TRP 61.A NE1 GLU 56.A O no hydrogen 2.981 N/A GLU 62.A N PRO 58.A O no hydrogen 2.974 N/A GLU 63.A N GLU 59.A O no hydrogen 2.598 N/A GLN 64.A N TYR 60.A O no hydrogen 2.651 N/A THR 65.A N TRP 61.A O no hydrogen 2.775 N/A THR 65.A OG1 TRP 61.A O no hydrogen 2.343 N/A GLN 66.A N GLU 62.A O no hydrogen 2.986 N/A GLN 66.A NE2 GLU 62.A O no hydrogen 3.632 N/A ARG 67.A N GLU 63.A O no hydrogen 3.135 N/A ALA 68.A N GLN 64.A O no hydrogen 2.923 N/A LYS 69.A N GLN 66.A O no hydrogen 2.854 N/A SER 70.A N GLN 66.A O no hydrogen 3.261 N/A SER 70.A OG GLN 66.A O no hydrogen 3.433 N/A GLN 73.A N LYS 69.A O no hydrogen 3.307 N/A TRP 74.A N SER 70.A O no hydrogen 2.816 N/A PHE 75.A N ASP 71.A O no hydrogen 2.743 N/A ARG 76.A N GLU 72.A O no hydrogen 2.843 N/A VAL 77.A N GLN 73.A O no hydrogen 3.035 N/A SER 78.A N TRP 74.A O no hydrogen 2.741 N/A SER 78.A OG TRP 74.A O no hydrogen 3.418 N/A LEU 79.A N PHE 75.A O no hydrogen 3.061 N/A ARG 80.A N ARG 76.A O no hydrogen 3.380 N/A THR 81.A N VAL 77.A O no hydrogen 2.828 N/A THR 81.A OG1 VAL 77.A O no hydrogen 3.090 N/A ALA 82.A N SER 78.A O no hydrogen 2.967 N/A GLN 83.A N LEU 79.A O no hydrogen 2.979 N/A GLN 83.A NE2 ARG 80.A O no hydrogen 2.934 N/A ARG 84.A N ARG 80.A O no hydrogen 3.118 N/A TYR 85.A N THR 81.A O no hydrogen 3.194 N/A TYR 86.A N ALA 82.A O no hydrogen 3.239 N/A TYR 86.A OH ASP 138.A OD2 no hydrogen 2.747 N/A ASN 87.A N ARG 84.A O no hydrogen 2.878 N/A GLN 88.A N GLN 83.A O no hydrogen 2.974 N/A SER 93.A OG SER 14.A O no hydrogen 2.776 N/A HIS 94.A N SER 14.A OG no hydrogen 3.079 N/A HIS 94.A ND1 ASP 120.A OD1 no hydrogen 3.208 N/A HIS 94.A ND1 ASP 120.A OD2 no hydrogen 2.630 N/A THR 95.A N ASP 120.A OD1 no hydrogen 3.082 N/A PHE 96.A N ALA 12.A O no hydrogen 3.013 N/A GLN 97.A N ALA 118.A O no hydrogen 2.755 N/A ARG 98.A N VAL 10.A O no hydrogen 2.989 N/A MET 99.A N GLN 116.A O no hydrogen 2.998 N/A PHE 100.A N TYR 8.A O no hydrogen 3.237 N/A GLY 101.A N TYR 114.A O no hydrogen 2.956 N/A CYS 102.A N LEU 6.A O no hydrogen 2.925 N/A ASP 103.A N ARG 112.A O no hydrogen 3.025 N/A VAL 104.A N HIS 4.A O no hydrogen 3.002 N/A GLY 105.A N ARG 109.A O no hydrogen 2.793 N/A TRP 108.A N GLY 105.A O no hydrogen 2.949 N/A ARG 109.A N ASP 107.A OD1 no hydrogen 3.294 N/A LEU 111.A N ASP 103.A O no hydrogen 2.735 N/A ARG 112.A N ASP 103.A O no hydrogen 3.283 N/A ARG 112.A NH1 GLY 113.A O no hydrogen 2.650 N/A TYR 114.A N GLY 101.A O no hydrogen 2.866 N/A TYR 114.A OH ASP 103.A OD2 no hydrogen 3.386 N/A GLN 116.A N MET 99.A O no hydrogen 2.970 N/A PHE 117.A N ILE 125.A O no hydrogen 2.897 N/A ALA 118.A N GLN 97.A O no hydrogen 3.044 N/A TYR 119.A N ARG 122.A O no hydrogen 2.843 N/A TYR 119.A OH GLN 88.A OE1 no hydrogen 2.985 N/A ASP 120.A N THR 95.A O no hydrogen 2.603 N/A ARG 122.A N TYR 119.A O no hydrogen 3.118 N/A TYR 124.A N PHE 117.A O no hydrogen 2.992 N/A TYR 124.A OH THR 144.A OG1 no hydrogen 2.594 N/A ALA 126.A N THR 135.A O no hydrogen 2.731 N/A LEU 127.A N HIS 115.A O no hydrogen 2.820 N/A ASN 128.A N THR 133.A O no hydrogen 2.780 N/A ASN 128.A ND2 THR 133.A OG1 no hydrogen 3.244 N/A LEU 131.A N ASN 128.A O no hydrogen 2.876 N/A LYS 132.A N ASP 130.A OD1 no hydrogen 2.866 N/A THR 133.A N ASP 130.A OD1 no hydrogen 3.014 N/A THR 133.A OG1 ASP 130.A OD1 no hydrogen 3.111 N/A THR 133.A OG1 ASP 130.A OD2 no hydrogen 2.240 N/A THR 135.A N ALA 126.A O no hydrogen 2.675 N/A THR 135.A OG1 ASN 128.A OD1 no hydrogen 2.395 N/A ALA 137.A N TYR 124.A O no hydrogen 2.839 N/A ALA 141.A N ASP 138.A OD1 no hydrogen 2.757 N/A LEU 142.A N THR 139.A O no hydrogen 2.950 N/A ILE 143.A N ALA 140.A O no hydrogen 3.042 N/A THR 144.A OG1 TYR 124.A OH no hydrogen 2.594 N/A ARG 145.A N ALA 141.A O no hydrogen 2.832 N/A ARG 146.A N LEU 142.A O no hydrogen 2.948 N/A LYS 147.A N ILE 143.A O no hydrogen 3.286 N/A LYS 147.A NZ TYR 85.A OH no hydrogen 3.365 N/A TRP 148.A N THR 144.A O no hydrogen 3.149 N/A GLU 149.A N ARG 145.A O no hydrogen 3.013 N/A GLN 150.A N ARG 146.A O no hydrogen 3.047 N/A ALA 151.A N LYS 147.A O no hydrogen 2.788 N/A GLY 152.A N TRP 148.A O no hydrogen 2.835 N/A ASP 153.A N TRP 148.A O no hydrogen 3.060 N/A GLU 155.A N GLY 152.A O no hydrogen 3.368 N/A TYR 157.A N ASP 153.A O no hydrogen 2.921 N/A ARG 158.A N ALA 154.A O no hydrogen 2.935 N/A ALA 159.A N GLU 155.A O no hydrogen 3.279 N/A LEU 161.A N TYR 157.A O no hydrogen 2.825 N/A GLU 162.A N ARG 158.A O no hydrogen 2.724 N/A GLY 163.A N TYR 160.A O no hydrogen 3.181 N/A CYS 165.A N TYR 160.A O no hydrogen 3.014 N/A GLU 167.A N.A GLY 163.A O no hydrogen 2.866 N/A GLU 167.A N.B GLY 163.A O no hydrogen 2.873 N/A TRP 168.A N GLU 164.A O no hydrogen 2.632 N/A LEU 169.A N CYS 165.A O no hydrogen 2.821 N/A ARG 170.A N VAL 166.A O no hydrogen 3.158 N/A ARG 171.A N GLU 167.A O.A no hydrogen 3.358 N/A ARG 171.A N GLU 167.A O.B no hydrogen 3.278 N/A ARG 171.A NH2 GLU 56.A OE1 no hydrogen 3.244 N/A ARG 171.A NH2 GLU 56.A OE2 no hydrogen 3.299 N/A TYR 172.A N TRP 168.A O no hydrogen 2.953 N/A TYR 172.A OH TYR 60.A OH no hydrogen 2.449 N/A LEU 173.A N LEU 169.A O no hydrogen 3.021 N/A GLU 174.A N ARG 170.A O no hydrogen 3.232 N/A LEU 175.A N ARG 171.A O no hydrogen 3.105 N/A GLY 176.A N TYR 172.A O no hydrogen 2.918 N/A THR 179.A OG1 GLY 176.A O no hydrogen 3.266 N/A LEU 180.A N GLY 176.A O no hydrogen 2.913 N/A LEU 181.A N ASN 177.A O no hydrogen 2.984 N/A ARG 182.A N THR 179.A O no hydrogen 3.282 N/A ARG 182.A NE ASP 184.A OD2 no hydrogen 2.566 N/A ARG 182.A NH1 THR 179.A O no hydrogen 2.761 N/A ASP 184.A N TYR 210.A O no hydrogen 2.769 N/A SER 185.A OG GLY 266.A O no hydrogen 3.092 N/A LYS 187.A N LEU 207.A O no hydrogen 2.876 N/A HIS 189.A N TRP 205.A O no hydrogen 3.122 N/A THR 191.A N ARG 203.A O no hydrogen 2.722 N/A THR 191.A OG1 HIS 193.A NE2 no hydrogen 2.622 N/A THR 191.A OG1 ARG 203.A O no hydrogen 3.485 N/A HIS 193.A N THR 201.A O no hydrogen 2.724 N/A HIS 193.A NE2 THR 191.A OG1 no hydrogen 2.622 N/A SER 196.A N ASP 199.A O no hydrogen 3.408 N/A VAL 198.A N SER 196.A OG no hydrogen 3.082 N/A ASP 199.A N SER 196.A OG no hydrogen 3.069 N/A VAL 200.A N VAL 250.A O no hydrogen 2.931 N/A THR 201.A N HIS 193.A O no hydrogen 2.837 N/A LEU 202.A N VAL 248.A O no hydrogen 2.902 N/A ARG 203.A N THR 191.A O no hydrogen 2.883 N/A CYS 204.A N ALA 246.A O no hydrogen 2.793 N/A TRP 205.A N HIS 189.A O no hydrogen 2.863 N/A TRP 205.A NE1 THR 191.A OG1 no hydrogen 2.890 N/A ALA 206.A N LYS 244.A O no hydrogen 2.949 N/A LEU 207.A N LYS 187.A O no hydrogen 2.836 N/A GLY 208.A N PHE 242.A O no hydrogen 2.804 N/A PHE 209.A N PHE 242.A O no hydrogen 3.245 N/A TYR 210.A N ASP 184.A O no hydrogen 3.060 N/A TYR 210.A OH THR 32.A OG1 no hydrogen 2.830 N/A ALA 212.A N ASP 31.A OD2 no hydrogen 2.798 N/A THR 215.A N HIS 263.A O no hydrogen 3.124 N/A THR 217.A N HIS 261.A O no hydrogen 2.922 N/A TRP 218.A NE1 ALA 246.A O no hydrogen 2.719 N/A GLN 219.A N THR 259.A O no hydrogen 2.770 N/A LEU 220.A N GLU 223.A O no hydrogen 2.777 N/A ASN 221.A N ASN 257.A O no hydrogen 3.208 N/A GLU 223.A N LEU 220.A O no hydrogen 3.062 N/A LEU 225.A N TRP 218.A O no hydrogen 3.216 N/A THR 226.A N GLN 227.A OE1 no hydrogen 2.933 N/A GLU 230.A N ALA 247.A O no hydrogen 2.830 N/A VAL 232.A N TRP 245.A O no hydrogen 3.246 N/A ARG 235.A N GLN 243.A O no hydrogen 2.826 N/A ARG 235.A NE GLN 243.A OE1 no hydrogen 2.876 N/A ARG 235.A NH2 GLN 243.A OE1 no hydrogen 3.500 N/A ALA 237.A N THR 241.A O no hydrogen 2.722 N/A THR 241.A N ASP 239.A OD1 no hydrogen 3.022 N/A THR 241.A OG1 ASP 239.A OD1 no hydrogen 2.528 N/A PHE 242.A N PHE 209.A O no hydrogen 2.758 N/A GLN 243.A N ARG 235.A O no hydrogen 2.836 N/A LYS 244.A N ALA 206.A O no hydrogen 3.132 N/A LYS 244.A NZ VAL 232.A O no hydrogen 2.901 N/A LYS 244.A NZ THR 234.A OG1 no hydrogen 3.259 N/A ALA 246.A N CYS 204.A O no hydrogen 2.902 N/A ALA 247.A N GLU 230.A O no hydrogen 2.747 N/A VAL 248.A N LEU 202.A O no hydrogen 2.913 N/A VAL 250.A N VAL 200.A O no hydrogen 2.860 N/A LEU 252.A N VAL 198.A O no hydrogen 3.065 N/A GLY 253.A N GLU 255.A OE2 no hydrogen 2.832 N/A LYS 254.A N PRO 251.A O no hydrogen 2.976 N/A GLU 255.A N GLU 255.A OE1 no hydrogen 2.754 N/A ASN 257.A N LYS 254.A O no hydrogen 3.196 N/A TYR 258.A N GLU 255.A O no hydrogen 3.227 N/A THR 259.A N GLN 219.A O no hydrogen 3.063 N/A THR 259.A OG1 GLN 219.A O no hydrogen 3.331 N/A THR 259.A OG1 HIS 261.A NE2 no hydrogen 2.878 N/A CYS 260.A N LEU 273.A O no hydrogen 2.977 N/A CYS 260.A SG THR 217.A O no hydrogen 3.802 N/A HIS 261.A N THR 217.A O no hydrogen 2.637 N/A HIS 261.A NE2 THR 259.A OG1 no hydrogen 2.878 N/A VAL 262.A N LEU 271.A O no hydrogen 2.758 N/A HIS 263.A N THR 215.A O no hydrogen 3.022 N/A HIS 263.A ND1 THR 215.A O no hydrogen 2.786 N/A LEU 267.A N HIS 264.A O no hydrogen 3.224 N/A LEU 271.A N VAL 262.A O no hydrogen 2.831 N/A LEU 273.A N CYS 260.A O no hydrogen 2.799 N/A ARG 274.A NE GLN 256.A O no hydrogen 3.151 N/A