Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8pw5_O1.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A NH1 ARG 2.A O no hydrogen 3.339 N/A TYR 3.A OH HIS 257.A ND1 no hydrogen 2.883 N/A ALA 8.A N GLY 4.A O no hydrogen 2.918 N/A ILE 9.A N LEU 5.A O no hydrogen 2.918 N/A LEU 10.A N LEU 6.A O no hydrogen 2.956 N/A GLY 11.A N ALA 7.A O no hydrogen 2.897 N/A THR 14.A OG1 LEU 116.A O no hydrogen 3.485 N/A THR 15.A N ASP 253.A OD1 no hydrogen 3.263 N/A THR 15.A OG1 ASP 253.A OD1 no hydrogen 3.397 N/A LYS 17.A N LYS 13.A O no hydrogen 2.991 N/A LYS 17.A NZ ASP 12.A OD1 no hydrogen 2.596 N/A LYS 17.A NZ SER 117.A O no hydrogen 2.749 N/A HIS 19.A N SER 22.A OG no hydrogen 3.327 N/A TYR 21.A N HIS 19.A ND1 no hydrogen 3.108 N/A SER 22.A OG GLY 119.A O no hydrogen 2.304 N/A ARG 23.A NE GLU 20.A O no hydrogen 3.573 N/A ARG 23.A NH1 HIS 167.A NE2 no hydrogen 3.228 N/A VAL 24.A N HIS 167.A ND1 no hydrogen 3.207 N/A ILE 25.A N VAL 122.A O no hydrogen 2.931 N/A THR 26.A N ALA 168.A O no hydrogen 2.923 N/A VAL 27.A N LEU 124.A O no hydrogen 2.907 N/A ASP 28.A N ILE 170.A O no hydrogen 2.903 N/A ASN 30.A N SER 33.A OG no hydrogen 2.935 N/A ILE 31.A N ASN 30.A OD1 no hydrogen 2.857 N/A SER 33.A OG SER 33.A O no hydrogen 2.579 N/A LYS 35.A NZ GLU 53.A OE1 no hydrogen 2.439 N/A LYS 40.A NZ ASN 36.A O no hydrogen 3.123 N/A GLU 41.A N LYS 37.A O no hydrogen 2.920 N/A ILE 42.A N LEU 38.A O no hydrogen 2.922 N/A ALA 43.A N ALA 39.A O no hydrogen 2.932 N/A GLN 44.A N LYS 40.A O no hydrogen 2.884 N/A GLN 45.A N GLU 41.A O no hydrogen 2.960 N/A MET 48.A N ALA 43.A O no hydrogen 2.989 N/A LYS 49.A N GLY 121.A O no hydrogen 2.925 N/A HIS 50.A NE2 GLU 125.A OE2 no hydrogen 2.426 N/A TYR 51.A N VAL 123.A O no hydrogen 2.882 N/A TYR 58.A OH ASP 110.A OD2 no hydrogen 2.948 N/A THR 61.A N GLN 57.A O no hydrogen 2.919 N/A THR 61.A OG1 GLN 57.A O no hydrogen 2.823 N/A THR 61.A OG1 TYR 58.A O no hydrogen 2.725 N/A THR 62.A N TYR 58.A O no hydrogen 2.919 N/A THR 63.A OG1 SER 59.A O no hydrogen 2.394 N/A ARG 67.A NH1 ASP 65.A OD2 no hydrogen 2.938 N/A SER 74.A N ASP 70.A O no hydrogen 2.910 N/A SER 74.A OG GLN 57.A OE1 no hydrogen 2.340 N/A SER 74.A OG ASP 70.A O no hydrogen 3.132 N/A SER 76.A N ILE 71.A O no hydrogen 2.529 N/A SER 76.A OG GLY 75.A O no hydrogen 2.651 N/A SER 78.A N ASN 92.A OD1 no hydrogen 3.325 N/A LYS 81.A N SER 78.A OG no hydrogen 3.129 N/A PHE 82.A N SER 78.A O no hydrogen 2.942 N/A TYR 83.A N LEU 79.A O no hydrogen 2.928 N/A ASP 84.A N GLU 80.A O no hydrogen 2.894 N/A ASP 85.A N LYS 81.A O no hydrogen 2.904 N/A SER 88.A OG ASP 85.A O no hydrogen 3.569 N/A SER 88.A OG ASP 90.A OD1 no hydrogen 2.458 N/A ASN 92.A N ASP 90.A OD1 no hydrogen 3.304 N/A ASN 92.A ND2 SER 78.A O no hydrogen 3.119 N/A SER 93.A OG PRO 86.A O no hydrogen 2.704 N/A TYR 94.A OH HIS 151.A ND1 no hydrogen 2.502 N/A ARG 95.A N GLY 91.A O no hydrogen 3.472 N/A ARG 95.A NE GLU 281.A O no hydrogen 3.428 N/A ARG 95.A NH2 ASP 90.A O no hydrogen 2.973 N/A LEU 96.A N ASN 92.A O no hydrogen 2.900 N/A GLN 97.A N SER 93.A O no hydrogen 2.942 N/A GLN 97.A NE2 ASP 131.A OD2 no hydrogen 2.698 N/A SER 98.A N TYR 94.A O no hydrogen 2.877 N/A SER 98.A OG TYR 94.A O no hydrogen 3.336 N/A SER 98.A OG ARG 95.A O no hydrogen 2.944 N/A TRP 99.A N ARG 95.A O no hydrogen 2.948 N/A TRP 99.A NE1 ILE 56.A O no hydrogen 2.682 N/A LEU 100.A N LEU 96.A O no hydrogen 2.880 N/A TYR 101.A N GLN 97.A O no hydrogen 2.903 N/A TYR 101.A OH THR 159.A OG1 no hydrogen 2.652 N/A ALA 102.A N SER 98.A O no hydrogen 2.934 N/A SER 103.A N TRP 99.A O no hydrogen 2.909 N/A SER 103.A OG GLY 55.A O no hydrogen 3.383 N/A SER 103.A OG TRP 99.A O no hydrogen 3.053 N/A ARG 104.A N LEU 100.A O no hydrogen 2.878 N/A ARG 104.A NE ASP 131.A OD1 no hydrogen 3.046 N/A ARG 104.A NH1 ARG 126.A O no hydrogen 2.881 N/A LEU 105.A N TYR 101.A O no hydrogen 2.875 N/A LEU 106.A N ALA 102.A O no hydrogen 2.941 N/A GLN 107.A N SER 103.A O no hydrogen 2.901 N/A GLN 107.A NE2 PRO 52.A O no hydrogen 2.509 N/A TYR 108.A N ARG 104.A O no hydrogen 2.872 N/A TYR 108.A OH LEU 164.A O no hydrogen 2.307 N/A ALA 109.A N LEU 105.A O no hydrogen 2.923 N/A ASP 110.A N LEU 106.A O no hydrogen 2.916 N/A ALA 111.A N GLN 107.A O no hydrogen 2.904 N/A LEU 112.A N TYR 108.A O no hydrogen 2.894 N/A GLU 113.A N ALA 109.A O no hydrogen 2.909 N/A HIS 114.A N ASP 110.A O no hydrogen 2.920 N/A LEU 115.A N ALA 111.A O no hydrogen 2.910 N/A LEU 116.A N LEU 112.A O no hydrogen 2.898 N/A SER 117.A N GLU 113.A O no hydrogen 2.906 N/A SER 117.A OG GLU 113.A O no hydrogen 2.901 N/A SER 117.A OG HIS 114.A O no hydrogen 3.237 N/A THR 118.A N HIS 114.A O no hydrogen 2.922 N/A THR 118.A OG1 HIS 114.A O no hydrogen 2.807 N/A GLY 119.A N LEU 115.A O no hydrogen 3.041 N/A GLN 120.A N THR 118.A OG1 no hydrogen 3.228 N/A GLN 120.A NE2 HIS 114.A NE2 no hydrogen 3.062 N/A VAL 122.A N ARG 23.A O no hydrogen 2.931 N/A VAL 123.A N LYS 49.A O no hydrogen 2.893 N/A LEU 124.A N ILE 25.A O no hydrogen 2.855 N/A GLU 125.A N TYR 51.A O no hydrogen 3.006 N/A ARG 126.A N VAL 27.A O no hydrogen 2.919 N/A ARG 126.A NH1 GLU 53.A OE2 no hydrogen 2.592 N/A ARG 126.A NH2 GLY 29.A O no hydrogen 2.532 N/A ARG 126.A NH2 ASN 30.A O no hydrogen 2.435 N/A SER 127.A N THR 26.A OG1 no hydrogen 3.379 N/A SER 130.A N SER 127.A O no hydrogen 3.158 N/A SER 130.A OG ASP 28.A OD1 no hydrogen 2.994 N/A SER 130.A OG SER 127.A O no hydrogen 3.204 N/A LEU 135.A N ASP 131.A O no hydrogen 3.083 N/A GLU 136.A N PHE 132.A O no hydrogen 2.854 N/A ALA 137.A N VAL 133.A O no hydrogen 2.895 N/A MET 138.A N PHE 134.A O no hydrogen 3.009 N/A TYR 139.A N LEU 135.A O no hydrogen 2.960 N/A ASN 140.A N GLU 136.A O no hydrogen 2.873 N/A ASN 140.A ND2 GLU 136.A O no hydrogen 3.115 N/A GLN 141.A N ALA 137.A O no hydrogen 2.947 N/A GLY 142.A N TYR 139.A O no hydrogen 3.166 N/A TYR 143.A N MET 138.A O no hydrogen 2.833 N/A GLN 147.A N GLN 147.A OE1 no hydrogen 2.987 N/A VAL 149.A N ARG 145.A O no hydrogen 2.986 N/A ASP 150.A N LYS 146.A O no hydrogen 2.871 N/A HIS 151.A N GLN 147.A O no hydrogen 2.901 N/A HIS 151.A ND1 TYR 94.A OH no hydrogen 2.502 N/A TYR 152.A N CYS 148.A O no hydrogen 2.942 N/A TYR 152.A OH ASP 131.A OD2 no hydrogen 2.269 N/A ASN 153.A N VAL 149.A O no hydrogen 2.907 N/A GLU 154.A N ASP 150.A O no hydrogen 2.889 N/A ILE 155.A N HIS 151.A O no hydrogen 2.968 N/A LYS 156.A N TYR 152.A O no hydrogen 2.870 N/A ARG 157.A N ASN 153.A O no hydrogen 2.888 N/A ARG 157.A NH2 GLU 154.A OE2 no hydrogen 2.907 N/A LEU 158.A N GLU 154.A O no hydrogen 2.916 N/A THR 159.A N ILE 155.A O no hydrogen 2.915 N/A THR 159.A OG1 TYR 101.A OH no hydrogen 2.652 N/A THR 159.A OG1 ILE 155.A O no hydrogen 2.647 N/A LEU 160.A N LYS 156.A O no hydrogen 2.863 N/A TYR 163.A N LEU 160.A O no hydrogen 3.191 N/A ALA 168.A N VAL 24.A O no hydrogen 2.938 N/A VAL 169.A N GLU 219.A O no hydrogen 2.902 N/A ILE 170.A N THR 26.A O no hydrogen 2.896 N/A TYR 171.A N LEU 221.A O no hydrogen 2.977 N/A ILE 172.A N ASP 28.A O no hydrogen 2.917 N/A ASP 173.A N TYR 223.A O no hydrogen 2.884 N/A VAL 179.A N PRO 175.A O no hydrogen 2.920 N/A GLN 180.A N VAL 176.A O no hydrogen 2.902 N/A GLN 180.A NE2 SER 196.A OG no hydrogen 2.603 N/A SER 181.A N PRO 177.A O no hydrogen 2.898 N/A SER 181.A OG PRO 177.A O no hydrogen 3.376 N/A SER 181.A OG GLU 178.A O no hydrogen 2.640 N/A ARG 182.A N GLU 178.A O no hydrogen 2.932 N/A ARG 182.A NH2 SER 225.A OG no hydrogen 2.836 N/A ILE 183.A N VAL 179.A O no hydrogen 2.891 N/A GLN 184.A N GLN 180.A O no hydrogen 2.908 N/A LYS 185.A N SER 181.A O no hydrogen 2.901 N/A LYS 186.A N ARG 182.A O no hydrogen 2.931 N/A LYS 186.A N ILE 183.A O no hydrogen 3.213 N/A GLY 187.A N ILE 183.A O no hydrogen 3.507 N/A HIS 190.A ND1 ASP 84.A OD1 no hydrogen 2.709 N/A GLU 191.A N ASP 188.A OD1 no hydrogen 2.644 N/A MET 192.A N ASP 188.A O no hydrogen 2.913 N/A LYS 193.A N HIS 190.A O no hydrogen 2.978 N/A LYS 193.A NZ ASP 84.A OD1 no hydrogen 2.834 N/A TYR 198.A N THR 195.A OG1 no hydrogen 3.177 N/A LEU 199.A N THR 195.A O no hydrogen 3.007 N/A GLN 200.A N SER 196.A O no hydrogen 2.844 N/A GLN 200.A NE2 GLN 200.A O no hydrogen 3.247 N/A GLN 200.A NE2 GLU 203.A OE1 no hydrogen 2.910 N/A ASP 201.A N ALA 197.A O no hydrogen 2.881 N/A ILE 202.A N TYR 198.A O no hydrogen 2.969 N/A GLU 203.A N LEU 199.A O no hydrogen 2.959 N/A ASN 204.A N GLN 200.A O no hydrogen 2.847 N/A ALA 205.A N ASP 201.A O no hydrogen 2.902 N/A TYR 206.A N ILE 202.A O no hydrogen 2.959 N/A TYR 206.A OH ASP 28.A OD1 no hydrogen 3.352 N/A TYR 206.A OH GLY 29.A O no hydrogen 2.393 N/A LYS 207.A N GLU 203.A O no hydrogen 2.956 N/A LYS 207.A NZ ASP 173.A OD1 no hydrogen 3.087 N/A LYS 207.A NZ ASP 173.A OD2 no hydrogen 2.862 N/A LYS 207.A NZ GLU 203.A OE2 no hydrogen 2.543 N/A LYS 208.A N ASN 204.A O no hydrogen 2.880 N/A THR 209.A N ALA 205.A O no hydrogen 2.973 N/A PHE 210.A N ALA 205.A O no hydrogen 3.449 N/A PHE 210.A N TYR 206.A O no hydrogen 2.946 N/A LEU 211.A N TYR 206.A O no hydrogen 3.279 N/A MET 214.A N PHE 210.A O no hydrogen 3.282 N/A SER 215.A N LEU 211.A O no hydrogen 2.929 N/A SER 215.A OG LEU 211.A O no hydrogen 3.417 N/A SER 215.A OG PRO 212.A O no hydrogen 2.726 N/A GLU 216.A N PRO 212.A O no hydrogen 2.989 N/A MET 217.A N MET 214.A O no hydrogen 3.296 N/A CYS 218.A N MET 214.A O no hydrogen 2.610 N/A CYS 218.A SG MET 214.A O no hydrogen 3.197 N/A CYS 218.A SG GLU 219.A O no hydrogen 3.995 N/A TYR 223.A N TYR 171.A O no hydrogen 2.861 N/A ASP 224.A N GLU 227.A OE1 no hydrogen 3.403 N/A ALA 228.A N ASP 224.A O no hydrogen 2.872 N/A THR 232.A N ASP 230.A O no hydrogen 2.568 N/A GLU 236.A N THR 232.A O no hydrogen 2.932 N/A ASP 237.A N LYS 233.A O no hydrogen 2.943 N/A ILE 238.A N VAL 234.A O no hydrogen 2.924 N/A GLU 239.A N VAL 235.A O no hydrogen 2.947 N/A TYR 240.A N GLU 236.A O no hydrogen 2.922 N/A LEU 241.A N ILE 238.A O no hydrogen 3.209 N/A LYS 245.A NZ SER 215.A O no hydrogen 2.895 N/A LYS 245.A NZ CYS 218.A O no hydrogen 3.356 N/A TRP 248.A NE1 PRO 165.A O no hydrogen 2.538 N/A GLN 251.A NE2 PRO 247.A O no hydrogen 2.966 N/A ASP 252.A N THR 255.A OG1 no hydrogen 2.683 N/A THR 255.A N ASP 252.A OD1 no hydrogen 3.150 N/A THR 255.A OG1 GLN 251.A OE1 no hydrogen 3.408 N/A THR 255.A OG1 ASP 252.A O no hydrogen 2.846 N/A THR 255.A OG1 ASP 252.A OD1 no hydrogen 2.413 N/A PHE 256.A N ASP 252.A O no hydrogen 2.929 N/A HIS 257.A N ASP 253.A O no hydrogen 2.874 N/A HIS 257.A ND1 TYR 3.A OH no hydrogen 2.883 N/A TYR 258.A N TRP 254.A O no hydrogen 2.924 N/A LEU 259.A N THR 255.A O no hydrogen 2.938 N/A ARG 260.A N PHE 256.A O no hydrogen 2.856 N/A MET 261.A N HIS 257.A O no hydrogen 2.921 N/A LEU 262.A N TYR 258.A O no hydrogen 2.957 N/A VAL 263.A N LEU 259.A O no hydrogen 2.914 N/A GLN 264.A N ARG 260.A O no hydrogen 2.872 N/A GLN 264.A NE2 TYR 3.A O no hydrogen 3.181 N/A ASP 265.A N MET 261.A O no hydrogen 3.009 N/A LYS 266.A NZ ASP 110.A OD1 no hydrogen 2.421 N/A THR 267.A OG1 ASP 265.A OD1 no hydrogen 2.721 N/A VAL 269.A N ASP 265.A O no hydrogen 3.045 N/A LEU 270.A N LYS 266.A O no hydrogen 2.943 N/A THR 273.A OG1 LEU 270.A O no hydrogen 2.691 N/A THR 274.A N ASN 271.A O no hydrogen 3.257 N/A THR 274.A OG1 ASN 271.A O no hydrogen 2.791 N/A LEU 279.A N VAL 277.A O no hydrogen 2.971 N/A GLU 281.A N GLU 281.A OE1 no hydrogen 2.848 N/A ILE 282.A N LEU 279.A O no hydrogen 2.868 N/A THR 283.A N LEU 279.A O no hydrogen 2.820 N/A GLY 289.A N GLY 285.A O no hydrogen 2.912 N/A SER 290.A N ALA 286.A O no hydrogen 2.879 N/A SER 290.A OG ALA 286.A O no hydrogen 2.866 N/A ARG 291.A N HIS 287.A O no hydrogen 2.959 N/A ARG 291.A NH1 GLU 72.A OE1 no hydrogen 2.788 N/A ILE 292.A N GLN 288.A O no hydrogen 2.942 N/A TYR 293.A N GLY 289.A O no hydrogen 2.877 N/A ASN 294.A N SER 290.A O no hydrogen 2.874 N/A SER 295.A N ARG 291.A O no hydrogen 2.967 N/A SER 295.A OG ARG 291.A O no hydrogen 2.898 N/A PHE 296.A N ILE 292.A O no hydrogen 2.900 N/A ARG 297.A N TYR 293.A O no hydrogen 2.902 N/A ARG 297.A NE LYS 303.A O no hydrogen 3.453 N/A ARG 297.A NH2 LYS 303.A O no hydrogen 3.567 N/A GLU 298.A N ASN 294.A O no hydrogen 2.908 N/A LEU 299.A N PHE 296.A O no hydrogen 3.226 N/A GLY 301.A N GLU 311.A OE2 no hydrogen 3.241 N/A ARG 302.A N LEU 299.A O no hydrogen 3.302 N/A ARG 302.A NH2 THR 63.A OG1 no hydrogen 3.371 N/A TYR 304.A N ASN 309.A OD1 no hydrogen 3.022 N/A TYR 308.A N ALA 305.A O no hydrogen 3.021 N/A TYR 308.A OH LYS 320.A O no hydrogen 3.187 N/A ASN 309.A N ASP 314.A OD2 no hydrogen 2.819 N/A ASN 309.A ND2 TYR 304.A O no hydrogen 3.484 N/A VAL 312.A N ASN 309.A O no hydrogen 3.444 N/A GLY 313.A N ALA 310.A O no hydrogen 3.474 N/A ASP 314.A N ASN 309.A O no hydrogen 3.399 N/A LEU 319.A N TRP 316.A O no hydrogen 3.236 N/A LYS 320.A N ILE 317.A O no hydrogen 3.206 N/A LYS 320.A NZ GLY 307.A O no hydrogen 3.275 N/A LYS 320.A NZ LYS 315.A O no hydrogen 2.468 N/A