Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8p4u_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 1.A ND2 GLY 72.A O no hydrogen 3.393 N/A ILE 3.A N ASN 1.A OD1 no hydrogen 3.301 N/A THR 4.A N ASN 1.A O no hydrogen 3.193 N/A THR 4.A OG1 THR 337.A O no hydrogen 2.750 N/A THR 4.A OG1 SER 339.A OG no hydrogen 3.184 N/A ASN 6.A ND2 ASN 58.A O no hydrogen 2.961 N/A LEU 7.A N ILE 3.A O no hydrogen 2.707 N/A ALA 8.A N THR 4.A O no hydrogen 2.861 N/A GLU 9.A N PRO 5.A O no hydrogen 3.225 N/A PHE 10.A N ASN 6.A O no hydrogen 2.912 N/A ALA 11.A N LEU 7.A O no hydrogen 2.738 N/A PHE 12.A N ALA 8.A O no hydrogen 3.055 N/A SER 13.A N GLU 9.A O no hydrogen 2.931 N/A SER 13.A OG GLU 9.A O no hydrogen 3.486 N/A SER 13.A OG PHE 10.A O no hydrogen 3.090 N/A LEU 14.A N PHE 10.A O no hydrogen 2.912 N/A TYR 15.A N ALA 11.A O no hydrogen 2.863 N/A TYR 15.A OH GLU 236.A OE2 no hydrogen 2.972 N/A ARG 16.A N PHE 12.A O no hydrogen 2.775 N/A ARG 16.A NE GLU 236.A O no hydrogen 3.164 N/A ARG 16.A NH2 GLU 236.A O no hydrogen 3.098 N/A ARG 16.A NH2 LEU 239.A O no hydrogen 2.958 N/A GLN 17.A N SER 13.A O no hydrogen 3.037 N/A LEU 18.A N LEU 14.A O no hydrogen 3.021 N/A ALA 19.A N TYR 15.A O no hydrogen 2.795 N/A HIS 20.A N GLN 17.A O no hydrogen 3.249 N/A GLN 21.A N LEU 18.A O no hydrogen 3.246 N/A THR 25.A N ASN 23.A O no hydrogen 2.722 N/A ASN 26.A ND2 ASN 348.A O no hydrogen 2.854 N/A ILE 27.A N LYS 345.A O no hydrogen 3.098 N/A PHE 28.A N TYR 269.A OH no hydrogen 3.075 N/A PHE 29.A N MET 343.A O no hydrogen 3.065 N/A SER 30.A N HIS 306.A NE2 no hydrogen 3.221 N/A SER 30.A OG SER 33.A OG no hydrogen 3.355 N/A SER 30.A OG LEU 341.A O no hydrogen 2.685 N/A SER 33.A N SER 30.A OG no hydrogen 3.191 N/A SER 33.A OG SER 30.A O no hydrogen 3.105 N/A SER 33.A OG ASN 158.A OD1 no hydrogen 2.748 N/A ILE 34.A N SER 30.A O no hydrogen 3.086 N/A ALA 35.A N PRO 31.A O no hydrogen 2.944 N/A THR 36.A N VAL 32.A O no hydrogen 2.762 N/A THR 36.A OG1 VAL 32.A O no hydrogen 2.872 N/A ALA 37.A N SER 33.A O no hydrogen 2.955 N/A PHE 38.A N ILE 34.A O no hydrogen 3.153 N/A ALA 39.A N ALA 35.A O no hydrogen 2.889 N/A MET 40.A N THR 36.A O no hydrogen 2.978 N/A LEU 41.A N ALA 37.A O no hydrogen 3.047 N/A SER 42.A N PHE 38.A O no hydrogen 2.907 N/A SER 42.A OG ALA 39.A O no hydrogen 2.435 N/A LEU 43.A N MET 40.A O no hydrogen 3.177 N/A GLY 44.A N LEU 41.A O no hydrogen 3.061 N/A THR 45.A N SER 42.A O no hydrogen 3.028 N/A THR 45.A OG1 SER 42.A O no hydrogen 2.854 N/A LYS 46.A N ASP 289.A O no hydrogen 3.215 N/A HIS 50.A N LYS 46.A O no hydrogen 3.433 N/A HIS 50.A ND1 ASP 51.A OD1 no hydrogen 3.287 N/A HIS 50.A NE2 GLU 66.A OE2 no hydrogen 2.477 N/A ASP 51.A N ALA 47.A O no hydrogen 3.147 N/A GLU 52.A N ASP 48.A O no hydrogen 2.976 N/A ILE 53.A N THR 49.A O no hydrogen 3.481 N/A LEU 54.A N HIS 50.A O no hydrogen 3.430 N/A GLU 55.A N ASP 51.A O no hydrogen 2.884 N/A GLY 56.A N GLU 52.A O no hydrogen 2.758 N/A LEU 57.A N ILE 53.A O no hydrogen 3.139 N/A ASN 58.A N GLU 55.A O no hydrogen 2.957 N/A PHE 59.A N LEU 54.A O no hydrogen 3.143 N/A THR 62.A N ASN 60.A OD1 no hydrogen 3.041 N/A THR 62.A OG1 ASN 60.A OD1 no hydrogen 2.504 N/A GLU 63.A N ASN 60.A O no hydrogen 2.981 N/A ILE 64.A N ASN 60.A O no hydrogen 3.167 N/A ILE 69.A N PRO 65.A O no hydrogen 3.251 N/A HIS 70.A N GLU 66.A O no hydrogen 3.001 N/A HIS 70.A ND1 TYR 110.A OH no hydrogen 2.676 N/A HIS 70.A NE2 GLU 66.A OE2 no hydrogen 2.983 N/A GLU 71.A N ALA 67.A O no hydrogen 2.954 N/A GLY 72.A N GLN 68.A O no hydrogen 2.697 N/A PHE 73.A N ILE 69.A O no hydrogen 3.174 N/A GLN 74.A N HIS 70.A O no hydrogen 2.967 N/A GLN 74.A NE2 LEU 109.A O no hydrogen 2.598 N/A GLU 75.A N GLU 71.A O no hydrogen 3.181 N/A LEU 76.A N GLY 72.A O no hydrogen 3.236 N/A LEU 77.A N PHE 73.A O no hydrogen 3.020 N/A ARG 78.A N GLN 74.A O no hydrogen 2.871 N/A THR 79.A N GLU 75.A O no hydrogen 3.025 N/A THR 85.A N PHE 161.A O no hydrogen 2.919 N/A THR 86.A OG1 TYR 159.A O no hydrogen 3.204 N/A GLY 87.A N TYR 159.A O no hydrogen 3.228 N/A ASN 88.A ND2 SER 112.A OG no hydrogen 3.120 N/A GLY 89.A N VAL 157.A O no hydrogen 2.820 N/A LEU 90.A N GLU 113.A O no hydrogen 2.813 N/A PHE 91.A N ALA 155.A O no hydrogen 2.830 N/A LEU 92.A N PHE 115.A O no hydrogen 2.897 N/A SER 93.A N VAL 153.A O no hydrogen 2.895 N/A SER 93.A OG GLU 94.A O no hydrogen 3.372 N/A GLU 94.A N VAL 117.A O no hydrogen 2.837 N/A VAL 99.A N VAL 293.A O no hydrogen 2.523 N/A PHE 102.A N VAL 99.A O no hydrogen 3.134 N/A LEU 103.A N VAL 99.A O no hydrogen 3.364 N/A GLU 104.A N ASP 100.A O no hydrogen 3.058 N/A ASP 105.A N LYS 101.A O no hydrogen 3.225 N/A VAL 106.A N PHE 102.A O no hydrogen 2.955 N/A LYS 107.A N LEU 103.A O no hydrogen 3.387 N/A LYS 108.A N GLU 104.A O no hydrogen 2.765 N/A LEU 109.A N ASP 105.A O no hydrogen 2.955 N/A TYR 110.A N VAL 106.A O no hydrogen 3.355 N/A TYR 110.A OH HIS 70.A ND1 no hydrogen 2.676 N/A HIS 111.A N LYS 107.A O no hydrogen 3.076 N/A SER 112.A N VAL 106.A O no hydrogen 3.046 N/A SER 112.A OG TYR 110.A O no hydrogen 3.261 N/A GLU 113.A N ASN 88.A O no hydrogen 3.069 N/A PHE 115.A N LEU 90.A O no hydrogen 2.597 N/A VAL 117.A N LEU 92.A O no hydrogen 2.993 N/A GLY 120.A N ASN 118.A OD1 no hydrogen 3.035 N/A ASP 121.A N ASN 118.A O no hydrogen 3.238 N/A GLU 124.A N ASP 121.A OD1 no hydrogen 3.349 N/A ALA 125.A N ASP 121.A O no hydrogen 2.905 N/A LYS 126.A N THR 122.A O no hydrogen 3.038 N/A LYS 126.A NZ GLU 123.A OE1 no hydrogen 2.837 N/A LYS 126.A NZ LYS 146.A O no hydrogen 3.059 N/A LYS 127.A N GLU 123.A O no hydrogen 3.107 N/A LYS 127.A NZ ASP 131.A OD2 no hydrogen 2.964 N/A GLN 128.A N GLU 124.A O no hydrogen 2.819 N/A ILE 129.A N ALA 125.A O no hydrogen 3.024 N/A ASN 130.A N LYS 126.A O no hydrogen 3.034 N/A ASN 130.A ND2 VAL 145.A O no hydrogen 2.917 N/A ASP 131.A N LYS 127.A O no hydrogen 2.952 N/A TYR 132.A N GLN 128.A O no hydrogen 3.282 N/A TYR 132.A OH ASN 88.A O no hydrogen 3.202 N/A TYR 132.A OH GLU 113.A OE2 no hydrogen 3.122 N/A VAL 133.A N ILE 129.A O no hydrogen 3.133 N/A GLU 134.A N ASN 130.A O no hydrogen 2.662 N/A LYS 135.A N ASP 131.A O no hydrogen 2.598 N/A GLY 136.A N TYR 132.A O no hydrogen 2.762 N/A THR 137.A OG1 VAL 133.A O no hydrogen 3.236 N/A GLN 138.A N LYS 135.A O no hydrogen 3.178 N/A GLY 139.A N GLU 134.A O no hydrogen 2.683 N/A LYS 140.A N THR 137.A O no hydrogen 3.263 N/A ILE 141.A N THR 137.A OG1 no hydrogen 3.252 N/A VAL 145.A N ASN 130.A OD1 no hydrogen 2.624 N/A ASP 151.A N ASP 151.A OD1 no hydrogen 2.587 N/A THR 152.A OG1 ASP 149.A O no hydrogen 2.947 N/A ALA 155.A N PHE 91.A O no hydrogen 2.816 N/A LEU 156.A N LYS 303.A O no hydrogen 2.747 N/A VAL 157.A N GLY 89.A O no hydrogen 3.019 N/A ASN 158.A N VAL 305.A O no hydrogen 2.948 N/A ASN 158.A ND2 ASN 88.A OD1 no hydrogen 2.373 N/A TYR 159.A N GLY 87.A O no hydrogen 3.179 N/A ILE 160.A N LYS 307.A O no hydrogen 2.936 N/A PHE 161.A N THR 85.A O no hydrogen 2.683 N/A PHE 162.A N VAL 309.A O no hydrogen 2.826 N/A CYS 164.A SG LEU 82.A O no hydrogen 3.305 N/A CYS 164.A SG LYS 165.A O no hydrogen 3.750 N/A CYS 164.A SG LEU 217.A O no hydrogen 3.244 N/A TRP 166.A NE1 ASP 313.A O no hydrogen 2.845 N/A GLU 167.A N LYS 215.A O no hydrogen 3.281 N/A ARG 168.A NH1 MET 198.A O no hydrogen 3.015 N/A ARG 168.A NH2 MET 198.A O no hydrogen 2.755 N/A PHE 170.A N GLU 314.A O no hydrogen 3.410 N/A ASP 174.A N GLU 171.A O no hydrogen 3.055 N/A THR 175.A N VAL 172.A O no hydrogen 3.280 N/A THR 175.A OG1 GLU 314.A OE2 no hydrogen 2.335 N/A GLU 176.A N MET 192.A O no hydrogen 3.069 N/A GLU 178.A N VAL 190.A O no hydrogen 2.936 N/A PHE 180.A N VAL 188.A O no hydrogen 2.658 N/A HIS 181.A N ASN 325.A O no hydrogen 2.807 N/A ASP 183.A N THR 186.A OG1 no hydrogen 3.229 N/A VAL 185.A N ASP 183.A OD1 no hydrogen 2.911 N/A THR 186.A OG1 ASP 183.A OD2 no hydrogen 3.010 N/A VAL 190.A N GLU 178.A O no hydrogen 3.042 N/A MET 192.A N GLU 176.A O no hydrogen 2.815 N/A MET 193.A N LEU 260.A O no hydrogen 2.729 N/A LYS 194.A NZ GLU 176.A OE2 no hydrogen 2.433 N/A ARG 195.A N LEU 258.A O no hydrogen 3.186 N/A GLY 197.A N ALA 256.A O no hydrogen 3.360 N/A PHE 199.A N ARG 254.A O no hydrogen 2.793 N/A ASN 200.A ND2 ASN 250.A O no hydrogen 3.438 N/A GLN 202.A N VAL 211.A O no hydrogen 2.907 N/A CYS 204.A N SER 209.A O no hydrogen 2.925 N/A SER 208.A OG LYS 205.A O no hydrogen 3.456 N/A SER 209.A N CYS 204.A O no hydrogen 3.353 N/A SER 209.A OG LEU 207.A O no hydrogen 3.094 N/A TRP 210.A N LEU 226.A O no hydrogen 2.751 N/A VAL 211.A N GLN 202.A O no hydrogen 2.721 N/A LEU 212.A N PHE 224.A O no hydrogen 2.844 N/A LEU 213.A N ASN 200.A O no hydrogen 2.989 N/A MET 214.A N ALA 222.A O no hydrogen 2.938 N/A TYR 216.A N ALA 220.A O no hydrogen 2.976 N/A LEU 217.A N LYS 165.A O no hydrogen 2.857 N/A ASN 219.A N ASN 219.A OD1 no hydrogen 2.332 N/A ASN 219.A ND2 THR 79.A O no hydrogen 3.645 N/A ASN 219.A ND2 GLU 334.A OE2 no hydrogen 3.295 N/A THR 221.A N ILE 333.A O no hydrogen 2.790 N/A ALA 222.A N MET 214.A O no hydrogen 2.895 N/A ILE 223.A N LEU 331.A O no hydrogen 2.790 N/A PHE 224.A N LEU 212.A O no hydrogen 2.661 N/A PHE 225.A N VAL 329.A O no hydrogen 2.732 N/A LEU 226.A N TRP 210.A O no hydrogen 2.704 N/A ASP 228.A N SER 208.A O no hydrogen 2.955 N/A LYS 231.A N ASP 228.A O no hydrogen 2.928 N/A HIS 234.A NE2 LYS 206.A O no hydrogen 2.945 N/A LEU 235.A N LYS 231.A O no hydrogen 2.853 N/A GLU 236.A N LEU 232.A O no hydrogen 2.996 N/A ASN 237.A N GLN 233.A O no hydrogen 3.053 N/A GLU 238.A N HIS 234.A O no hydrogen 3.207 N/A HIS 241.A N GLU 9.A OE2 no hydrogen 3.279 N/A ILE 243.A N THR 240.A OG1 no hydrogen 3.335 N/A ILE 244.A N THR 240.A O no hydrogen 3.338 N/A THR 245.A N HIS 241.A O no hydrogen 3.078 N/A THR 245.A OG1 HIS 241.A O no hydrogen 3.054 N/A LYS 246.A N ASP 242.A O no hydrogen 2.927 N/A PHE 247.A N ILE 243.A O no hydrogen 3.115 N/A LEU 248.A N ILE 244.A O no hydrogen 3.003 N/A GLU 249.A N THR 245.A O no hydrogen 3.051 N/A ASN 250.A N LYS 246.A O no hydrogen 3.202 N/A ARG 254.A N PHE 199.A O no hydrogen 3.126 N/A ALA 256.A N GLY 197.A O no hydrogen 3.053 N/A SER 257.A N PRO 320.A O no hydrogen 2.749 N/A LEU 258.A N ARG 195.A O no hydrogen 3.049 N/A HIS 259.A N VAL 322.A O no hydrogen 2.902 N/A HIS 259.A ND1 GLU 178.A OE2 no hydrogen 2.649 N/A HIS 259.A NE2 GLU 321.A OE2 no hydrogen 2.508 N/A LEU 260.A N MET 193.A O no hydrogen 2.737 N/A LYS 262.A N PRO 191.A O no hydrogen 3.087 N/A LEU 263.A N ILE 312.A O no hydrogen 2.932 N/A SER 264.A OG LEU 310.A O no hydrogen 3.391 N/A ILE 265.A N LEU 310.A O no hydrogen 3.054 N/A GLY 267.A N ALA 308.A O no hydrogen 2.633 N/A TYR 269.A N HIS 306.A O no hydrogen 2.926 N/A LEU 271.A N ALA 304.A O no hydrogen 2.807 N/A SER 273.A N ASP 270.A OD2 no hydrogen 3.102 N/A SER 273.A OG ASP 270.A O no hydrogen 3.317 N/A SER 273.A OG ASP 270.A OD2 no hydrogen 3.033 N/A VAL 274.A N ASP 270.A O no hydrogen 3.268 N/A LEU 275.A N LEU 271.A O no hydrogen 2.877 N/A GLY 276.A N LYS 272.A O no hydrogen 3.220 N/A GLN 277.A N SER 273.A O no hydrogen 3.354 N/A LEU 278.A N LEU 275.A O no hydrogen 3.201 N/A GLY 279.A N GLY 276.A O no hydrogen 2.952 N/A ILE 280.A N LEU 275.A O no hydrogen 3.017 N/A THR 281.A N GLU 52.A OE1 no hydrogen 3.306 N/A LYS 282.A N GLU 52.A OE1 no hydrogen 3.014 N/A PHE 284.A N THR 281.A O no hydrogen 2.847 N/A SER 285.A N LYS 282.A O no hydrogen 3.246 N/A SER 285.A OG LYS 282.A O no hydrogen 2.877 N/A ALA 288.A N SER 285.A O no hydrogen 3.084 N/A ASP 289.A N THR 49.A OG1 no hydrogen 3.084 N/A SER 291.A OG ASP 289.A OD1 no hydrogen 3.088 N/A GLY 292.A N GLY 44.A O no hydrogen 3.017 N/A VAL 293.A N LEU 290.A O no hydrogen 3.009 N/A THR 294.A N LEU 290.A O no hydrogen 3.401 N/A THR 294.A OG1 LYS 97.A O no hydrogen 3.137 N/A LYS 300.A NZ ASP 151.A OD2 no hydrogen 3.481 N/A LYS 300.A NZ ASN 286.A OD1 no hydrogen 3.155 N/A LEU 301.A N VAL 283.A O no hydrogen 2.982 N/A SER 302.A N PHE 154.A O no hydrogen 2.940 N/A LYS 303.A NZ GLU 147.A O no hydrogen 3.212 N/A VAL 305.A N LEU 156.A O no hydrogen 3.062 N/A HIS 306.A N TYR 269.A O no hydrogen 2.859 N/A HIS 306.A ND1 ASN 158.A OD1 no hydrogen 2.891 N/A LYS 307.A N ASN 158.A O no hydrogen 3.006 N/A ALA 308.A N GLY 267.A O no hydrogen 2.864 N/A VAL 309.A N ILE 160.A O no hydrogen 3.020 N/A LEU 310.A N ILE 265.A O no hydrogen 2.785 N/A THR 311.A N PHE 162.A O no hydrogen 3.088 N/A ILE 312.A N LEU 263.A O no hydrogen 2.659 N/A ILE 318.A N SER 317.A OG no hydrogen 2.565 N/A VAL 322.A N SER 257.A O no hydrogen 2.999 N/A PHE 324.A N HIS 259.A O no hydrogen 2.755 N/A LYS 326.A NZ PRO 227.A O no hydrogen 2.594 N/A PHE 328.A N VAL 346.A O no hydrogen 3.372 N/A VAL 329.A N PHE 225.A O no hydrogen 3.150 N/A PHE 330.A N GLY 344.A O no hydrogen 2.959 N/A LEU 331.A N ILE 223.A O no hydrogen 2.898 N/A MET 332.A N PHE 342.A O no hydrogen 2.706 N/A ILE 333.A N THR 221.A O no hydrogen 2.704 N/A GLU 334.A N SER 339.A O no hydrogen 2.805 N/A GLN 335.A N ASN 219.A O no hydrogen 2.664 N/A ASN 336.A N GLU 334.A OE2 no hydrogen 2.852 N/A ASN 336.A ND2 THR 79.A OG1 no hydrogen 3.328 N/A THR 337.A N GLU 334.A OE1 no hydrogen 2.501 N/A THR 337.A OG1 GLU 334.A OE1 no hydrogen 2.846 N/A THR 337.A OG1 SER 339.A OG no hydrogen 3.039 N/A LYS 338.A N GLU 334.A O no hydrogen 2.876 N/A SER 339.A N THR 337.A OG1 no hydrogen 3.320 N/A SER 339.A OG THR 4.A OG1 no hydrogen 3.184 N/A SER 339.A OG THR 337.A OG1 no hydrogen 3.039 N/A PHE 342.A N MET 332.A O no hydrogen 3.245 N/A MET 343.A N PHE 29.A O no hydrogen 3.035 N/A GLY 344.A N PHE 330.A O no hydrogen 3.191 N/A LYS 345.A N ILE 27.A O no hydrogen 2.881 N/A LYS 345.A NZ GLU 236.A OE2 no hydrogen 2.805 N/A VAL 346.A N PHE 328.A O no hydrogen 3.037 N/A VAL 347.A N ASN 26.A OD1 no hydrogen 2.781 N/A ASN 348.A N ASN 26.A OD1 no hydrogen 3.001 N/A THR 350.A OG1 ASN 348.A OD1 no hydrogen 2.278 N/A GLN 351.A N ASN 348.A OD1 no hydrogen 2.746 N/A