Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3p9u_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 5.A NZ LEU 2.A O no hydrogen 3.369 N/A ASN 6.A N ASP 146.A OD1 no hydrogen 3.351 N/A ASN 6.A ND2 THR 144.A O no hydrogen 3.422 N/A VAL 7.A N ASP 28.A O no hydrogen 2.766 N/A ALA 8.A N LEU 147.A O no hydrogen 2.720 N/A ILE 9.A N SER 30.A O no hydrogen 2.896 N/A ILE 10.A N ILE 149.A O no hydrogen 2.948 N/A GLY 11.A N TYR 32.A O no hydrogen 3.068 N/A GLY 12.A N GLU 33.A OE1 no hydrogen 2.580 N/A LEU 17.A N GLY 13.A O no hydrogen 2.949 N/A THR 18.A N PRO 14.A O no hydrogen 3.142 N/A THR 18.A OG1 PRO 14.A O no hydrogen 2.827 N/A LYS 20.A N LEU 17.A O no hydrogen 3.003 N/A LYS 20.A NZ SER 112.A O no hydrogen 2.941 N/A LEU 21.A N THR 18.A O no hydrogen 2.848 N/A GLN 23.A N ALA 19.A O no hydrogen 2.896 N/A GLN 23.A NE2 THR 117.A OG1 no hydrogen 2.960 N/A GLN 24.A N LYS 20.A O no hydrogen 3.064 N/A GLN 24.A NE2 LYS 59.A O no hydrogen 3.063 N/A ASN 25.A N LEU 22.A O no hydrogen 2.748 N/A GLY 26.A N GLN 23.A O no hydrogen 3.244 N/A SER 30.A N VAL 7.A O no hydrogen 3.135 N/A VAL 31.A N THR 117.A O no hydrogen 2.883 N/A TYR 32.A N ILE 9.A O no hydrogen 2.898 N/A GLU 33.A N ILE 119.A O no hydrogen 3.252 N/A ASP 35.A N GLU 33.A OE2 no hydrogen 2.930 N/A GLU 39.A N ASP 37.A OD2 no hydrogen 2.791 N/A ALA 40.A N ASP 37.A O no hydrogen 3.131 N/A ILE 42.A N ASN 103.A OD1 no hydrogen 2.807 N/A THR 46.A OG1 GLU 99.A OE1 no hydrogen 2.817 N/A LEU 47.A N ILE 100.A O no hydrogen 2.903 N/A LEU 49.A N TYR 66.A OH no hydrogen 3.031 N/A HIS 50.A N ASN 303.A OD1 no hydrogen 2.810 N/A SER 53.A N HIS 50.A O no hydrogen 3.348 N/A GLN 55.A N HIS 50.A O no hydrogen 2.948 N/A GLN 55.A NE2 LEU 49.A O no hydrogen 2.982 N/A GLN 55.A NE2 PHE 95.A O no hydrogen 2.891 N/A ALA 57.A N SER 53.A O no hydrogen 3.053 N/A LYS 58.A NZ GLU 56.A OE2 no hydrogen 3.139 N/A LYS 59.A N GLU 56.A O no hydrogen 2.995 N/A ALA 60.A N ALA 57.A O no hydrogen 3.116 N/A GLY 61.A N LYS 58.A O no hydrogen 3.100 N/A GLN 64.A NE2 ASP 68.A OD1 no hydrogen 2.884 N/A TYR 66.A N LEU 62.A O no hydrogen 2.956 N/A TYR 66.A OH PRO 98.A O no hydrogen 2.702 N/A TYR 67.A N LEU 63.A O no hydrogen 2.789 N/A TYR 67.A OH GLN 55.A OE1 no hydrogen 2.329 N/A ASP 68.A N GLN 64.A O no hydrogen 2.893 N/A LEU 69.A N THR 65.A O no hydrogen 3.254 N/A ALA 70.A N TYR 66.A O no hydrogen 2.896 N/A LEU 71.A N GLU 99.A O no hydrogen 2.812 N/A GLY 73.A N ASN 195.A OD1 no hydrogen 3.333 N/A VAL 74.A N LYS 87.A O no hydrogen 2.824 N/A ASN 75.A N ARG 196.A O no hydrogen 2.911 N/A ILE 76.A N SER 85.A O no hydrogen 2.956 N/A ASP 78.A N ASN 82.A O no hydrogen 2.984 N/A LYS 79.A NZ HIS 200.A NE2 no hydrogen 3.396 N/A LYS 80.A N ASP 78.A OD1 no hydrogen 3.236 N/A GLY 81.A N ASP 78.A O no hydrogen 3.035 N/A GLY 81.A N ASP 78.A OD1 no hydrogen 2.930 N/A ASN 82.A N ASP 78.A OD1 no hydrogen 2.640 N/A ASN 82.A ND2 ASP 78.A OD2 no hydrogen 2.696 N/A LEU 84.A N ILE 76.A O no hydrogen 2.720 N/A SER 85.A N ILE 76.A O no hydrogen 3.158 N/A LYS 87.A N VAL 74.A O no hydrogen 2.962 N/A ASN 88.A ND2 THR 86.A OG1 no hydrogen 2.948 N/A GLU 92.A N GLU 92.A OE1 no hydrogen 2.657 N/A ASN 93.A N LYS 90.A O no hydrogen 2.606 N/A ARG 94.A NE PRO 91.A O no hydrogen 2.682 N/A ASN 97.A ND2 ASP 48.A OD2 no hydrogen 2.918 N/A GLU 99.A N LEU 71.A O no hydrogen 2.914 N/A ILE 100.A N LEU 47.A O no hydrogen 2.667 N/A ARG 102.A NE GLY 45.A O no hydrogen 2.943 N/A ASN 103.A ND2 ALA 40.A O no hydrogen 3.230 N/A LEU 105.A N ASN 101.A O no hydrogen 2.948 N/A ARG 106.A N ARG 102.A O no hydrogen 3.278 N/A ARG 106.A NH1 ASP 35.A OD2 no hydrogen 2.837 N/A ARG 106.A NH2 GLY 12.A O no hydrogen 3.152 N/A ARG 106.A NH2 ASP 35.A OD2 no hydrogen 2.927 N/A ALA 107.A N ASN 103.A O no hydrogen 2.992 N/A ILE 108.A N ASP 104.A O no hydrogen 3.018 N/A LEU 109.A N LEU 105.A O no hydrogen 2.975 N/A LEU 110.A N ARG 106.A O no hydrogen 2.742 N/A ASN 111.A N ALA 107.A O no hydrogen 3.055 N/A SER 112.A N LEU 109.A O no hydrogen 2.775 N/A SER 112.A OG LEU 109.A O no hydrogen 2.936 N/A LEU 113.A N LEU 110.A O no hydrogen 3.140 N/A GLU 114.A N GLN 23.A OE1 no hydrogen 2.740 N/A THR 117.A N GLU 114.A O no hydrogen 3.356 N/A THR 117.A OG1 GLU 114.A O no hydrogen 2.652 N/A ILE 119.A N VAL 31.A O no hydrogen 2.641 N/A ASP 121.A N ASP 35.A O no hydrogen 2.870 N/A ARG 122.A N GLU 33.A O no hydrogen 2.748 N/A VAL 125.A N THR 136.A O no hydrogen 2.984 N/A LYS 132.A NZ ASN 6.A OD1 no hydrogen 3.467 N/A LYS 132.A NZ ASP 146.A OD1 no hydrogen 3.107 N/A TRP 133.A N ALA 145.A O no hydrogen 2.762 N/A TRP 133.A NE1 PRO 285.A O no hydrogen 2.670 N/A THR 134.A N GLU 127.A O no hydrogen 2.892 N/A LEU 135.A N GLU 143.A O no hydrogen 2.705 N/A GLU 138.A N LYS 123.A O no hydrogen 3.135 N/A LYS 140.A N PHE 137.A O no hydrogen 2.983 N/A GLU 143.A N LEU 135.A O no hydrogen 3.015 N/A ALA 145.A N TRP 133.A O no hydrogen 3.102 N/A ASP 146.A N ASN 6.A O no hydrogen 2.960 N/A ASP 146.A N ASN 6.A OD1 no hydrogen 3.197 N/A LEU 147.A N ASN 6.A O no hydrogen 3.271 N/A ILE 149.A N ALA 8.A O no hydrogen 2.740 N/A LEU 150.A N THR 287.A O no hydrogen 2.964 N/A ALA 151.A N ILE 10.A O no hydrogen 2.822 N/A ASN 152.A ND2 SER 155.A OG no hydrogen 2.935 N/A SER 155.A OG ASN 152.A OD1 no hydrogen 2.814 N/A ARG 158.A NH1 ALA 291.A O no hydrogen 2.666 N/A ARG 158.A NH2 GLY 154.A O no hydrogen 3.004 N/A ARG 158.A NH2 SER 155.A O no hydrogen 3.464 N/A VAL 161.A N ARG 158.A O no hydrogen 3.049 N/A THR 162.A N ARG 158.A O no hydrogen 3.007 N/A THR 164.A N THR 162.A OG1 no hydrogen 2.874 N/A THR 164.A OG1 THR 162.A OG1 no hydrogen 3.094 N/A THR 164.A OG1 GLU 275.A OE2 no hydrogen 3.325 N/A GLU 167.A N ILE 271.A O no hydrogen 2.887 N/A THR 169.A N THR 269.A O no hydrogen 2.940 N/A THR 169.A OG1 GLU 349.A OE2 no hydrogen 2.983 N/A THR 171.A OG1 THR 269.A OG1 no hydrogen 2.878 N/A THR 171.A OG1 GLU 349.A OE1 no hydrogen 2.567 N/A PHE 172.A N PHE 221.A O no hydrogen 2.748 N/A ASN 173.A N LEU 267.A O no hydrogen 2.735 N/A ASN 173.A ND2 LEU 267.A O no hydrogen 3.677 N/A ASN 173.A ND2 THR 269.A OG1 no hydrogen 2.948 N/A ILE 174.A N ILE 219.A O no hydrogen 2.890 N/A GLN 175.A N VAL 265.A O no hydrogen 3.108 N/A ALA 176.A N PHE 217.A O no hydrogen 3.065 N/A ILE 178.A N LEU 215.A O no hydrogen 2.821 N/A GLU 182.A N GLU 182.A OE1 no hydrogen 2.459 N/A ILE 183.A N GLN 180.A O no hydrogen 2.981 N/A ASN 184.A N GLN 180.A O no hydrogen 3.069 N/A ASN 184.A ND2 HIS 179.A O no hydrogen 2.748 N/A ASN 184.A ND2 GLN 180.A O no hydrogen 3.612 N/A CYS 185.A N PRO 181.A O no hydrogen 2.989 N/A CYS 185.A SG PRO 181.A O no hydrogen 3.246 N/A GLY 187.A N GLU 256.A OE1 no hydrogen 3.240 N/A PHE 188.A N GLU 256.A OE1 no hydrogen 3.268 N/A PHE 189.A N CYS 185.A O no hydrogen 2.898 N/A GLN 190.A N PRO 186.A O no hydrogen 2.846 N/A LEU 191.A N GLY 187.A O no hydrogen 3.041 N/A CYS 192.A N PHE 188.A O no hydrogen 3.032 N/A CYS 192.A SG PHE 188.A O no hydrogen 3.523 N/A ASN 193.A N GLN 190.A O no hydrogen 3.192 N/A ASN 195.A N CYS 192.A O no hydrogen 2.780 N/A ASN 195.A ND2 ASN 75.A OD1 no hydrogen 3.144 N/A ASN 195.A ND2 ASN 88.A OD1 no hydrogen 3.698 N/A ARG 196.A N GLY 73.A O no hydrogen 2.901 N/A LEU 197.A N ALA 207.A O no hydrogen 2.909 N/A HIS 200.A N ASN 203.A O no hydrogen 3.008 N/A GLN 201.A NE2 ASP 249.A OD2 no hydrogen 2.947 N/A ASN 203.A N HIS 200.A O no hydrogen 2.917 N/A LEU 204.A N SER 220.A O no hydrogen 2.825 N/A LEU 205.A N ALA 198.A O no hydrogen 2.910 N/A PHE 206.A N GLY 218.A O no hydrogen 2.995 N/A ALA 207.A N LEU 197.A O no hydrogen 2.854 N/A ASN 208.A N HIS 216.A O no hydrogen 2.848 N/A ASN 208.A ND2 THR 46.A OG1 no hydrogen 3.414 N/A ASN 210.A N ASN 208.A OD1 no hydrogen 2.785 N/A ASN 211.A N ALA 214.A O no hydrogen 2.823 N/A ASN 212.A ND2 ASP 104.A OD1 no hydrogen 3.456 N/A ASN 212.A ND2 ASP 104.A OD2 no hydrogen 3.449 N/A GLY 213.A N ASN 210.A OD1 no hydrogen 3.081 N/A ALA 214.A N ASN 211.A O no hydrogen 3.113 N/A LEU 215.A N ILE 178.A O no hydrogen 2.817 N/A HIS 216.A N ASN 208.A O no hydrogen 2.966 N/A PHE 217.A N ALA 176.A O no hydrogen 3.173 N/A GLY 218.A N PHE 206.A O no hydrogen 2.830 N/A ILE 219.A N ILE 174.A O no hydrogen 2.625 N/A SER 220.A N LEU 204.A O no hydrogen 2.778 N/A SER 220.A OG ASN 173.A OD1 no hydrogen 2.568 N/A PHE 221.A N PHE 172.A O no hydrogen 3.160 N/A THR 223.A N GLY 170.A O no hydrogen 2.733 N/A THR 223.A OG1 GLY 170.A O no hydrogen 3.163 N/A GLU 226.A N GLU 226.A OE1 no hydrogen 2.536 N/A GLN 234.A N ASP 232.A OD1 no hydrogen 3.088 N/A ASN 235.A N ASP 232.A OD2 no hydrogen 3.120 N/A ARG 236.A NE THR 261.A O no hydrogen 3.253 N/A ARG 236.A NH2 THR 261.A O no hydrogen 3.412 N/A SER 238.A N ASN 235.A O no hydrogen 3.242 N/A VAL 240.A N ARG 236.A O no hydrogen 2.824 N/A ASP 241.A N ASN 237.A O no hydrogen 3.184 N/A PHE 242.A N SER 238.A O no hydrogen 3.377 N/A LEU 243.A N VAL 239.A O no hydrogen 2.873 N/A LEU 244.A N VAL 240.A O no hydrogen 2.840 N/A LYS 245.A N ASP 241.A O no hydrogen 3.044 N/A LYS 245.A N PHE 242.A O no hydrogen 3.150 N/A LYS 246.A N PHE 242.A O no hydrogen 3.205 N/A LYS 246.A NZ ASN 203.A OD1 no hydrogen 2.704 N/A SER 248.A N LYS 245.A O no hydrogen 2.910 N/A SER 248.A OG LYS 245.A O no hydrogen 3.225 N/A TRP 250.A N PHE 247.A O no hydrogen 2.761 N/A ASP 251.A N LYS 79.A O no hydrogen 2.844 N/A ARG 253.A N ASP 251.A OD1 no hydrogen 2.910 N/A ARG 253.A NE ASP 251.A OD1 no hydrogen 3.149 N/A TYR 254.A N ASP 251.A O no hydrogen 2.980 N/A TYR 254.A OH ASP 78.A O no hydrogen 2.983 N/A LYS 255.A N ASP 251.A O no hydrogen 3.327 N/A LYS 255.A NZ SER 248.A O no hydrogen 3.308 N/A LYS 255.A NZ GLU 252.A OE2 no hydrogen 3.527 N/A GLU 256.A N GLU 252.A O no hydrogen 2.908 N/A LEU 257.A N TYR 254.A O no hydrogen 2.998 N/A ILE 258.A N TYR 254.A O no hydrogen 3.340 N/A HIS 259.A N LYS 255.A O no hydrogen 2.820 N/A THR 260.A N GLU 256.A O no hydrogen 3.192 N/A THR 260.A OG1 ASN 184.A O no hydrogen 2.774 N/A THR 260.A OG1 GLU 256.A O no hydrogen 3.478 N/A THR 261.A OG1 SER 263.A O no hydrogen 3.554 N/A VAL 265.A N GLN 175.A O no hydrogen 3.045 N/A LEU 267.A N ASN 173.A O no hydrogen 3.060 N/A THR 269.A N THR 171.A O no hydrogen 3.209 N/A THR 269.A OG1 THR 171.A OG1 no hydrogen 2.878 N/A ILE 271.A N GLU 167.A O no hydrogen 2.903 N/A PHE 272.A N LEU 294.A O no hydrogen 2.884 N/A LEU 274.A N GLN 342.A OE1 no hydrogen 2.953 N/A LYS 276.A NZ ASP 163.A OD1 no hydrogen 3.264 N/A LYS 276.A NZ ASP 163.A OD2 no hydrogen 2.932 N/A LYS 279.A N VAL 161.A O no hydrogen 2.786 N/A LYS 279.A NZ LYS 159.A O no hydrogen 3.147 N/A ARG 282.A NH2 GLU 332.A OE1 no hydrogen 2.932 N/A THR 287.A N VAL 148.A O no hydrogen 3.242 N/A THR 287.A OG1 GLU 332.A OE2 no hydrogen 2.980 N/A GLY 289.A N ASP 308.A OD2 no hydrogen 2.849 N/A ALA 292.A N GLY 289.A O no hydrogen 2.926 N/A HIS 293.A N GLY 289.A O no hydrogen 3.196 N/A LEU 294.A N ASP 290.A O no hydrogen 3.044 N/A GLY 299.A N PRO 296.A O no hydrogen 2.779 N/A GLN 300.A NE2 GLU 344.A OE1 no hydrogen 2.864 N/A ASN 303.A N GLY 301.A O no hydrogen 2.568 N/A ASN 303.A ND2 ASP 48.A O no hydrogen 3.206 N/A SER 304.A OG HIS 293.A NE2 no hydrogen 2.815 N/A LEU 306.A N VAL 302.A O no hydrogen 2.474 N/A VAL 307.A N ASN 303.A O no hydrogen 2.816 N/A ASP 308.A N SER 304.A O no hydrogen 3.335 N/A ALA 309.A N GLY 305.A O no hydrogen 3.089 N/A LEU 310.A N LEU 306.A O no hydrogen 2.916 N/A ILE 311.A N VAL 307.A O no hydrogen 2.873 N/A LEU 312.A N ASP 308.A O no hydrogen 2.909 N/A SER 313.A N ALA 309.A O no hydrogen 2.811 N/A ASP 314.A N LEU 310.A O no hydrogen 2.932 N/A ASN 315.A N ILE 311.A O no hydrogen 3.093 N/A ASN 315.A ND2 ALA 327.A O no hydrogen 2.946 N/A LEU 316.A N LEU 312.A O no hydrogen 3.213 N/A ALA 317.A N ASP 314.A O no hydrogen 2.775 N/A ASP 318.A N ASP 314.A O no hydrogen 2.890 N/A ASN 322.A N GLU 326.A OE2 no hydrogen 2.804 N/A GLU 325.A N GLU 325.A OE1 no hydrogen 2.673 N/A GLU 326.A N SER 323.A OG no hydrogen 2.993 N/A ALA 327.A N SER 323.A O no hydrogen 3.419 N/A VAL 328.A N ILE 324.A O no hydrogen 3.045 N/A LYS 329.A N GLU 325.A O no hydrogen 2.865 N/A ASN 330.A N GLU 326.A O no hydrogen 2.778 N/A ASN 330.A ND2 GLN 334.A OE1 no hydrogen 3.126 N/A TYR 331.A N ALA 327.A O no hydrogen 2.963 N/A GLU 332.A N VAL 328.A O no hydrogen 2.850 N/A GLN 333.A N ASN 330.A O no hydrogen 2.955 N/A GLN 334.A N ASN 330.A O no hydrogen 3.183 N/A ILE 336.A N GLN 334.A O no hydrogen 2.891 N/A TYR 337.A N GLN 334.A O no hydrogen 3.376 N/A TYR 337.A OH ASP 308.A OD1 no hydrogen 2.690 N/A LYS 339.A N PHE 335.A O no hydrogen 3.303 N/A LYS 339.A NZ GLU 275.A O no hydrogen 3.507 N/A GLU 340.A N ILE 336.A O no hydrogen 3.422 N/A ALA 341.A N TYR 337.A O no hydrogen 2.939 N/A GLN 342.A N GLY 338.A O no hydrogen 2.866 N/A GLN 342.A NE2 PHE 272.A O no hydrogen 3.208 N/A GLN 342.A NE2 LEU 294.A O no hydrogen 3.548 N/A GLU 343.A N LYS 339.A O no hydrogen 2.906 N/A GLU 344.A N GLU 340.A O no hydrogen 3.120 N/A SER 345.A N ALA 341.A O no hydrogen 2.932 N/A SER 345.A OG ALA 341.A O no hydrogen 3.428 N/A SER 345.A OG GLN 342.A O no hydrogen 3.282 N/A THR 346.A N GLN 342.A O no hydrogen 3.023 N/A THR 346.A OG1 GLN 342.A O no hydrogen 2.889 N/A GLN 347.A N GLU 343.A O no hydrogen 3.028 N/A ASN 348.A N GLU 344.A O no hydrogen 2.657 N/A GLU 349.A N SER 345.A O no hydrogen 2.817 N/A ILE 350.A N THR 346.A O no hydrogen 3.054 N/A GLU 351.A N GLN 347.A O no hydrogen 2.839 N/A