Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3qfv_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 4.A N SER 1.A O no hydrogen 2.747 N/A ARG 5.A N SER 1.A O no hydrogen 3.159 N/A LEU 6.A N ALA 2.A O no hydrogen 3.007 N/A LYS 7.A NZ GLU 10.A OE2 no hydrogen 2.672 N/A LYS 8.A N VAL 4.A O no hydrogen 3.204 N/A LEU 9.A N ARG 5.A O no hydrogen 3.113 N/A GLU 10.A N LEU 6.A O no hydrogen 3.237 N/A GLN 11.A N LYS 7.A O no hydrogen 2.873 N/A LEU 12.A N LYS 8.A O no hydrogen 3.042 N/A LEU 13.A N LEU 9.A O no hydrogen 3.056 N/A LEU 14.A N GLU 10.A O no hydrogen 2.681 N/A ASP 15.A N GLN 11.A O no hydrogen 2.997 N/A GLY 16.A N LEU 12.A O no hydrogen 3.251 N/A ASN 20.A N GLY 16.A O no hydrogen 2.930 N/A SER 25.A OG THR 28.A OG1 no hydrogen 3.407 N/A SER 25.A OG ASP 391.A OD1 no hydrogen 3.272 N/A GLU 27.A N PHE 389.A O no hydrogen 3.179 N/A THR 28.A N SER 25.A OG no hydrogen 3.214 N/A THR 28.A OG1 SER 25.A OG no hydrogen 3.407 N/A LEU 29.A N SER 25.A O no hydrogen 3.213 N/A LEU 30.A N VAL 26.A O no hydrogen 2.879 N/A ASP 31.A N GLU 27.A O no hydrogen 3.160 N/A VAL 32.A N THR 28.A O no hydrogen 3.087 N/A LEU 33.A N LEU 29.A O no hydrogen 3.301 N/A VAL 34.A N LEU 30.A O no hydrogen 3.155 N/A CYS 35.A N ASP 31.A O no hydrogen 2.787 N/A CYS 35.A SG HIS 375.A O no hydrogen 3.594 N/A LEU 36.A N VAL 32.A O no hydrogen 2.878 N/A TYR 37.A N LEU 33.A O no hydrogen 2.984 N/A THR 38.A N VAL 34.A O no hydrogen 3.178 N/A THR 38.A OG1 VAL 34.A O no hydrogen 3.047 N/A GLU 39.A N CYS 35.A O no hydrogen 2.994 N/A CYS 40.A N LEU 36.A O no hydrogen 2.968 N/A SER 41.A N TYR 37.A O no hydrogen 3.161 N/A HIS 42.A N GLU 39.A O no hydrogen 3.258 N/A ARG 47.A N ALA 44.A O no hydrogen 3.256 N/A ASP 48.A N LEU 45.A O no hydrogen 2.644 N/A ALA 52.A N ASP 48.A O no hydrogen 3.334 N/A GLU 53.A N LYS 49.A O no hydrogen 3.234 N/A PHE 54.A N TYR 50.A O no hydrogen 3.008 N/A LEU 55.A N VAL 51.A O no hydrogen 2.850 N/A GLU 56.A N ALA 52.A O no hydrogen 2.939 N/A TRP 57.A N GLU 53.A O no hydrogen 3.135 N/A ALA 58.A N PHE 54.A O no hydrogen 2.928 N/A THR 62.A N ALA 58.A O no hydrogen 3.147 N/A THR 62.A OG1 ALA 58.A O no hydrogen 2.593 N/A GLN 63.A N LYS 59.A O no hydrogen 2.749 N/A VAL 65.A N PHE 61.A O no hydrogen 2.965 N/A LYS 66.A N THR 62.A O no hydrogen 3.176 N/A GLU 67.A N GLN 63.A O no hydrogen 3.059 N/A MET 68.A N LEU 64.A O no hydrogen 2.977 N/A GLN 69.A N VAL 65.A O no hydrogen 3.120 N/A HIS 71.A N ASP 74.A OD2 no hydrogen 3.158 N/A ARG 72.A NE TYR 149.A OH no hydrogen 3.473 N/A ASP 74.A N HIS 71.A O no hydrogen 3.149 N/A GLU 76.A N LYS 93.A O no hydrogen 3.057 N/A LYS 79.A N VAL 91.A O no hydrogen 3.099 N/A LYS 79.A NZ THR 366.A O no hydrogen 3.565 N/A LYS 79.A NZ THR 366.A OG1 no hydrogen 3.068 N/A ILE 81.A N VAL 89.A O no hydrogen 3.085 N/A GLU 88.A N ILE 105.A O no hydrogen 3.378 N/A VAL 89.A N GLY 82.A O no hydrogen 3.320 N/A ALA 90.A N MET 103.A O no hydrogen 3.058 N/A VAL 91.A N LYS 79.A O no hydrogen 2.777 N/A VAL 92.A N TYR 101.A O no hydrogen 3.009 N/A LYS 93.A N GLU 76.A O no hydrogen 3.072 N/A MET 94.A N ARG 99.A O no hydrogen 2.937 N/A LYS 95.A N ASP 74.A O no hydrogen 3.291 N/A LYS 95.A NZ GLU 73.A O no hydrogen 2.410 N/A THR 97.A OG1 MET 94.A O no hydrogen 2.670 N/A ARG 99.A N THR 97.A OG1 no hydrogen 3.272 N/A ARG 99.A NE TYR 101.A OH no hydrogen 3.272 N/A TYR 101.A N VAL 92.A O no hydrogen 3.017 N/A ALA 102.A N MET 152.A O no hydrogen 2.917 N/A MET 103.A N ALA 90.A O no hydrogen 2.949 N/A LYS 104.A N LEU 150.A O no hydrogen 2.997 N/A LYS 104.A NZ ASP 217.A OD2 no hydrogen 3.109 N/A ILE 105.A N GLU 88.A O no hydrogen 3.183 N/A LEU 106.A N LEU 148.A O no hydrogen 3.129 N/A LYS 108.A N ASN 146.A O no hydrogen 2.940 N/A LYS 108.A NZ GLN 143.A OE1 no hydrogen 3.326 N/A LYS 108.A NZ ASP 144.A O no hydrogen 2.586 N/A LYS 108.A NZ GLU 145.A O no hydrogen 3.402 N/A TRP 109.A NE1 ASN 146.A OD1 no hydrogen 3.232 N/A GLU 110.A N ASN 107.A OD1 no hydrogen 2.846 N/A MET 111.A N ASN 107.A O no hydrogen 3.229 N/A LEU 112.A N LYS 108.A O no hydrogen 3.066 N/A LYS 113.A N TRP 109.A O no hydrogen 3.032 N/A THR 117.A N ARG 114.A O no hydrogen 3.288 N/A THR 117.A OG1 ARG 114.A O no hydrogen 3.465 N/A ALA 118.A N ARG 114.A O no hydrogen 2.945 N/A CYS 119.A N GLY 219.A O no hydrogen 3.138 N/A CYS 119.A SG THR 117.A O no hydrogen 3.927 N/A PHE 120.A N ALA 118.A O no hydrogen 2.837 N/A GLU 122.A N GLU 122.A OE1 no hydrogen 2.598 N/A GLU 123.A N CYS 119.A O no hydrogen 3.129 N/A ARG 124.A N PHE 120.A O no hydrogen 3.341 N/A ARG 124.A NE PHE 381.A O no hydrogen 2.725 N/A ARG 124.A NH1 THR 382.A O no hydrogen 3.242 N/A ARG 124.A NH1 ASP 391.A OD2 no hydrogen 2.769 N/A ARG 124.A NH2 ASP 391.A OD2 no hydrogen 3.313 N/A ASP 125.A N ARG 121.A O no hydrogen 3.266 N/A VAL 126.A N GLU 122.A O no hydrogen 3.027 N/A LEU 127.A N GLU 123.A O no hydrogen 3.110 N/A VAL 128.A N ARG 124.A O no hydrogen 2.869 N/A ASN 129.A N ASP 125.A O no hydrogen 3.008 N/A ASN 129.A ND2 ASP 125.A O no hydrogen 2.680 N/A GLY 130.A N VAL 126.A O no hydrogen 2.691 N/A THR 136.A N LEU 215.A O no hydrogen 3.195 N/A ALA 137.A N TYR 155.A OH no hydrogen 3.122 N/A HIS 139.A N VAL 151.A O no hydrogen 2.912 N/A HIS 139.A NE2 ASP 153.A OD1 no hydrogen 2.677 N/A TYR 140.A N VAL 151.A O no hydrogen 3.217 N/A TYR 140.A OH GLU 386.A OE1 no hydrogen 2.718 N/A ALA 141.A N PHE 383.A O no hydrogen 2.635 N/A PHE 142.A N TYR 149.A O no hydrogen 3.141 N/A GLN 143.A NE2 PHE 378.A O no hydrogen 3.192 N/A ASP 144.A N HIS 147.A O no hydrogen 2.840 N/A ASN 146.A N ASP 144.A OD1 no hydrogen 3.049 N/A HIS 147.A N ASP 144.A OD1 no hydrogen 3.082 N/A HIS 147.A ND1 ASP 144.A OD1 no hydrogen 3.176 N/A LEU 148.A N LEU 106.A O no hydrogen 2.919 N/A TYR 149.A N PHE 142.A O no hydrogen 2.714 N/A TYR 149.A OH ASP 144.A OD2 no hydrogen 2.803 N/A LEU 150.A N LYS 104.A O no hydrogen 3.119 N/A VAL 151.A N TYR 140.A O no hydrogen 3.004 N/A MET 152.A N ALA 102.A O no hydrogen 2.706 N/A ASP 153.A N ALA 137.A O no hydrogen 2.794 N/A TYR 154.A OH ASP 365.A O no hydrogen 3.123 N/A LEU 160.A N VAL 205.A O no hydrogen 3.008 N/A LEU 161.A N PRO 202.A O no hydrogen 3.331 N/A THR 162.A N ASP 159.A OD1 no hydrogen 2.831 N/A LEU 164.A N LEU 160.A O no hydrogen 3.305 N/A LEU 164.A N LEU 161.A O no hydrogen 3.287 N/A PHE 167.A N LEU 164.A O no hydrogen 2.823 N/A GLU 168.A N SER 165.A O no hydrogen 3.043 N/A ASP 169.A N LEU 164.A O no hydrogen 2.487 N/A LYS 170.A NZ ASP 307.A OD1 no hydrogen 2.930 N/A LEU 171.A N MET 273.A O no hydrogen 2.909 N/A ALA 176.A N PRO 172.A O no hydrogen 2.889 N/A ARG 177.A N GLU 173.A O no hydrogen 2.895 N/A ARG 177.A NH1 PHE 340.A O no hydrogen 3.045 N/A PHE 178.A N MET 175.A O no hydrogen 3.135 N/A TYR 179.A N MET 175.A O no hydrogen 3.451 N/A ILE 180.A N ALA 176.A O no hydrogen 2.905 N/A GLY 181.A N ARG 177.A O no hydrogen 3.137 N/A GLU 182.A N PHE 178.A O no hydrogen 3.136 N/A MET 183.A N TYR 179.A O no hydrogen 2.997 N/A VAL 184.A N ILE 180.A O no hydrogen 3.032 N/A ALA 186.A N GLU 182.A O no hydrogen 3.136 N/A ILE 187.A N MET 183.A O no hydrogen 2.930 N/A ASP 188.A N VAL 184.A O no hydrogen 3.075 N/A SER 189.A N LEU 185.A O no hydrogen 3.079 N/A ILE 190.A N ALA 186.A O no hydrogen 3.293 N/A HIS 191.A N ILE 187.A O no hydrogen 3.066 N/A HIS 191.A NE2 ASP 262.A OD2 no hydrogen 2.701 N/A GLN 192.A N ASP 188.A O no hydrogen 2.842 N/A HIS 194.A N HIS 191.A O no hydrogen 2.894 N/A TYR 195.A N ILE 190.A O no hydrogen 3.264 N/A VAL 196.A N LEU 222.A O no hydrogen 3.062 N/A HIS 197.A N ASP 262.A OD2 no hydrogen 3.077 N/A HIS 197.A NE2 ALA 216.A O no hydrogen 3.211 N/A ARG 198.A N ASP 262.A OD1 no hydrogen 3.009 N/A ARG 198.A NE SER 220.A O no hydrogen 2.616 N/A ARG 198.A NH1 TYR 257.A OH no hydrogen 3.541 N/A ARG 198.A NH2 SER 220.A O no hydrogen 2.574 N/A ASP 199.A N HIS 197.A ND1 no hydrogen 2.948 N/A LYS 201.A NZ ASP 199.A OD2 no hydrogen 3.424 N/A LYS 201.A NZ THR 238.A OG1 no hydrogen 2.879 N/A ASN 204.A N LYS 201.A O no hydrogen 2.665 N/A ASN 204.A ND2 ASP 199.A O no hydrogen 2.674 N/A VAL 205.A N PRO 202.A O no hydrogen 3.366 N/A LEU 206.A N ARG 214.A O no hydrogen 2.948 N/A LEU 207.A N GLY 158.A O no hydrogen 3.141 N/A ASP 208.A N HIS 212.A O no hydrogen 2.948 N/A ASN 210.A N ASP 208.A OD1 no hydrogen 2.923 N/A GLY 211.A N ASP 208.A O no hydrogen 2.977 N/A HIS 212.A N ASP 208.A OD1 no hydrogen 2.741 N/A HIS 212.A ND1 GLU 182.A OE2 no hydrogen 3.112 N/A HIS 212.A NE2 LEU 352.A O no hydrogen 2.941 N/A ILE 213.A N GLU 182.A OE1 no hydrogen 3.096 N/A ARG 214.A N LEU 206.A O no hydrogen 2.881 N/A ARG 214.A NH1 ILE 135.A O no hydrogen 2.223 N/A LEU 215.A N TRP 134.A O no hydrogen 2.709 N/A CYS 221.A N PHE 218.A O no hydrogen 3.335 N/A CYS 221.A SG VAL 196.A O no hydrogen 4.036 N/A CYS 221.A SG PHE 218.A O no hydrogen 3.490 N/A LEU 222.A N VAL 196.A O no hydrogen 3.277 N/A MET 224.A N HIS 194.A O no hydrogen 2.848 N/A ASN 225.A N THR 229.A O no hydrogen 2.858 N/A VAL 230.A N TYR 257.A O no hydrogen 3.043 N/A SER 232.A N GLY 255.A O no hydrogen 3.285 N/A SER 232.A OG TYR 257.A OH no hydrogen 2.481 N/A TYR 241.A N THR 238.A O no hydrogen 2.917 N/A TYR 241.A OH GLU 272.A OE1 no hydrogen 3.254 N/A TYR 241.A OH GLU 272.A OE2 no hydrogen 2.818 N/A ILE 242.A N PRO 239.A O no hydrogen 3.242 N/A LEU 247.A N SER 243.A O no hydrogen 3.278 N/A GLN 248.A N PRO 244.A O no hydrogen 2.783 N/A ALA 249.A N GLU 245.A O no hydrogen 3.129 N/A MET 250.A N ILE 246.A O no hydrogen 3.281 N/A GLU 251.A N LEU 247.A O no hydrogen 3.148 N/A GLU 251.A N GLN 248.A O no hydrogen 2.723 N/A ASP 252.A N GLN 248.A O no hydrogen 2.753 N/A TYR 257.A N VAL 230.A O no hydrogen 3.140 N/A TYR 257.A OH SER 232.A OG no hydrogen 2.481 N/A GLY 258.A N GLU 260.A OE2 no hydrogen 2.767 N/A CYS 261.A SG GLY 258.A O no hydrogen 3.521 N/A CYS 261.A SG ASP 262.A OD1 no hydrogen 3.807 N/A TRP 264.A N GLU 260.A O no hydrogen 3.451 N/A SER 265.A N CYS 261.A O no hydrogen 3.403 N/A SER 265.A OG TYR 241.A O no hydrogen 2.613 N/A SER 265.A OG CYS 261.A O no hydrogen 3.314 N/A LEU 266.A N ASP 262.A O no hydrogen 3.100 N/A GLY 267.A N TRP 263.A O no hydrogen 3.291 N/A VAL 268.A N TRP 264.A O no hydrogen 3.152 N/A CYS 269.A N SER 265.A O no hydrogen 2.961 N/A CYS 269.A SG SER 265.A O no hydrogen 3.172 N/A MET 270.A N LEU 266.A O no hydrogen 2.941 N/A TYR 271.A N GLY 267.A O no hydrogen 3.061 N/A GLU 272.A N VAL 268.A O no hydrogen 3.056 N/A MET 273.A N CYS 269.A O no hydrogen 2.926 N/A LEU 274.A N MET 270.A O no hydrogen 3.195 N/A TYR 275.A N TYR 271.A O no hydrogen 2.929 N/A GLY 276.A N GLU 272.A O no hydrogen 3.089 N/A THR 288.A N SER 284.A O no hydrogen 3.107 N/A THR 288.A OG1 SER 284.A O no hydrogen 2.715 N/A TYR 289.A N LEU 285.A O no hydrogen 3.205 N/A GLY 290.A N VAL 286.A O no hydrogen 2.938 N/A LYS 291.A N GLU 287.A O no hydrogen 2.865 N/A ILE 292.A N THR 288.A O no hydrogen 2.959 N/A MET 293.A N TYR 289.A O no hydrogen 3.080 N/A ASN 294.A ND2 ASN 294.A O no hydrogen 2.368 N/A HIS 295.A N ILE 292.A O no hydrogen 3.277 N/A GLU 297.A N ASN 294.A O no hydrogen 2.493 N/A ARG 298.A N HIS 295.A O no hydrogen 3.130 N/A PHE 299.A N HIS 295.A O no hydrogen 2.846 N/A SER 309.A N GLU 173.A OE1 no hydrogen 2.640 N/A SER 309.A OG GLU 173.A OE2 no hydrogen 1.806 N/A GLU 311.A N GLU 311.A OE1 no hydrogen 2.300 N/A LYS 313.A N SER 309.A O no hydrogen 3.251 N/A LYS 313.A NZ GLU 310.A OE1 no hydrogen 3.266 N/A ASP 314.A N GLU 310.A O no hydrogen 2.844 N/A LEU 315.A N GLU 311.A O no hydrogen 3.048 N/A ILE 316.A N ALA 312.A O no hydrogen 2.949 N/A GLN 317.A N LYS 313.A O no hydrogen 3.029 N/A ARG 318.A N ASP 314.A O no hydrogen 3.100 N/A LEU 319.A N ILE 316.A O no hydrogen 3.114 N/A ILE 320.A N ILE 316.A O no hydrogen 2.896 N/A CYS 321.A SG GLN 317.A O no hydrogen 3.338 N/A CYS 321.A SG SER 322.A O no hydrogen 3.580 N/A ARG 326.A N ARG 323.A O no hydrogen 3.274 N/A ARG 326.A NH1 GLU 245.A OE1 no hydrogen 3.390 N/A ARG 326.A NH1 GLU 245.A OE2 no hydrogen 3.321 N/A ARG 326.A NH1 GLU 260.A O no hydrogen 2.764 N/A ARG 326.A NH2 GLU 245.A OE2 no hydrogen 3.085 N/A ARG 326.A NH2 CYS 321.A O no hydrogen 2.696 N/A LEU 327.A N ARG 318.A O no hydrogen 3.096 N/A GLY 328.A N ASP 334.A OD2 no hydrogen 3.113 N/A GLN 329.A NE2 GLU 324.A O no hydrogen 2.682 N/A GLN 329.A NE2 ARG 326.A O no hydrogen 2.892 N/A ASN 330.A N ASP 334.A OD2 no hydrogen 3.213 N/A GLY 331.A N GLY 328.A O no hydrogen 3.287 N/A ASP 334.A N GLY 331.A O no hydrogen 3.352 N/A LYS 336.A N ILE 332.A O no hydrogen 3.012 N/A LYS 337.A N GLU 333.A O no hydrogen 3.248 N/A HIS 338.A N PHE 335.A O no hydrogen 2.796 N/A PHE 340.A N HIS 338.A ND1 no hydrogen 3.341 N/A PHE 341.A N HIS 338.A O no hydrogen 3.249 N/A GLU 342.A N ALA 339.A O no hydrogen 3.170 N/A LEU 344.A N PHE 341.A O no hydrogen 3.111 N/A ASN 351.A N ASN 348.A O no hydrogen 3.025 N/A ASN 351.A ND2 ASN 348.A OD1 no hydrogen 3.164 N/A SER 361.A N ASP 365.A OD1 no hydrogen 3.012 N/A SER 364.A N SER 362.A OG no hydrogen 3.003 N/A SER 364.A OG SER 364.A O no hydrogen 2.296 N/A ASP 365.A N SER 362.A O no hydrogen 3.467 N/A SER 367.A N ASP 365.A OD2 no hydrogen 2.758 N/A SER 367.A OG ASP 365.A OD2 no hydrogen 2.213 N/A ASN 368.A ND2 VAL 156.A O no hydrogen 3.211 N/A ASN 368.A ND2 ASP 359.A O no hydrogen 3.314 N/A PHE 378.A N HIS 375.A O no hydrogen 3.358 N/A ILE 379.A N LEU 376.A O no hydrogen 3.356 N/A GLY 380.A N ASP 31.A OD2 no hydrogen 3.040 N/A PHE 381.A N PHE 378.A O no hydrogen 3.249 N/A THR 382.A N ASP 31.A OD2 no hydrogen 3.376 N/A THR 382.A OG1 ASP 31.A OD1 no hydrogen 3.047 N/A THR 382.A OG1 ASP 31.A OD2 no hydrogen 3.291 N/A PHE 383.A N ALA 141.A O no hydrogen 2.983 N/A THR 385.A N HIS 139.A O no hydrogen 2.825 N/A ARG 392.A NE VAL 128.A O no hydrogen 3.143 N/A GLY 393.A N SER 390.A OG no hydrogen 3.344 N/A SER 394.A OG LEU 395.A O no hydrogen 3.439 N/A LEU 395.A N LEU 14.A O no hydrogen 3.205 N/A