Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8ppu_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 12.A NE1 VAL 16.A O no hydrogen 2.612 N/A ASN 13.A N ASN 209.A O no hydrogen 2.910 N/A ASN 13.A ND2 GLY 210.A O no hydrogen 3.151 N/A SER 15.A N ASN 13.A OD1 no hydrogen 3.257 N/A SER 15.A OG ASN 13.A OD1 no hydrogen 3.106 N/A VAL 16.A N ASN 13.A O no hydrogen 3.309 N/A LYS 23.A NZ LYS 225.A O no hydrogen 3.387 N/A GLU 26.A N ARG 315.A O no hydrogen 3.017 N/A LYS 28.A N VAL 313.A O no hydrogen 2.897 N/A VAL 31.A N SER 309.A OG no hydrogen 3.014 N/A ARG 32.A NH2 ILE 307.A O no hydrogen 2.927 N/A SER 45.A N ASN 43.A OD1 no hydrogen 2.470 N/A GLU 54.A N GLU 50.A O no hydrogen 2.941 N/A ALA 55.A N ILE 51.A O no hydrogen 2.888 N/A TYR 56.A N ILE 52.A O no hydrogen 2.960 N/A TYR 56.A OH ILE 367.A O no hydrogen 3.200 N/A ALA 57.A N VAL 53.A O no hydrogen 2.954 N/A SER 58.A N GLU 54.A O no hydrogen 2.903 N/A SER 58.A OG PRO 371.A O no hydrogen 2.901 N/A LEU 59.A N ALA 55.A O no hydrogen 2.916 N/A PHE 60.A N TYR 56.A O no hydrogen 3.015 N/A LYS 61.A N ALA 57.A O no hydrogen 2.907 N/A SER 62.A N SER 58.A O no hydrogen 2.917 N/A ARG 63.A N LEU 59.A O no hydrogen 2.944 N/A ARG 63.A NE ASP 373.A OD2 no hydrogen 3.096 N/A ARG 63.A NH1 ASP 142.A O no hydrogen 3.128 N/A ARG 63.A NH1 PRO 359.A O no hydrogen 2.913 N/A LEU 64.A N PHE 60.A O no hydrogen 2.969 N/A SER 65.A N LYS 61.A O no hydrogen 2.921 N/A LYS 66.A N SER 62.A O no hydrogen 2.884 N/A LYS 66.A NZ ASP 373.A O no hydrogen 2.474 N/A LYS 66.A NZ GLU 378.A OE2 no hydrogen 3.114 N/A LEU 67.A N ARG 63.A O no hydrogen 2.968 N/A LYS 68.A N LEU 64.A O no hydrogen 2.910 N/A ASN 74.A ND2 GLU 76.A OE1 no hydrogen 2.968 N/A ILE 77.A N ASN 74.A O no hydrogen 3.377 N/A VAL 81.A N THR 96.A O no hydrogen 3.138 N/A GLY 84.A N ASP 82.A OD1 no hydrogen 3.084 N/A GLY 84.A N THR 119.A OG1 no hydrogen 2.832 N/A ASP 92.A N ASP 92.A OD1 no hydrogen 2.484 N/A THR 96.A N ASN 79.A O no hydrogen 3.014 N/A THR 96.A OG1 SER 78.A O no hydrogen 3.022 N/A THR 96.A OG1 ASN 79.A O no hydrogen 2.744 N/A ILE 97.A N PHE 147.A O no hydrogen 3.058 N/A GLY 99.A N VAL 145.A O no hydrogen 3.453 N/A LEU 100.A N GLU 116.A O no hydrogen 2.642 N/A VAL 101.A N ALA 143.A O no hydrogen 3.208 N/A LYS 104.A NZ PHE 137.A O no hydrogen 2.840 N/A ARG 105.A N ILE 112.A O no hydrogen 3.095 N/A THR 107.A N GLY 110.A O no hydrogen 2.655 N/A THR 107.A OG1 ASN 108.A OD1 no hydrogen 3.545 N/A ILE 112.A N ARG 105.A O no hydrogen 3.433 N/A PHE 113.A N VAL 124.A O no hydrogen 2.938 N/A GLU 116.A N LEU 100.A O no hydrogen 2.979 N/A ASP 117.A N GLY 120.A O no hydrogen 3.244 N/A THR 119.A N ASP 117.A OD1 no hydrogen 3.269 N/A THR 119.A OG1 ASP 82.A OD1 no hydrogen 2.287 N/A THR 119.A OG1 ASP 117.A OD2 no hydrogen 3.509 N/A VAL 122.A N VAL 115.A O no hydrogen 2.909 N/A PHE 125.A N PHE 157.A O no hydrogen 3.280 N/A LEU 126.A N LEU 111.A O no hydrogen 3.182 N/A LYS 128.A N ARG 109.A O no hydrogen 2.821 N/A LYS 128.A NZ THR 107.A O no hydrogen 3.426 N/A LYS 128.A NZ ASN 108.A O no hydrogen 3.262 N/A SER 130.A N PRO 127.A O no hydrogen 3.128 N/A SER 130.A OG PRO 127.A O no hydrogen 2.960 N/A GLU 131.A N GLU 131.A OE1 no hydrogen 2.458 N/A TYR 133.A N SER 130.A O no hydrogen 3.271 N/A ALA 136.A N ASP 132.A O no hydrogen 3.328 N/A PHE 137.A N ARG 134.A O no hydrogen 3.433 N/A ASP 142.A N VAL 101.A O no hydrogen 2.906 N/A VAL 145.A N GLY 99.A O no hydrogen 3.353 N/A ALA 146.A N TYR 163.A O no hydrogen 3.332 N/A PHE 147.A N ILE 97.A O no hydrogen 3.046 N/A LYS 148.A N LYS 161.A O no hydrogen 3.523 N/A LYS 148.A NZ SER 78.A O no hydrogen 3.367 N/A PHE 150.A N PHE 158.A O no hydrogen 2.738 N/A LYS 153.A NZ ASN 87.A O no hydrogen 3.313 N/A LYS 153.A NZ VAL 89.A O no hydrogen 2.864 N/A LYS 154.A N SER 152.A OG no hydrogen 2.862 N/A PHE 157.A N LYS 123.A O no hydrogen 3.150 N/A ALA 159.A N PHE 125.A O no hydrogen 3.253 N/A ASN 160.A N LYS 148.A O no hydrogen 2.782 N/A ASN 160.A ND2 GLU 94.A OE2 no hydrogen 3.451 N/A LYS 161.A N LYS 148.A O no hydrogen 3.262 N/A TYR 163.A N ALA 146.A O no hydrogen 3.035 N/A ASP 166.A N LYS 353.A O no hydrogen 3.076 N/A VAL 167.A N ASP 166.A OD1 no hydrogen 3.009 N/A ARG 171.A NE ARG 398.A O no hydrogen 3.293 N/A ARG 171.A NH2 ARG 398.A O no hydrogen 3.158 N/A LEU 177.A N GLU 433.A OE2 no hydrogen 2.562 N/A LYS 180.A NZ ASP 431.A OD2 no hydrogen 2.929 N/A ALA 183.A N VAL 430.A O no hydrogen 3.161 N/A ILE 186.A N ILE 228.A O no hydrogen 3.045 N/A SER 187.A OG SER 405.A OG no hydrogen 2.242 N/A ASP 188.A N GLY 231.A O no hydrogen 3.049 N/A HIS 190.A N ASP 232.A O no hydrogen 2.960 N/A HIS 190.A ND1 ASP 235.A OD1 no hydrogen 3.006 N/A VAL 191.A N VAL 233.A O no hydrogen 3.242 N/A SER 193.A OG ASP 235.A OD2 no hydrogen 3.169 N/A ARG 194.A N ASP 246.A O no hydrogen 3.326 N/A ARG 194.A NE SER 245.A O no hydrogen 3.310 N/A ARG 194.A NH2 SER 245.A O no hydrogen 2.765 N/A CYS 197.A SG GLU 195.A O no hydrogen 3.877 N/A LEU 202.A N GLU 198.A O no hydrogen 2.913 N/A LYS 203.A N LYS 199.A O no hydrogen 2.909 N/A PHE 204.A N ALA 200.A O no hydrogen 2.910 N/A LEU 205.A N PHE 201.A O no hydrogen 2.900 N/A GLU 206.A N LEU 202.A O no hydrogen 2.900 N/A TRP 207.A N LYS 203.A O no hydrogen 2.872 N/A TRP 207.A NE1 GLU 217.A OE1 no hydrogen 2.953 N/A LEU 208.A N PHE 204.A O no hydrogen 2.946 N/A ASN 209.A N GLU 206.A O no hydrogen 3.070 N/A ASN 209.A ND2 LEU 205.A O no hydrogen 2.911 N/A ASN 209.A ND2 ASN 265.A O no hydrogen 3.386 N/A GLY 210.A N TRP 207.A O no hydrogen 3.382 N/A HIS 211.A N GLU 206.A O no hydrogen 3.260 N/A VAL 212.A N GLY 210.A O no hydrogen 2.916 N/A LYS 215.A NZ GLU 218.A OE1 no hydrogen 3.525 N/A GLU 217.A N SER 214.A OG no hydrogen 3.279 N/A GLU 218.A N SER 214.A O no hydrogen 2.989 N/A GLU 219.A N LYS 215.A O no hydrogen 2.909 N/A ILE 220.A N GLU 216.A O no hydrogen 2.928 N/A VAL 221.A N GLU 217.A O no hydrogen 2.830 N/A SER 222.A N GLU 218.A O no hydrogen 2.951 N/A SER 222.A OG THR 17.A O no hydrogen 3.292 N/A ARG 223.A N ILE 220.A O no hydrogen 2.925 N/A ARG 223.A NH1 LYS 180.A O no hydrogen 2.929 N/A ARG 223.A NH2 GLU 219.A OE2 no hydrogen 3.495 N/A VAL 224.A N VAL 221.A O no hydrogen 3.323 N/A LYS 225.A N TYR 182.A O no hydrogen 2.936 N/A TYR 226.A OH HIS 317.A NE2 no hydrogen 3.085 N/A ILE 228.A N ILE 184.A O no hydrogen 2.927 N/A ILE 229.A N PHE 273.A O no hydrogen 2.971 N/A ALA 230.A N ILE 186.A O no hydrogen 3.040 N/A ASP 235.A N VAL 191.A O no hydrogen 2.943 N/A GLY 236.A N GLN 255.A OE1 no hydrogen 3.015 N/A ILE 239.A N GLN 243.A OE1 no hydrogen 2.939 N/A GLN 243.A NE2 ASP 235.A O no hydrogen 3.605 N/A SER 245.A OG ASP 246.A OD1 no hydrogen 3.119 N/A ASP 246.A N GLN 243.A O no hydrogen 2.705 N/A VAL 248.A N GLY 192.A O no hydrogen 3.102 N/A ILE 249.A N GLY 192.A O no hydrogen 3.392 N/A ASP 251.A N ILE 249.A O no hydrogen 2.689 N/A GLN 255.A N ASP 251.A O no hydrogen 2.750 N/A GLN 255.A NE2 GLY 236.A O no hydrogen 3.328 N/A GLN 255.A NE2 ILE 249.A O no hydrogen 3.098 N/A TYR 256.A N ILE 252.A O no hydrogen 3.002 N/A GLU 257.A N PHE 253.A O no hydrogen 2.895 N/A ALA 258.A N ASP 254.A O no hydrogen 2.897 N/A LEU 259.A N GLN 255.A O no hydrogen 2.964 N/A ALA 260.A N TYR 256.A O no hydrogen 2.896 N/A ASN 261.A N GLU 257.A O no hydrogen 2.912 N/A LEU 262.A N ALA 258.A O no hydrogen 2.942 N/A LEU 263.A N LEU 259.A O no hydrogen 3.181 N/A ALA 264.A N ALA 260.A O no hydrogen 3.266 N/A ASN 265.A N LEU 262.A O no hydrogen 3.449 N/A ASN 265.A ND2 VAL 8.A O no hydrogen 3.687 N/A ILE 270.A N PRO 267.A O no hydrogen 3.198 N/A MET 272.A N ASN 304.A O no hydrogen 3.047 N/A PHE 273.A N LEU 227.A O no hydrogen 3.016 N/A ILE 274.A N ILE 306.A O no hydrogen 3.058 N/A GLY 275.A N ILE 229.A O no hydrogen 3.228 N/A ALA 279.A N ASP 232.A OD1 no hydrogen 3.107 N/A ALA 281.A N TYR 256.A OH no hydrogen 2.678 N/A ARG 283.A NH1 PRO 287.A O no hydrogen 3.108 N/A ILE 286.A N PRO 366.A O no hydrogen 3.418 N/A GLN 288.A N ASN 310.A O no hydrogen 3.189 N/A GLN 288.A NE2 GLY 277.A O no hydrogen 3.190 N/A GLN 288.A NE2 ARG 283.A O no hydrogen 2.955 N/A TYR 292.A N ALA 281.A O no hydrogen 3.190 N/A GLU 294.A N GLU 294.A OE1 no hydrogen 2.713 N/A TYR 295.A N TYR 292.A O no hydrogen 3.119 N/A ALA 296.A N TYR 292.A O no hydrogen 3.012 N/A TYR 300.A N ALA 296.A O no hydrogen 3.446 N/A LYS 301.A N LYS 297.A O no hydrogen 2.935 N/A ASN 304.A N ASN 304.A OD1 no hydrogen 2.431 N/A ASN 304.A ND2 ILE 270.A O no hydrogen 2.755 N/A ILE 306.A N MET 272.A O no hydrogen 2.904 N/A ILE 308.A N ILE 274.A O no hydrogen 2.808 N/A SER 309.A N ASP 30.A OD1 no hydrogen 3.104 N/A SER 309.A OG ASP 30.A OD1 no hydrogen 2.951 N/A SER 309.A OG PRO 311.A O no hydrogen 3.458 N/A ASN 310.A N GLN 288.A O no hydrogen 3.288 N/A ASN 310.A ND2 PRO 276.A O no hydrogen 3.561 N/A ALA 312.A N ILE 323.A O no hydrogen 3.130 N/A ILE 314.A N PHE 321.A O no hydrogen 2.835 N/A ARG 315.A N GLU 26.A O no hydrogen 2.958 N/A ARG 315.A NE ASP 320.A OD1 no hydrogen 2.891 N/A ARG 315.A NH2 ASP 320.A OD1 no hydrogen 3.452 N/A ARG 315.A NH2 ASP 320.A OD2 no hydrogen 2.853 N/A LEU 316.A N ARG 319.A O no hydrogen 2.940 N/A HIS 317.A N ASN 24.A O no hydrogen 3.280 N/A HIS 317.A NE2 TYR 226.A OH no hydrogen 3.085 N/A ARG 319.A N LEU 316.A O no hydrogen 2.919 N/A ARG 319.A NE GLU 433.A O no hydrogen 3.261 N/A ARG 319.A NH1 HIS 317.A O no hydrogen 2.744 N/A ARG 319.A NH2 PRO 175.A O no hydrogen 2.979 N/A ARG 319.A NH2 GLU 433.A O no hydrogen 3.410 N/A PHE 321.A N ILE 314.A O no hydrogen 2.665 N/A LEU 322.A N LEU 383.A O no hydrogen 2.955 N/A ILE 323.A N ALA 312.A O no hydrogen 2.838 N/A ALA 324.A N GLN 385.A O no hydrogen 3.230 N/A HIS 325.A ND1 ALA 230.A O no hydrogen 2.883 N/A ILE 329.A N GLY 326.A O no hydrogen 3.457 N/A VAL 333.A N ILE 329.A O no hydrogen 2.951 N/A SER 334.A N GLU 330.A O no hydrogen 2.907 N/A SER 334.A OG GLU 330.A O no hydrogen 3.539 N/A PHE 335.A N ASP 331.A O no hydrogen 2.924 N/A VAL 336.A N VAL 332.A O no hydrogen 3.060 N/A LYS 343.A N THR 340.A O no hydrogen 3.285 N/A GLY 345.A N ASP 393.A OD2 no hydrogen 3.410 N/A MET 348.A N PRO 344.A O no hydrogen 3.219 N/A VAL 349.A N GLY 345.A O no hydrogen 2.926 N/A GLU 350.A N LEU 346.A O no hydrogen 2.937 N/A LEU 351.A N PRO 347.A O no hydrogen 2.922 N/A LEU 352.A N MET 348.A O no hydrogen 2.934 N/A LYS 353.A N VAL 349.A O no hydrogen 2.892 N/A LYS 353.A NZ GLU 135.A OE1 no hydrogen 2.876 N/A MET 354.A N GLU 350.A O no hydrogen 2.960 N/A ARG 355.A N LEU 352.A O no hydrogen 3.109 N/A ARG 355.A NE ILE 377.A O no hydrogen 3.027 N/A ARG 355.A NH1 ASP 166.A O no hydrogen 3.090 N/A ARG 355.A NH2 ILE 377.A O no hydrogen 3.140 N/A ARG 355.A NH2 GLU 378.A O no hydrogen 3.142 N/A PHE 361.A N ASP 142.A OD2 no hydrogen 2.736 N/A LYS 364.A N ASP 331.A OD1 no hydrogen 3.268 N/A ALA 368.A N ILE 286.A O no hydrogen 3.481 N/A ASP 370.A N ALA 368.A O no hydrogen 2.992 N/A LEU 375.A N ASP 373.A OD1 no hydrogen 3.017 N/A ILE 377.A N ARG 355.A O no hydrogen 3.339 N/A ASP 382.A N ASP 320.A O no hydrogen 3.018 N/A LEU 383.A N ASP 320.A O no hydrogen 3.123 N/A VAL 384.A N GLN 401.A O no hydrogen 2.946 N/A GLN 385.A N LEU 322.A O no hydrogen 3.180 N/A GLN 385.A NE2 SER 405.A OG no hydrogen 3.420 N/A GLY 387.A N HIS 325.A O no hydrogen 2.384 N/A HIS 388.A N ASP 188.A OD1 no hydrogen 3.127 N/A HIS 390.A NE2 ASP 188.A OD2 no hydrogen 2.957 N/A TYR 392.A N THR 423.A OG1 no hydrogen 3.272 N/A ALA 394.A N ASP 393.A OD1 no hydrogen 2.638 N/A VAL 395.A N LEU 402.A O no hydrogen 3.123 N/A TYR 397.A N VAL 400.A O no hydrogen 3.049 N/A TYR 397.A OH ASP 166.A OD1 no hydrogen 3.153 N/A ARG 398.A NH1 VAL 167.A O no hydrogen 2.796 N/A VAL 400.A N TYR 397.A O no hydrogen 3.351 N/A GLN 401.A N ASP 382.A O no hydrogen 3.338 N/A GLN 401.A NE2 VAL 395.A O no hydrogen 2.591 N/A LEU 402.A N VAL 395.A O no hydrogen 3.016 N/A VAL 403.A N VAL 384.A O no hydrogen 2.838 N/A ASN 404.A N ASP 393.A O no hydrogen 3.151 N/A SER 405.A N MET 386.A O no hydrogen 3.197 N/A SER 405.A OG SER 187.A OG no hydrogen 2.242 N/A SER 405.A OG MET 386.A O no hydrogen 3.138 N/A THR 407.A OG1 ASP 188.A O no hydrogen 3.245 N/A THR 407.A OG1 GLN 409.A O no hydrogen 3.553 N/A TRP 408.A N ASP 188.A O no hydrogen 3.311 N/A GLN 409.A N THR 407.A OG1 no hydrogen 2.692 N/A GLN 409.A NE2 SER 193.A OG no hydrogen 3.282 N/A ALA 410.A N GLU 195.A O no hydrogen 2.917 N/A THR 412.A OG1 GLU 195.A OE1 no hydrogen 2.638 N/A THR 412.A OG1 GLU 413.A OE1 no hydrogen 2.517 N/A GLU 413.A N THR 412.A OG1 no hydrogen 2.775 N/A GLU 413.A N GLU 413.A OE1 no hydrogen 2.580 N/A LYS 416.A N THR 412.A O no hydrogen 3.130 N/A MET 417.A N GLU 413.A O no hydrogen 2.896 N/A VAL 418.A N PHE 414.A O no hydrogen 2.887 N/A ASN 419.A N LYS 416.A O no hydrogen 3.297 N/A ILE 420.A N GLN 415.A O no hydrogen 2.772 N/A THR 423.A N HIS 390.A O no hydrogen 3.134 N/A THR 423.A OG1 THR 423.A O no hydrogen 2.429 N/A ALA 425.A N THR 407.A O no hydrogen 2.997 N/A VAL 427.A N LEU 441.A O no hydrogen 3.415 N/A VAL 429.A N LYS 439.A O no hydrogen 2.860 N/A VAL 430.A N ALA 183.A O no hydrogen 3.134 N/A ASP 431.A N ARG 436.A O no hydrogen 3.050 N/A VAL 432.A N VAL 181.A O no hydrogen 3.014 N/A GLU 433.A N ASP 431.A OD1 no hydrogen 3.138 N/A ARG 436.A NH1 SER 434.A O no hydrogen 3.279 N/A VAL 437.A N GLN 401.A OE1 no hydrogen 3.016 N/A VAL 438.A N VAL 429.A O no hydrogen 3.042 N/A LEU 441.A N VAL 427.A O no hydrogen 2.853 N/A PHE 443.A N ALA 425.A O no hydrogen 3.045 N/A SER 444.A N ASP 442.A OD1 no hydrogen 3.072 N/A