Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8rty_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 1.A N HIS 95.A ND1 no hydrogen 3.242 N/A LEU 3.A N PRO 96.A O no hydrogen 2.679 N/A VAL 4.A N GLY 15.A O no hydrogen 3.398 N/A VAL 5.A N LEU 98.A O no hydrogen 3.211 N/A ASP 6.A N LYS 13.A O no hydrogen 2.628 N/A CYS 12.A SG PHE 26.A O no hydrogen 3.154 N/A LYS 13.A N ASP 6.A O no hydrogen 2.928 N/A LYS 13.A NZ MET 11.A O no hydrogen 2.906 N/A ALA 14.A N ALA 24.A O no hydrogen 3.296 N/A GLY 15.A N VAL 4.A O no hydrogen 2.993 N/A ALA 17.A N ALA 2.A O no hydrogen 3.125 N/A ALA 24.A N ALA 14.A O no hydrogen 3.145 N/A VAL 30.A N LYS 63.A O no hydrogen 3.220 N/A GLY 31.A N TYR 48.A O no hydrogen 3.447 N/A ARG 32.A NH1 ASP 75.A OD2 no hydrogen 2.822 N/A ARG 32.A NH2 ASP 75.A OD1 no hydrogen 2.324 N/A MET 42.A N VAL 40.A O no hydrogen 3.052 N/A GLN 44.A NE2 VAL 40.A O no hydrogen 3.155 N/A TYR 48.A N GLY 31.A O no hydrogen 3.332 N/A ALA 53.A N GLY 50.A O no hydrogen 3.210 N/A SER 55.A N ASP 51.A O no hydrogen 3.089 N/A SER 55.A OG ASP 51.A O no hydrogen 3.391 N/A SER 55.A OG GLU 52.A O no hydrogen 2.424 N/A LYS 56.A N GLU 52.A O no hydrogen 3.371 N/A ARG 57.A N GLN 54.A O no hydrogen 3.445 N/A ARG 57.A NH1 GLN 54.A OE1 no hydrogen 3.296 N/A ILE 59.A N LYS 56.A O no hydrogen 3.431 N/A THR 61.A N ARG 32.A O no hydrogen 2.940 N/A THR 61.A OG1 ARG 32.A O no hydrogen 2.996 N/A LYS 63.A N VAL 30.A O no hydrogen 3.224 N/A LYS 63.A NZ TYR 64.A O no hydrogen 3.170 N/A LYS 63.A NZ THR 71.A OG1 no hydrogen 2.953 N/A TYR 64.A OH GLU 201.A OE2 no hydrogen 2.905 N/A GLU 67.A N ILE 69.A O no hydrogen 2.847 N/A ILE 69.A N GLU 67.A O no hydrogen 2.735 N/A THR 71.A N PRO 65.A O no hydrogen 3.265 N/A ASP 74.A N ASN 72.A OD1 no hydrogen 2.963 N/A LYS 78.A N ASP 75.A O no hydrogen 3.209 N/A ILE 79.A N MET 76.A O no hydrogen 3.081 N/A TRP 80.A N MET 76.A O no hydrogen 3.281 N/A HIS 81.A N GLU 77.A O no hydrogen 2.914 N/A HIS 82.A N LYS 78.A O no hydrogen 2.771 N/A THR 83.A N ILE 79.A O no hydrogen 2.726 N/A THR 83.A OG1 ILE 79.A O no hydrogen 2.426 N/A PHE 84.A N TRP 80.A O no hydrogen 3.275 N/A TYR 85.A N HIS 81.A O no hydrogen 3.427 N/A ASN 86.A N HIS 82.A O no hydrogen 2.999 N/A GLU 87.A N THR 83.A O no hydrogen 3.323 N/A LEU 88.A N THR 83.A O no hydrogen 3.049 N/A VAL 90.A N PHE 84.A O no hydrogen 3.034 N/A GLU 93.A N GLU 93.A OE1 no hydrogen 2.747 N/A VAL 97.A N ALA 125.A O no hydrogen 3.369 N/A LEU 98.A N LEU 3.A O no hydrogen 2.826 N/A LEU 99.A N TYR 127.A O no hydrogen 2.971 N/A GLU 101.A N ALA 129.A O no hydrogen 2.970 N/A ASN 109.A N PRO 106.A O no hydrogen 3.225 N/A ARG 110.A NE GLU 101.A OE1 no hydrogen 2.725 N/A ARG 110.A NH2 GLU 101.A OE1 no hydrogen 2.814 N/A ARG 110.A NH2 PHE 369.A OXT no hydrogen 3.285 N/A GLU 111.A N LYS 107.A O no hydrogen 3.228 N/A LYS 112.A N ASN 109.A O no hydrogen 3.128 N/A MET 113.A N ASN 109.A O no hydrogen 3.388 N/A THR 114.A OG1 GLU 111.A O no hydrogen 2.602 N/A GLN 115.A N GLU 111.A O no hydrogen 3.067 N/A ILE 116.A N LYS 112.A O no hydrogen 3.297 N/A MET 117.A N MET 113.A O no hydrogen 3.373 N/A PHE 118.A N THR 114.A O no hydrogen 3.140 N/A GLU 119.A N ILE 116.A O no hydrogen 2.823 N/A THR 120.A N ILE 116.A O no hydrogen 2.432 N/A THR 120.A OG1 ILE 116.A O no hydrogen 3.364 N/A THR 123.A N MET 117.A O no hydrogen 3.380 N/A MET 126.A N ILE 351.A O no hydrogen 3.223 N/A TYR 127.A N VAL 97.A O no hydrogen 3.324 N/A ALA 129.A N LEU 99.A O no hydrogen 2.824 N/A LEU 134.A N ILE 130.A O no hydrogen 3.269 N/A SER 135.A N GLN 131.A O no hydrogen 3.218 N/A SER 135.A OG GLN 131.A O no hydrogen 2.926 N/A LEU 136.A N ALA 132.A O no hydrogen 3.435 N/A ALA 138.A N LEU 134.A O no hydrogen 3.318 N/A GLY 140.A N TYR 137.A O no hydrogen 3.041 N/A THR 142.A OG1 GLU 161.A OE1 no hydrogen 3.481 N/A THR 143.A OG1 GLU 161.A OE2 no hydrogen 2.984 N/A GLY 144.A N ILE 159.A O no hydrogen 2.749 N/A ILE 145.A N ASN 290.A O no hydrogen 3.297 N/A VAL 146.A N VAL 157.A O no hydrogen 3.319 N/A MET 147.A N VAL 292.A O no hydrogen 2.628 N/A ASP 148.A N HIS 155.A O no hydrogen 3.127 N/A SER 149.A N SER 294.A O no hydrogen 3.366 N/A SER 149.A OG SER 294.A O no hydrogen 3.562 N/A GLY 150.A N VAL 153.A O no hydrogen 3.024 N/A THR 154.A N LEU 172.A O no hydrogen 2.932 N/A THR 154.A OG1 LEU 174.A O no hydrogen 2.459 N/A HIS 155.A N ASP 148.A O no hydrogen 3.037 N/A THR 156.A N LEU 170.A O no hydrogen 3.331 N/A VAL 157.A N VAL 146.A O no hydrogen 3.328 N/A ILE 159.A N GLY 144.A O no hydrogen 2.737 N/A TYR 160.A N TYR 163.A O no hydrogen 2.910 N/A GLU 161.A N THR 143.A OG1 no hydrogen 2.542 N/A GLY 162.A N THR 142.A O no hydrogen 3.288 N/A TYR 163.A N TYR 160.A O no hydrogen 3.155 N/A ILE 169.A N PRO 166.A O no hydrogen 3.491 N/A ARG 171.A NH1 PRO 103.A O no hydrogen 2.936 N/A ARG 171.A NH1 ASN 105.A OD1 no hydrogen 2.354 N/A LEU 172.A N THR 154.A O no hydrogen 2.823 N/A GLY 176.A N GLY 150.A O no hydrogen 3.395 N/A ARG 177.A N ASP 151.A O no hydrogen 2.957 N/A ARG 177.A NE ASP 151.A OD2 no hydrogen 3.020 N/A ARG 177.A NH1 ILE 66.A O no hydrogen 3.079 N/A ARG 177.A NH1 GLU 67.A OE1 no hydrogen 2.298 N/A ARG 177.A NH2 SER 9.A O no hydrogen 2.364 N/A ARG 177.A NH2 ASP 151.A OD2 no hydrogen 2.908 N/A LEU 179.A N ALA 175.A O no hydrogen 3.150 N/A THR 180.A N GLY 176.A O no hydrogen 2.822 N/A THR 180.A OG1 ARG 177.A O no hydrogen 2.365 N/A THR 180.A OG1 ASP 181.A OD1 no hydrogen 3.233 N/A ASP 181.A N ARG 177.A O no hydrogen 3.117 N/A TYR 182.A N ASP 178.A O no hydrogen 2.759 N/A LEU 183.A N LEU 179.A O no hydrogen 2.900 N/A MET 184.A N THR 180.A O no hydrogen 2.644 N/A LYS 185.A N TYR 182.A O no hydrogen 3.054 N/A LYS 185.A NZ ASP 181.A O no hydrogen 2.754 N/A ILE 186.A N TYR 182.A O no hydrogen 3.029 N/A LEU 187.A N LEU 183.A O no hydrogen 3.104 N/A GLU 189.A N ILE 186.A O no hydrogen 3.348 N/A GLY 191.A N THR 188.A O no hydrogen 3.373 N/A TYR 192.A OH THR 243.A O no hydrogen 3.171 N/A THR 197.A OG1 LEU 62.A O no hydrogen 3.476 N/A ARG 200.A N THR 197.A O no hydrogen 3.123 N/A ARG 200.A NH1 THR 197.A OG1 no hydrogen 3.364 N/A ARG 200.A NH2 ASP 181.A OD1 no hydrogen 3.539 N/A GLU 201.A N ALA 198.A O no hydrogen 3.268 N/A ARG 204.A N ARG 200.A O no hydrogen 3.006 N/A ASP 205.A N GLU 201.A O no hydrogen 3.129 N/A ASP 205.A N ILE 202.A O no hydrogen 2.922 N/A ILE 206.A N ILE 202.A O no hydrogen 3.085 N/A LYS 207.A N VAL 203.A O no hydrogen 3.228 N/A GLU 208.A N ASP 205.A O no hydrogen 3.129 N/A LYS 209.A N ILE 206.A O no hydrogen 3.211 N/A LEU 210.A N ILE 206.A O no hydrogen 2.998 N/A TYR 212.A N ARG 248.A O no hydrogen 3.255 N/A VAL 213.A N PRO 301.A O no hydrogen 3.017 N/A GLU 220.A N ASP 216.A O no hydrogen 3.311 N/A MET 221.A N PHE 217.A O no hydrogen 2.949 N/A ALA 222.A N GLU 218.A O no hydrogen 3.391 N/A THR 223.A N GLN 219.A O no hydrogen 2.818 N/A THR 223.A OG1 GLN 219.A O no hydrogen 2.882 N/A ALA 224.A N GLU 220.A O no hydrogen 2.628 N/A ALA 225.A N MET 221.A O no hydrogen 3.027 N/A SER 226.A N THR 223.A O no hydrogen 3.070 N/A SER 226.A OG THR 223.A O no hydrogen 2.903 N/A SER 227.A OG THR 223.A O no hydrogen 3.231 N/A SER 227.A OG SER 229.A OG no hydrogen 3.363 N/A SER 229.A OG SER 227.A OG no hydrogen 3.363 N/A GLU 231.A N SER 228.A O no hydrogen 3.234 N/A LYS 232.A N ILE 244.A O no hydrogen 3.352 N/A TYR 234.A N ILE 242.A O no hydrogen 2.676 N/A GLU 235.A N GLU 235.A OE1 no hydrogen 2.549 N/A LEU 236.A N GLN 240.A O no hydrogen 2.395 N/A GLY 239.A N LEU 236.A O no hydrogen 2.949 N/A GLN 240.A N ASP 238.A OD1 no hydrogen 2.782 N/A ILE 242.A N TYR 234.A O no hydrogen 2.542 N/A THR 243.A N TYR 192.A OH no hydrogen 3.110 N/A ILE 244.A N LYS 232.A O no hydrogen 3.214 N/A GLY 245.A N GLU 247.A OE1 no hydrogen 3.019 N/A GLU 247.A N GLU 247.A OE1 no hydrogen 2.773 N/A ARG 248.A N GLY 245.A O no hydrogen 3.208 N/A ARG 248.A NE LEU 210.A O no hydrogen 2.586 N/A ARG 248.A NH1 LEU 230.A O no hydrogen 3.485 N/A ARG 248.A NH2 LEU 210.A O no hydrogen 2.884 N/A CYS 251.A SG LEU 179.A O no hydrogen 3.612 N/A GLU 253.A N PHE 249.A O no hydrogen 3.074 N/A ALA 254.A N ARG 250.A O no hydrogen 3.222 N/A ALA 254.A N CYS 251.A O no hydrogen 2.972 N/A LEU 255.A N PRO 252.A O no hydrogen 3.231 N/A PHE 256.A N GLU 253.A O no hydrogen 2.884 N/A GLN 257.A N GLU 253.A O no hydrogen 3.109 N/A PHE 260.A N GLN 257.A O no hydrogen 3.471 N/A LEU 261.A N PRO 258.A O no hydrogen 3.127 N/A GLY 262.A N SER 259.A O no hydrogen 3.060 N/A ILE 268.A N LEU 255.A O no hydrogen 2.848 N/A THR 271.A N GLY 267.A O no hydrogen 2.796 N/A THR 271.A OG1 GLY 267.A O no hydrogen 3.498 N/A THR 271.A OG1 ILE 268.A O no hydrogen 2.747 N/A THR 272.A N ILE 268.A O no hydrogen 3.197 N/A THR 272.A OG1 ILE 268.A O no hydrogen 3.461 N/A THR 272.A OG1 HIS 269.A O no hydrogen 2.668 N/A PHE 273.A N HIS 269.A O no hydrogen 3.434 N/A ASN 274.A N GLU 270.A O no hydrogen 3.004 N/A ASN 274.A ND2 GLU 270.A OE2 no hydrogen 2.845 N/A SER 275.A N THR 271.A O no hydrogen 3.040 N/A SER 275.A OG THR 271.A O no hydrogen 3.519 N/A SER 275.A OG THR 272.A O no hydrogen 2.694 N/A ILE 276.A N THR 272.A O no hydrogen 3.085 N/A MET 277.A N PHE 273.A O no hydrogen 2.947 N/A LYS 278.A N ASN 274.A O no hydrogen 2.875 N/A LYS 278.A NZ HIS 167.A ND1 no hydrogen 2.947 N/A CYS 279.A N SER 275.A O no hydrogen 3.116 N/A CYS 279.A N ILE 276.A O no hydrogen 3.210 N/A CYS 279.A SG SER 275.A O no hydrogen 3.252 N/A ARG 284.A N VAL 281.A O no hydrogen 3.313 N/A ARG 284.A NE ILE 276.A O no hydrogen 3.292 N/A ARG 284.A NE CYS 279.A O no hydrogen 3.191 N/A ARG 284.A NH2 CYS 279.A O no hydrogen 2.669 N/A LEU 287.A N ILE 283.A O no hydrogen 3.519 N/A TYR 288.A N ARG 284.A O no hydrogen 3.275 N/A ASN 290.A N LEU 287.A O no hydrogen 3.258 N/A THR 291.A OG1 LYS 322.A O no hydrogen 2.558 N/A VAL 292.A N ILE 145.A O no hydrogen 2.690 N/A LEU 293.A N ILE 324.A O no hydrogen 3.220 N/A SER 294.A N MET 147.A O no hydrogen 2.762 N/A SER 294.A OG MET 147.A O no hydrogen 2.846 N/A SER 294.A OG ASP 148.A OD1 no hydrogen 3.483 N/A THR 297.A N SER 149.A O no hydrogen 3.269 N/A THR 297.A OG1 SER 149.A O no hydrogen 2.864 N/A THR 298.A OG1 GLY 295.A O no hydrogen 3.205 N/A ILE 303.A N TYR 300.A O no hydrogen 3.432 N/A ARG 306.A N GLY 302.A O no hydrogen 3.025 N/A ARG 306.A NH1 LEU 215.A O no hydrogen 2.289 N/A MET 307.A N ILE 303.A O no hydrogen 2.633 N/A GLN 308.A N ALA 304.A O no hydrogen 2.931 N/A LYS 309.A N ARG 306.A O no hydrogen 2.795 N/A THR 312.A N GLN 308.A O no hydrogen 3.228 N/A THR 312.A OG1 LYS 309.A O no hydrogen 2.356 N/A ALA 313.A N LYS 309.A O no hydrogen 3.223 N/A LEU 314.A N GLU 310.A O no hydrogen 2.882 N/A ALA 315.A N ILE 311.A O no hydrogen 2.689 N/A LYS 322.A NZ ILE 323.A O no hydrogen 3.000 N/A ILE 324.A N THR 291.A O no hydrogen 2.892 N/A ARG 329.A N PRO 326.A O no hydrogen 3.291 N/A ARG 329.A NE THR 298.A O no hydrogen 3.513 N/A ARG 329.A NH1 PRO 326.A O no hydrogen 2.905 N/A ARG 329.A NH2 THR 298.A O no hydrogen 3.167 N/A SER 332.A N ARG 329.A O no hydrogen 3.383 N/A ILE 335.A N TYR 331.A O no hydrogen 3.011 N/A GLY 336.A N SER 332.A O no hydrogen 2.648 N/A GLY 337.A N VAL 333.A O no hydrogen 2.604 N/A SER 338.A N TRP 334.A O no hydrogen 2.686 N/A SER 338.A OG ASP 19.A O no hydrogen 3.104 N/A ILE 339.A N ILE 335.A O no hydrogen 3.362 N/A ALA 341.A N GLY 337.A O no hydrogen 3.479 N/A SER 342.A N ILE 339.A O no hydrogen 3.010 N/A SER 342.A OG ILE 339.A O no hydrogen 2.432 N/A LEU 343.A N LEU 340.A O no hydrogen 2.968 N/A GLN 347.A N SER 344.A O no hydrogen 3.286 N/A GLN 348.A N THR 345.A O no hydrogen 3.207 N/A MET 349.A N PHE 346.A O no hydrogen 3.168 N/A ILE 351.A N MET 126.A O no hydrogen 2.935 N/A SER 352.A N GLU 355.A OE2 no hydrogen 3.204 N/A LYS 353.A NZ PHE 118.A O no hydrogen 3.070 N/A LYS 353.A NZ ASN 122.A OD1 no hydrogen 3.124 N/A GLN 354.A NE2 GLU 358.A OE1 no hydrogen 2.637 N/A TYR 356.A N SER 352.A O no hydrogen 3.325 N/A TYR 356.A OH GLU 119.A OE2 no hydrogen 2.881 N/A ASP 357.A N LYS 353.A O no hydrogen 3.001 N/A GLU 358.A N GLN 354.A O no hydrogen 2.907 N/A SER 359.A N GLU 355.A O no hydrogen 3.181 N/A GLY 360.A N TYR 356.A O no hydrogen 2.611 N/A LYS 367.A N ILE 363.A O no hydrogen 2.903 N/A LYS 367.A NZ TRP 350.A O no hydrogen 3.493 N/A CYS 368.A SG VAL 128.A O no hydrogen 3.609 N/A