Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7dye_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 4.A NZ SER 16.A O no hydrogen 2.691 N/A MET 5.A N LEU 20.A O no hydrogen 2.806 N/A THR 7.A N ASP 13.A OD1 no hydrogen 3.334 N/A THR 7.A OG1 ASP 13.A OD1 no hydrogen 3.256 N/A PHE 12.A N ILE 9.A O no hydrogen 2.885 N/A ASP 14.A N GLY 11.A O no hydrogen 3.059 N/A ILE 15.A N GLY 11.A O no hydrogen 3.024 N/A SER 16.A N PHE 12.A O no hydrogen 3.066 N/A HIS 17.A N ASP 14.A O no hydrogen 3.107 N/A LEU 20.A N MET 5.A O no hydrogen 2.985 N/A ILE 22.A N ALA 3.A O no hydrogen 2.809 N/A THR 26.A N THR 145.A O no hydrogen 3.144 N/A LEU 27.A N ASN 170.A O no hydrogen 3.119 N/A VAL 28.A N MET 147.A O no hydrogen 2.664 N/A SER 29.A N VAL 172.A O no hydrogen 3.172 N/A SER 29.A OG ILE 158.A O no hydrogen 3.136 N/A THR 31.A OG1 GLU 154.A OE1 no hydrogen 3.367 N/A THR 31.A OG1 GLU 154.A OE2 no hydrogen 2.625 N/A THR 34.A OG1 THR 31.A O no hydrogen 2.863 N/A THR 37.A OG1 ASP 117.A OD1 no hydrogen 3.249 N/A THR 37.A OG1 ASP 117.A OD2 no hydrogen 2.998 N/A PHE 39.A N GLY 35.A O no hydrogen 2.936 N/A SER 40.A N LYS 36.A O no hydrogen 2.895 N/A ILE 41.A N THR 37.A O no hydrogen 2.789 N/A GLN 42.A N LEU 38.A O no hydrogen 2.781 N/A PHE 43.A N PHE 39.A O no hydrogen 2.972 N/A LEU 44.A N SER 40.A O no hydrogen 3.466 N/A TYR 45.A N ILE 41.A O no hydrogen 2.671 N/A ASN 46.A N GLN 42.A O no hydrogen 3.080 N/A ASN 46.A ND2 THR 7.A O no hydrogen 3.273 N/A GLY 47.A N PHE 43.A O no hydrogen 3.229 N/A ILE 48.A N LEU 44.A O no hydrogen 3.260 N/A ILE 48.A N TYR 45.A O no hydrogen 2.822 N/A ILE 49.A N ASN 46.A O no hydrogen 3.318 N/A GLU 53.A N GLY 47.A O no hydrogen 3.011 N/A GLY 55.A N LYS 86.A O no hydrogen 3.141 N/A PHE 57.A N PHE 88.A O no hydrogen 2.903 N/A VAL 58.A N SER 115.A O no hydrogen 3.036 N/A THR 59.A N LEU 90.A O no hydrogen 3.171 N/A ILE 67.A N THR 63.A O no hydrogen 3.083 N/A ILE 68.A N PRO 64.A O no hydrogen 2.944 N/A LYS 69.A N GLN 65.A O no hydrogen 2.916 N/A ASN 70.A N ASP 66.A O no hydrogen 2.719 N/A ALA 71.A N ILE 67.A O no hydrogen 2.869 N/A ARG 72.A N ILE 68.A O no hydrogen 2.943 N/A SER 73.A N ASN 70.A O no hydrogen 3.036 N/A PHE 74.A N ALA 71.A O no hydrogen 3.166 N/A VAL 82.A N LEU 78.A O no hydrogen 2.776 N/A ASP 83.A N ALA 79.A O no hydrogen 2.698 N/A GLU 84.A N LYS 80.A O no hydrogen 3.048 N/A GLY 85.A N LEU 81.A O no hydrogen 3.014 N/A ALA 92.A N THR 59.A O no hydrogen 2.534 N/A LEU 98.A N ASP 94.A O no hydrogen 3.213 N/A ILE 99.A N LEU 95.A O no hydrogen 2.589 N/A GLU 100.A N SER 96.A O no hydrogen 2.730 N/A ARG 101.A N ALA 97.A O no hydrogen 3.115 N/A ILE 102.A N LEU 98.A O no hydrogen 2.940 N/A ASN 103.A N ILE 99.A O no hydrogen 2.690 N/A TYR 104.A N GLU 100.A O no hydrogen 2.638 N/A ALA 105.A N ILE 102.A O no hydrogen 3.283 N/A GLN 107.A NE2 GLN 107.A O no hydrogen 2.899 N/A ALA 111.A N ILE 106.A O no hydrogen 2.984 N/A ARG 112.A N PRO 54.A O no hydrogen 2.749 N/A ARG 113.A NH1 PHE 43.A O no hydrogen 2.915 N/A ARG 113.A NH2 ARG 6.A O no hydrogen 2.460 N/A VAL 114.A N THR 144.A O no hydrogen 3.036 N/A SER 115.A N VAL 56.A O no hydrogen 3.502 N/A SER 115.A OG SER 40.A O no hydrogen 3.179 N/A ILE 116.A N VAL 146.A O no hydrogen 2.913 N/A ASP 117.A N VAL 58.A O no hydrogen 3.163 N/A SER 118.A OG GLU 150.A OE1 no hydrogen 3.242 N/A VAL 119.A N THR 148.A O no hydrogen 3.442 N/A SER 121.A OG SER 118.A O no hydrogen 2.708 N/A GLU 130.A N VAL 126.A O no hydrogen 2.936 N/A LEU 131.A N VAL 127.A O no hydrogen 2.834 N/A PHE 132.A N ARG 128.A O no hydrogen 2.722 N/A ARG 133.A N ARG 129.A O no hydrogen 3.335 N/A LEU 134.A N GLU 130.A O no hydrogen 2.942 N/A VAL 135.A N LEU 131.A O no hydrogen 3.047 N/A ALA 136.A N PHE 132.A O no hydrogen 3.130 N/A ARG 137.A N ARG 133.A O no hydrogen 3.194 N/A LEU 138.A N LEU 134.A O no hydrogen 3.175 N/A LYS 139.A N VAL 135.A O no hydrogen 2.788 N/A GLN 140.A N ALA 136.A O no hydrogen 3.286 N/A GLY 142.A N LYS 139.A O no hydrogen 3.079 N/A THR 144.A N ARG 112.A O no hydrogen 3.259 N/A MET 147.A N THR 26.A O no hydrogen 2.710 N/A THR 148.A N ILE 116.A O no hydrogen 3.150 N/A THR 148.A OG1 ASP 117.A OD2 no hydrogen 3.143 N/A THR 149.A N VAL 28.A O no hydrogen 2.904 N/A ARG 151.A N GLY 30.A O no hydrogen 3.493 N/A ARG 151.A NE PRO 157.A O no hydrogen 3.540 N/A ARG 151.A NE ILE 158.A O no hydrogen 2.873 N/A ARG 151.A NH1 GLU 154.A O no hydrogen 2.584 N/A ARG 151.A NH2 GLY 156.A O no hydrogen 3.248 N/A ARG 151.A NH2 PRO 157.A O no hydrogen 3.455 N/A TYR 155.A OH GLU 201.A OE1 no hydrogen 2.992 N/A TYR 155.A OH GLU 201.A OE2 no hydrogen 2.758 N/A TYR 161.A N GLU 164.A OE1 no hydrogen 3.480 N/A VAL 163.A N GLU 164.A OE2 no hydrogen 2.580 N/A SER 168.A OG GLU 164.A O no hydrogen 2.650 N/A ASN 170.A ND2 THR 26.A OG1 no hydrogen 2.843 N/A VAL 171.A N LYS 191.A O no hydrogen 3.318 N/A VAL 172.A N LEU 27.A O no hydrogen 2.781 N/A ILE 173.A N GLU 188.A O no hydrogen 2.848 N/A LEU 174.A N SER 29.A O no hydrogen 3.004 N/A ARG 175.A N THR 186.A O no hydrogen 2.746 N/A ASN 176.A N GLU 154.A OE2 no hydrogen 2.840 N/A VAL 177.A N ARG 184.A O no hydrogen 3.243 N/A GLU 179.A N ARG 182.A O no hydrogen 2.930 N/A ARG 183.A NH1 ASN 176.A O no hydrogen 2.520 N/A ARG 184.A N VAL 177.A O no hydrogen 2.918 N/A THR 186.A N ARG 175.A O no hydrogen 3.189 N/A THR 186.A OG1 GLU 201.A OE2 no hydrogen 3.255 N/A LEU 187.A N TYR 202.A O no hydrogen 3.032 N/A GLU 188.A N ILE 173.A O no hydrogen 3.000 N/A LEU 190.A N VAL 171.A O no hydrogen 2.756 N/A ARG 193.A N ASP 169.A O no hydrogen 3.206 N/A ARG 193.A NH2 PHE 166.A O no hydrogen 2.635 N/A MET 198.A N ILE 15.A O no hydrogen 2.786 N/A TYR 202.A N LEU 187.A O no hydrogen 3.045 N/A TYR 202.A OH LYS 199.A O no hydrogen 3.398 N/A PHE 204.A N ARG 185.A O no hydrogen 3.455 N/A THR 205.A N ASN 212.A O no hydrogen 3.103 N/A THR 207.A N GLY 210.A O no hydrogen 3.082 N/A ASP 208.A N THR 207.A OG1 no hydrogen 2.720 N/A GLY 210.A N THR 207.A O no hydrogen 3.350 N/A ILE 211.A N GLN 42.A OE1 no hydrogen 3.225 N/A ASN 212.A N THR 205.A O no hydrogen 2.738 N/A ILE 213.A N GLU 10.A O no hydrogen 3.003 N/A PHE 214.A N PRO 203.A O no hydrogen 3.203 N/A VAL 228.A N SER 226.A OG no hydrogen 3.301 N/A ARG 229.A NH1 CYS 241.A O no hydrogen 3.320 N/A ARG 229.A NH1 GLY 244.A O no hydrogen 3.513 N/A VAL 230.A N PHE 245.A O no hydrogen 2.660 N/A SER 231.A OG ASP 238.A OD2 no hydrogen 2.380 N/A SER 232.A OG ASP 238.A OD1 no hydrogen 2.690 N/A GLY 233.A N SER 231.A OG no hydrogen 3.359 N/A VAL 234.A N SER 232.A OG no hydrogen 3.425 N/A ASP 238.A N VAL 234.A O no hydrogen 3.056 N/A GLU 239.A N VAL 235.A O no hydrogen 2.932 N/A MET 240.A N ARG 236.A O no hydrogen 2.647 N/A CYS 241.A N LEU 237.A O no hydrogen 2.817 N/A CYS 241.A SG LEU 237.A O no hydrogen 3.580 N/A GLY 242.A N GLU 239.A O no hydrogen 3.108 N/A GLY 243.A N ASP 238.A O no hydrogen 2.907 N/A LYS 247.A N VAL 228.A O no hydrogen 2.707 N/A SER 249.A OG PHE 246.A O no hydrogen 2.843 N/A ILE 250.A N ASP 399.A OD2 no hydrogen 3.097 N/A ILE 251.A N GLY 377.A O no hydrogen 2.778 N/A LEU 252.A N THR 400.A O no hydrogen 2.903 N/A ALA 253.A N PHE 379.A O no hydrogen 3.022 N/A THR 254.A OG1 ASN 381.A O no hydrogen 2.937 N/A GLY 255.A N ASN 381.A O no hydrogen 3.106 N/A THR 259.A OG1 ALA 256.A O no hydrogen 2.238 N/A LYS 261.A NZ GLY 255.A O no hydrogen 2.744 N/A LYS 261.A NZ ALA 256.A O no hydrogen 2.556 N/A LYS 261.A NZ THR 259.A OG1 no hydrogen 3.390 N/A THR 262.A OG1 GLU 286.A OE2 no hydrogen 3.437 N/A THR 262.A OG1 ASP 345.A OD2 no hydrogen 3.380 N/A LEU 264.A N GLY 260.A O no hydrogen 3.373 N/A VAL 265.A N LYS 261.A O no hydrogen 3.063 N/A SER 266.A N THR 262.A O no hydrogen 2.788 N/A SER 266.A OG THR 262.A O no hydrogen 2.580 N/A ARG 267.A N LEU 263.A O no hydrogen 3.066 N/A ARG 267.A NE GLY 233.A O no hydrogen 3.443 N/A ARG 267.A NH1 LYS 439.A O no hydrogen 2.477 N/A ARG 267.A NH2 LYS 439.A O no hydrogen 2.704 N/A PHE 268.A N LEU 264.A O no hydrogen 3.007 N/A VAL 269.A N VAL 265.A O no hydrogen 3.029 N/A GLU 270.A N SER 266.A O no hydrogen 2.773 N/A ASN 271.A N ARG 267.A O no hydrogen 2.911 N/A CYS 273.A N VAL 269.A O no hydrogen 3.263 N/A CYS 273.A SG VAL 269.A O no hydrogen 3.380 N/A CYS 273.A SG LEU 310.A O no hydrogen 3.247 N/A ALA 274.A N GLU 270.A O no hydrogen 2.876 N/A ALA 274.A N ASN 271.A O no hydrogen 3.242 N/A ASN 275.A N ASN 271.A O no hydrogen 3.261 N/A GLU 277.A N ALA 272.A O no hydrogen 2.770 N/A ALA 279.A N LEU 310.A O no hydrogen 2.715 N/A ILE 280.A N ARG 341.A O no hydrogen 3.219 N/A LEU 281.A N LYS 312.A O no hydrogen 2.847 N/A PHE 282.A N ALA 343.A O no hydrogen 3.000 N/A ALA 283.A N VAL 314.A O no hydrogen 3.222 N/A TYR 284.A N ASP 345.A O no hydrogen 2.884 N/A GLN 290.A N SER 287.A OG no hydrogen 3.381 N/A LEU 291.A N SER 287.A O no hydrogen 2.882 N/A LEU 292.A N ARG 288.A O no hydrogen 2.749 N/A ARG 293.A N ALA 289.A O no hydrogen 3.070 N/A ARG 293.A NH2 ASN 294.A OD1 no hydrogen 3.321 N/A ASN 294.A N GLN 290.A O no hydrogen 2.747 N/A ALA 295.A N LEU 291.A O no hydrogen 2.677 N/A TYR 296.A N LEU 292.A O no hydrogen 2.774 N/A SER 297.A N ARG 293.A O no hydrogen 2.877 N/A SER 297.A OG ARG 293.A O no hydrogen 3.411 N/A TRP 298.A N ALA 295.A O no hydrogen 2.687 N/A GLY 299.A N TYR 296.A O no hydrogen 3.135 N/A MET 300.A N ALA 295.A O no hydrogen 3.123 N/A GLU 304.A N ASP 301.A OD1 no hydrogen 2.983 N/A GLU 306.A N PHE 302.A O no hydrogen 3.248 N/A ARG 307.A N GLU 303.A O no hydrogen 2.804 N/A GLN 308.A N GLU 304.A O no hydrogen 2.800 N/A ASN 309.A N GLU 306.A O no hydrogen 3.448 N/A LEU 310.A N MET 305.A O no hydrogen 3.159 N/A LYS 312.A N ALA 279.A O no hydrogen 3.137 N/A VAL 314.A N LEU 281.A O no hydrogen 2.911 N/A CYS 315.A SG GLU 286.A O no hydrogen 4.008 N/A ALA 316.A N ALA 283.A O no hydrogen 3.200 N/A SER 320.A N TYR 317.A O no hydrogen 3.039 N/A SER 320.A OG TYR 317.A O no hydrogen 2.529 N/A HIS 326.A N GLY 322.A O no hydrogen 2.882 N/A HIS 326.A NE2 PRO 318.A O no hydrogen 3.011 N/A LEU 327.A N LEU 323.A O no hydrogen 2.819 N/A GLN 328.A N GLU 324.A O no hydrogen 3.097 N/A ILE 329.A N ASP 325.A O no hydrogen 2.625 N/A ILE 330.A N HIS 326.A O no hydrogen 2.950 N/A LYS 331.A N LEU 327.A O no hydrogen 2.912 N/A SER 332.A N GLN 328.A O no hydrogen 2.954 N/A GLU 333.A N ILE 329.A O no hydrogen 3.031 N/A ILE 334.A N ILE 330.A O no hydrogen 2.900 N/A ASN 335.A N LYS 331.A O no hydrogen 2.949 N/A ASN 335.A ND2 TYR 369.A OH no hydrogen 2.937 N/A ASP 336.A N SER 332.A O no hydrogen 3.088 N/A PHE 337.A N GLU 333.A O no hydrogen 2.881 N/A LYS 338.A N ILE 334.A O no hydrogen 2.575 N/A ALA 340.A N ARG 278.A O no hydrogen 2.728 N/A ARG 341.A NH1 PHE 268.A O no hydrogen 2.914 N/A ARG 341.A NH2 SER 231.A O no hydrogen 2.374 N/A ILE 342.A N THR 376.A O no hydrogen 2.913 N/A ALA 343.A N ILE 280.A O no hydrogen 3.224 N/A ILE 344.A N LEU 378.A O no hydrogen 3.229 N/A ASP 345.A N PHE 282.A O no hydrogen 2.835 N/A SER 346.A OG GLU 285.A OE2 no hydrogen 2.565 N/A SER 346.A OG SER 348.A OG no hydrogen 3.152 N/A LEU 347.A N THR 380.A O no hydrogen 3.181 N/A SER 348.A OG SER 346.A OG no hydrogen 3.152 N/A ALA 351.A N SER 348.A O no hydrogen 3.075 N/A ARG 352.A N ALA 349.A O no hydrogen 3.290 N/A ARG 352.A NE GLU 319.A OE1 no hydrogen 3.127 N/A ARG 352.A NH2 GLU 319.A OE1 no hydrogen 2.986 N/A PHE 359.A N SER 355.A O no hydrogen 2.914 N/A ARG 360.A N ASN 356.A O no hydrogen 2.824 N/A GLN 361.A N ASN 357.A O no hydrogen 3.037 N/A PHE 362.A N PHE 359.A O no hydrogen 3.167 N/A VAL 363.A N PHE 359.A O no hydrogen 3.129 N/A ILE 364.A N ARG 360.A O no hydrogen 3.302 N/A GLY 365.A N GLN 361.A O no hydrogen 3.272 N/A VAL 366.A N PHE 362.A O no hydrogen 3.022 N/A THR 367.A N VAL 363.A O no hydrogen 3.002 N/A THR 367.A OG1 VAL 363.A O no hydrogen 3.021 N/A GLY 368.A N ILE 364.A O no hydrogen 2.870 N/A ALA 370.A N VAL 366.A O no hydrogen 3.131 N/A LYS 371.A N THR 367.A O no hydrogen 2.987 N/A GLN 372.A N GLY 368.A O no hydrogen 3.080 N/A GLN 372.A N TYR 369.A O no hydrogen 3.177 N/A GLU 373.A N ALA 370.A O no hydrogen 3.319 N/A ILE 375.A N ALA 370.A O no hydrogen 2.955 N/A THR 376.A N ALA 340.A O no hydrogen 3.085 N/A THR 376.A OG1 LYS 247.A O no hydrogen 2.351 N/A GLY 377.A N SER 249.A O no hydrogen 3.497 N/A LEU 378.A N ILE 342.A O no hydrogen 3.131 N/A PHE 379.A N ILE 251.A O no hydrogen 2.947 N/A THR 380.A N ILE 344.A O no hydrogen 3.241 N/A THR 380.A OG1 ASP 345.A OD1 no hydrogen 3.031 N/A ASN 381.A N ALA 253.A O no hydrogen 3.103 N/A ASN 381.A ND2 THR 254.A OG1 no hydrogen 3.225 N/A THR 382.A N SER 348.A OG no hydrogen 3.256 N/A SER 383.A N GLY 255.A O no hydrogen 2.898 N/A SER 383.A OG GLN 385.A O no hydrogen 2.669 N/A ILE 397.A N ILE 394.A O no hydrogen 3.373 N/A THR 398.A OG1 ALA 395.A O no hydrogen 3.499 N/A ASP 399.A N ILE 250.A O no hydrogen 2.795 N/A THR 400.A N ILE 250.A O no hydrogen 3.207 N/A ILE 401.A N LYS 421.A O no hydrogen 3.316 N/A ILE 402.A N LEU 252.A O no hydrogen 2.700 N/A LEU 403.A N ASN 418.A O no hydrogen 3.090 N/A LEU 404.A N THR 254.A O no hydrogen 3.104 N/A GLN 405.A N ALA 416.A O no hydrogen 2.840 N/A TYR 406.A OH THR 257.A O no hydrogen 2.593 N/A VAL 407.A N SER 414.A O no hydrogen 2.715 N/A ILE 409.A N GLU 412.A O no hydrogen 2.891 N/A SER 414.A OG VAL 407.A O no hydrogen 3.130 N/A ARG 415.A NH1 GLY 258.A O no hydrogen 3.019 N/A ALA 416.A N GLN 405.A O no hydrogen 2.639 N/A ILE 417.A N ARG 432.A O no hydrogen 3.055 N/A ASN 418.A N LEU 403.A O no hydrogen 3.099 N/A PHE 420.A N ILE 401.A O no hydrogen 2.884 N/A LYS 421.A NZ ALA 395.A O no hydrogen 3.074 N/A ARG 423.A N ASP 399.A O no hydrogen 3.100 N/A ARG 423.A NH1 ASP 399.A OD1 no hydrogen 2.743 N/A ASP 428.A N MET 240.A O no hydrogen 2.747 N/A ARG 432.A NE ASP 428.A OD2 no hydrogen 2.739 N/A ARG 432.A NH1 LYS 444.A O no hydrogen 3.513 N/A ARG 432.A NH2 ASP 428.A OD2 no hydrogen 2.872 N/A GLU 433.A N ASP 445.A O no hydrogen 2.930 N/A PHE 434.A N ARG 415.A O no hydrogen 3.220 N/A MET 435.A N ASP 442.A O no hydrogen 2.915 N/A SER 437.A N GLY 440.A O no hydrogen 3.334 N/A SER 437.A OG GLY 440.A O no hydrogen 3.531 N/A GLY 440.A N SER 437.A O no hydrogen 3.242 N/A ASP 442.A N MET 435.A O no hydrogen 2.777 N/A LYS 444.A N GLU 433.A O no hydrogen 2.855 N/A