Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1um2_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N ASN 63.A OD1 no hydrogen 2.257 N/A PHE 2.A N TYR 395.A O no hydrogen 3.250 N/A ALA 3.A N THR 61.A O no hydrogen 3.219 N/A GLY 5.A N GLU 19.A OE1 no hydrogen 2.667 N/A THR 6.A N ALA 3.A O no hydrogen 3.353 N/A THR 6.A OG1 ALA 3.A O no hydrogen 3.246 N/A VAL 8.A N GLU 16.A O no hydrogen 3.040 N/A MET 10.A N SER 14.A O no hydrogen 2.798 N/A ALA 11.A N LYS 26.A O no hydrogen 3.428 N/A GLY 13.A N MET 10.A O no hydrogen 3.050 N/A SER 14.A N ASP 12.A OD1 no hydrogen 2.730 N/A SER 14.A OG ASP 12.A OD1 no hydrogen 2.217 N/A SER 14.A OG ASP 12.A OD2 no hydrogen 2.958 N/A GLU 19.A N GLU 19.A OE1 no hydrogen 3.147 N/A GLU 22.A N ASN 25.A OD1 no hydrogen 2.810 N/A GLY 24.A N VAL 37.A O no hydrogen 2.848 N/A VAL 27.A N ARG 35.A O no hydrogen 2.901 N/A MET 28.A N LEU 9.A O no hydrogen 2.924 N/A GLY 29.A N ARG 33.A O no hydrogen 2.967 N/A ASP 31.A N GLY 29.A O no hydrogen 2.383 N/A GLY 32.A N GLY 29.A O no hydrogen 2.959 N/A ARG 35.A N VAL 27.A O no hydrogen 2.779 N/A ARG 35.A NH1 PRO 34.A O no hydrogen 3.461 N/A VAL 37.A N ASN 25.A O no hydrogen 2.820 N/A ILE 38.A N THR 398.A O no hydrogen 3.439 N/A GLU 45.A N ASP 392.A O no hydrogen 3.122 N/A THR 46.A OG1 LYS 390.A O no hydrogen 3.276 N/A MET 47.A N LEU 389.A O no hydrogen 3.329 N/A TYR 48.A N CYS 62.A O no hydrogen 2.743 N/A SER 49.A N GLN 387.A O no hydrogen 3.270 N/A SER 49.A OG SER 49.A O no hydrogen 2.403 N/A VAL 50.A N PHE 60.A O no hydrogen 2.737 N/A VAL 51.A N GLU 385.A O no hydrogen 2.718 N/A GLN 52.A N LEU 58.A O no hydrogen 2.905 N/A LYS 53.A N TYR 383.A O no hydrogen 3.081 N/A LEU 58.A N GLN 52.A OE1 no hydrogen 3.183 N/A PHE 60.A N VAL 50.A O no hydrogen 2.956 N/A CYS 62.A N TYR 48.A O no hydrogen 2.691 N/A CYS 62.A SG TYR 48.A O no hydrogen 3.980 N/A CYS 62.A SG ASN 63.A O no hydrogen 3.835 N/A ASN 63.A N SER 1.A O no hydrogen 2.738 N/A ASN 63.A N ASN 63.A OD1 no hydrogen 2.529 N/A ALA 64.A N THR 46.A O no hydrogen 3.211 N/A THR 65.A OG1 GLU 147.A OE2 no hydrogen 3.476 N/A ASN 66.A N ASN 63.A O no hydrogen 2.584 N/A LEU 68.A N ILE 146.A O no hydrogen 2.782 N/A VAL 70.A N TRP 144.A O no hydrogen 3.047 N/A ARG 71.A N TYR 163.A O no hydrogen 2.783 N/A THR 72.A N PHE 142.A O no hydrogen 3.097 N/A THR 72.A OG1 THR 162.A OG1 no hydrogen 2.536 N/A ARG 74.A N ALA 140.A O no hydrogen 3.307 N/A ARG 74.A NH2 TYR 133.A O no hydrogen 2.798 N/A SER 75.A N TYR 133.A OH no hydrogen 2.750 N/A ARG 77.A N ILE 92.A O no hydrogen 2.960 N/A ARG 78.A NE ARG 78.A O no hydrogen 3.279 N/A ARG 78.A NH1 ASN 127.A OD1 no hydrogen 2.721 N/A ILE 83.A N VAL 86.A O no hydrogen 2.416 N/A LYS 84.A N THR 82.A O no hydrogen 3.170 N/A TYR 88.A N ARG 81.A O no hydrogen 2.360 N/A PHE 89.A N TYR 117.A O no hydrogen 2.564 N/A VAL 91.A N LYS 115.A O no hydrogen 3.225 N/A ILE 92.A N ARG 77.A O no hydrogen 2.996 N/A THR 93.A N VAL 113.A O no hydrogen 2.919 N/A THR 93.A OG1 GLU 95.A OE2 no hydrogen 2.564 N/A PHE 94.A N SER 75.A O no hydrogen 3.169 N/A GLU 95.A N LYS 111.A O no hydrogen 3.037 N/A GLY 97.A N LEU 109.A O no hydrogen 2.797 N/A LYS 99.A N VAL 107.A O no hydrogen 3.269 N/A LYS 100.A NZ ALA 101.A O no hydrogen 3.300 N/A ALA 101.A N ARG 105.A O no hydrogen 3.172 N/A ARG 105.A NE ASP 103.A OD1 no hydrogen 2.607 N/A ARG 105.A NH2 ASP 150.A OD1 no hydrogen 3.376 N/A VAL 107.A N LYS 99.A O no hydrogen 3.025 N/A LEU 109.A N GLY 97.A O no hydrogen 3.015 N/A LYS 111.A N GLU 95.A O no hydrogen 2.953 N/A LYS 111.A NZ GLN 98.A O no hydrogen 2.590 N/A VAL 113.A N THR 93.A O no hydrogen 2.769 N/A SER 114.A OG GLU 90.A OE2 no hydrogen 2.412 N/A LYS 115.A N VAL 91.A O no hydrogen 3.172 N/A ILE 119.A N GLU 87.A O no hydrogen 2.606 N/A GLY 122.A N ILE 119.A O no hydrogen 2.657 N/A ASN 127.A N PRO 123.A O no hydrogen 2.764 N/A GLU 128.A N GLU 124.A O no hydrogen 3.432 N/A LEU 129.A N ARG 125.A O no hydrogen 2.839 N/A VAL 130.A N ALA 126.A O no hydrogen 3.325 N/A GLU 131.A N ASN 127.A O no hydrogen 2.850 N/A SER 132.A N GLU 128.A O no hydrogen 3.013 N/A SER 132.A N LEU 129.A O no hydrogen 2.918 N/A SER 132.A OG GLU 128.A O no hydrogen 2.478 N/A TYR 133.A N LEU 129.A O no hydrogen 3.122 N/A TYR 133.A OH PHE 94.A O no hydrogen 2.844 N/A ARG 134.A N VAL 130.A O no hydrogen 3.143 N/A LYS 135.A N SER 132.A O no hydrogen 3.376 N/A ALA 136.A N TYR 133.A O no hydrogen 3.493 N/A SER 137.A OG LYS 139.A O no hydrogen 2.753 N/A LYS 139.A N SER 137.A OG no hydrogen 2.889 N/A PHE 142.A N THR 72.A O no hydrogen 2.837 N/A TRP 144.A N VAL 70.A O no hydrogen 3.185 N/A TRP 144.A NE1 THR 72.A OG1 no hydrogen 3.031 N/A THR 145.A OG1 GLU 67.A OE1 no hydrogen 3.219 N/A ILE 146.A N LEU 68.A O no hydrogen 3.255 N/A ALA 148.A N ASN 66.A O no hydrogen 2.699 N/A ARG 149.A N ALA 64.A O no hydrogen 3.297 N/A ARG 149.A NH2 GLU 147.A OE2 no hydrogen 2.783 N/A ASP 150.A N GLU 147.A O no hydrogen 2.710 N/A SER 152.A OG ARG 149.A O no hydrogen 2.839 N/A LEU 153.A N ASP 150.A O no hydrogen 3.249 N/A LEU 154.A N LEU 151.A O no hydrogen 2.871 N/A HIS 157.A ND1 GLU 112.A OE2 no hydrogen 2.757 N/A ARG 159.A N GLY 155.A O no hydrogen 3.305 N/A ARG 159.A NH1 ARG 159.A O no hydrogen 3.542 N/A ARG 159.A NH2 PHE 384.A O no hydrogen 3.492 N/A LYS 160.A N SER 156.A O no hydrogen 3.020 N/A ALA 161.A N HIS 157.A O no hydrogen 3.072 N/A THR 162.A N ARG 159.A O no hydrogen 3.087 N/A THR 162.A OG1 THR 72.A OG1 no hydrogen 2.536 N/A THR 162.A OG1 VAL 158.A O no hydrogen 2.576 N/A TYR 163.A N ARG 71.A O no hydrogen 3.056 N/A GLN 164.A N PHE 382.A O no hydrogen 3.282 N/A TYR 166.A N ARG 380.A O no hydrogen 3.034 N/A TYR 166.A OH LEU 333.A O no hydrogen 2.761 N/A ALA 167.A N GLN 412.A O no hydrogen 2.753 N/A ILE 169.A N SER 330.A O no hydrogen 2.769 N/A TYR 171.A OH ASP 12.A O no hydrogen 3.327 N/A ASN 173.A N THR 283.A O no hydrogen 2.969 N/A ASP 178.A N ASP 174.A O no hydrogen 3.159 N/A TYR 179.A N HIS 175.A O no hydrogen 3.320 N/A TYR 179.A OH ASP 262.A O no hydrogen 2.305 N/A LYS 182.A N MET 180.A O no hydrogen 2.506 N/A SER 183.A N MET 180.A O no hydrogen 3.242 N/A LYS 184.A NZ SER 183.A OG no hydrogen 2.773 N/A GLY 191.A N THR 188.A O no hydrogen 2.587 N/A VAL 194.A N GLU 190.A O no hydrogen 3.107 N/A LEU 195.A N GLY 191.A O no hydrogen 3.184 N/A ALA 196.A N PRO 192.A O no hydrogen 2.840 N/A TYR 197.A N LYS 193.A O no hydrogen 2.886 N/A TYR 197.A OH ASP 298.A OD2 no hydrogen 2.901 N/A LEU 198.A N VAL 194.A O no hydrogen 3.147 N/A LEU 199.A N LEU 195.A O no hydrogen 2.804 N/A GLY 200.A N ALA 196.A O no hydrogen 2.528 N/A LEU 201.A N TYR 197.A O no hydrogen 2.578 N/A TRP 202.A N LEU 198.A O no hydrogen 2.638 N/A TRP 202.A N LEU 199.A O no hydrogen 2.915 N/A TRP 202.A NE1 LEU 207.A O no hydrogen 2.720 N/A ILE 203.A N LEU 199.A O no hydrogen 3.183 N/A ILE 203.A N GLY 200.A O no hydrogen 2.618 N/A GLY 204.A N GLY 200.A O no hydrogen 3.453 N/A ARG 210.A NE ASP 209.A OD1 no hydrogen 2.498 N/A ARG 210.A NH2 ASP 209.A OD2 no hydrogen 3.533 N/A THR 212.A OG1 ASN 252.A OD1 no hydrogen 2.511 N/A PHE 213.A N VAL 251.A O no hydrogen 3.013 N/A VAL 215.A N LYS 249.A O no hydrogen 3.126 N/A SER 217.A N VAL 247.A O no hydrogen 2.936 N/A SER 217.A OG VAL 247.A O no hydrogen 2.898 N/A ASP 219.A N ASP 216.A OD1 no hydrogen 2.831 N/A SER 221.A OG ASP 219.A OD1 no hydrogen 2.781 N/A SER 221.A OG ALA 362.A O no hydrogen 2.974 N/A MET 223.A N ASP 219.A O no hydrogen 3.045 N/A ARG 225.A N SER 221.A O no hydrogen 2.847 N/A ARG 225.A NH1 LYS 360.A O no hydrogen 2.708 N/A ARG 225.A NH2 LYS 360.A O no hydrogen 3.175 N/A VAL 226.A N LEU 222.A O no hydrogen 2.643 N/A THR 227.A N MET 223.A O no hydrogen 2.955 N/A GLU 228.A N GLU 224.A O no hydrogen 2.649 N/A TYR 229.A N ARG 225.A O no hydrogen 2.872 N/A ALA 230.A N VAL 226.A O no hydrogen 2.748 N/A GLU 231.A N THR 227.A O no hydrogen 3.053 N/A LYS 232.A NZ GLU 190.A OE2 no hydrogen 3.073 N/A LYS 232.A NZ GLU 228.A OE2 no hydrogen 3.328 N/A ASN 234.A N ALA 230.A O no hydrogen 3.451 N/A VAL 247.A N GLN 246.A OE1 no hydrogen 2.903 N/A ALA 248.A N GLN 246.A OE1 no hydrogen 3.204 N/A LYS 249.A N VAL 247.A O no hydrogen 3.148 N/A LYS 249.A NZ ASP 241.A OD1 no hydrogen 2.589 N/A ASN 252.A N GLU 238.A O no hydrogen 3.169 N/A ASN 258.A ND2 LEU 253.A O no hydrogen 3.398 N/A ASP 262.A N ASN 258.A O no hydrogen 3.216 N/A ALA 263.A N PRO 259.A O no hydrogen 3.094 N/A ILE 264.A N LEU 260.A O no hydrogen 2.894 N/A GLY 266.A N ASP 262.A O no hydrogen 2.889 N/A LEU 267.A N ALA 263.A O no hydrogen 3.209 N/A GLY 268.A N VAL 265.A O no hydrogen 2.895 N/A PHE 269.A N ILE 264.A O no hydrogen 2.642 N/A VAL 274.A N ASP 272.A O no hydrogen 3.050 N/A LYS 275.A NZ GLY 204.A O no hydrogen 3.548 N/A ASN 276.A N PHE 269.A O no hydrogen 3.304 N/A ASN 276.A ND2 GLY 268.A O no hydrogen 3.075 N/A ILE 277.A N SER 319.A O no hydrogen 3.264 N/A SER 282.A N SER 279.A O no hydrogen 3.201 N/A SER 282.A OG SER 279.A O no hydrogen 3.489 N/A THR 283.A OG1 PHE 280.A O no hydrogen 3.537 N/A ASP 284.A N LEU 281.A O no hydrogen 3.096 N/A ASN 285.A N ASP 284.A OD2 no hydrogen 2.510 N/A ILE 286.A N GLU 172.A OE2 no hydrogen 3.265 N/A THR 288.A N ASN 285.A O no hydrogen 2.843 N/A THR 288.A N ASN 285.A OD1 no hydrogen 3.296 N/A THR 288.A OG1 ASN 285.A OD1 no hydrogen 3.203 N/A ARG 289.A N ASN 285.A O no hydrogen 3.111 N/A ARG 289.A NH1 ILE 169.A O no hydrogen 3.089 N/A ARG 289.A NH1 SER 282.A O no hydrogen 2.434 N/A ARG 289.A NH2 ILE 169.A O no hydrogen 3.142 N/A GLU 290.A N ILE 286.A O no hydrogen 2.791 N/A THR 291.A N GLY 287.A O no hydrogen 2.516 N/A THR 291.A OG1 GLY 287.A O no hydrogen 2.980 N/A PHE 292.A N THR 288.A O no hydrogen 2.804 N/A LEU 293.A N ARG 289.A O no hydrogen 3.018 N/A ALA 294.A N GLU 290.A O no hydrogen 2.678 N/A GLY 295.A N THR 291.A O no hydrogen 3.156 N/A LEU 296.A N PHE 292.A O no hydrogen 3.202 N/A ILE 297.A N LEU 293.A O no hydrogen 3.083 N/A ASP 298.A N ALA 294.A O no hydrogen 2.842 N/A SER 299.A N GLY 295.A O no hydrogen 2.736 N/A SER 299.A OG GLY 295.A O no hydrogen 3.284 N/A SER 299.A OG LEU 296.A O no hydrogen 2.221 N/A SER 299.A OG ASP 300.A OD1 no hydrogen 3.514 N/A ASP 300.A N LEU 296.A O no hydrogen 3.223 N/A GLY 301.A N ILE 297.A O no hydrogen 2.696 N/A TYR 302.A N THR 312.A O no hydrogen 2.860 N/A THR 304.A N LYS 310.A O no hydrogen 3.112 N/A LYS 310.A N THR 304.A O no hydrogen 3.190 N/A ALA 311.A N MET 348.A O no hydrogen 3.089 N/A THR 312.A N TYR 302.A O no hydrogen 2.982 N/A ILE 313.A N ILE 346.A O no hydrogen 3.228 N/A LYS 314.A NZ GLU 340.A OE2 no hydrogen 2.899 N/A THR 315.A N TYR 344.A O no hydrogen 3.321 N/A THR 315.A OG1 HIS 317.A O no hydrogen 3.563 N/A SER 319.A OG LYS 275.A O no hydrogen 3.125 N/A VAL 320.A N HIS 317.A O no hydrogen 2.792 N/A ARG 321.A N HIS 317.A O no hydrogen 3.098 N/A ASP 322.A N THR 318.A O no hydrogen 2.903 N/A LEU 324.A N VAL 320.A O no hydrogen 2.684 N/A VAL 325.A N ARG 321.A O no hydrogen 2.888 N/A LEU 327.A N GLY 323.A O no hydrogen 3.168 N/A ALA 328.A N LEU 324.A O no hydrogen 2.675 N/A SER 330.A N SER 326.A O no hydrogen 2.763 N/A SER 330.A OG SER 326.A O no hydrogen 3.115 N/A SER 330.A OG LEU 327.A O no hydrogen 2.260 N/A LEU 331.A N ALA 328.A O no hydrogen 2.906 N/A VAL 334.A N SER 349.A O no hydrogen 2.719 N/A SER 336.A N TYR 347.A O no hydrogen 3.092 N/A ASN 338.A N ALA 345.A O no hydrogen 3.005 N/A GLU 340.A N SER 343.A O no hydrogen 2.682 N/A SER 343.A N GLU 340.A O no hydrogen 3.468 N/A TYR 344.A N THR 315.A O no hydrogen 2.640 N/A ILE 346.A N ILE 313.A O no hydrogen 3.082 N/A TYR 347.A N SER 336.A O no hydrogen 2.810 N/A MET 348.A N ALA 311.A O no hydrogen 2.899 N/A SER 349.A N VAL 334.A O no hydrogen 3.048 N/A LEU 355.A N GLY 351.A O no hydrogen 2.934 N/A ASN 356.A N ASP 352.A O no hydrogen 2.858 N/A ASN 356.A ND2 GLU 290.A OE2 no hydrogen 2.710 N/A VAL 357.A N LEU 354.A O no hydrogen 3.086 N/A LEU 358.A N LEU 354.A O no hydrogen 2.907 N/A LEU 358.A N LEU 355.A O no hydrogen 2.515 N/A SER 359.A N LEU 355.A O no hydrogen 2.828 N/A SER 359.A OG LEU 355.A O no hydrogen 3.382 N/A LYS 360.A NZ GLU 290.A OE1 no hydrogen 2.775 N/A LYS 360.A NZ ASN 356.A O no hydrogen 3.028 N/A CYS 361.A SG ALA 294.A O no hydrogen 3.185 N/A ALA 362.A N ASP 298.A OD1 no hydrogen 3.336 N/A ALA 362.A N ASP 298.A OD2 no hydrogen 2.435 N/A GLY 363.A N ASP 298.A OD1 no hydrogen 2.601 N/A SER 364.A N ASP 219.A OD1 no hydrogen 2.746 N/A SER 364.A N SER 221.A OG no hydrogen 3.166 N/A LYS 365.A NZ SER 364.A OG no hydrogen 2.847 N/A LYS 366.A N GLY 363.A O no hydrogen 2.532 N/A LYS 366.A NZ ASP 298.A O no hydrogen 3.291 N/A ARG 368.A NH1 PHE 367.A O no hydrogen 2.468 N/A ARG 368.A NH2 ASP 305.A OD2 no hydrogen 2.587 N/A ARG 377.A NH1 LEU 331.A O no hydrogen 2.332 N/A ARG 380.A N TYR 166.A O no hydrogen 2.971 N/A ARG 380.A NE GLY 332.A O no hydrogen 3.202 N/A ARG 380.A NH2 GLY 350.A O no hydrogen 3.020 N/A PHE 382.A N GLN 164.A O no hydrogen 2.867 N/A GLU 385.A N VAL 51.A O no hydrogen 2.582 N/A GLN 387.A N SER 49.A O no hydrogen 3.429 N/A LEU 389.A N MET 47.A O no hydrogen 2.907 N/A LYS 390.A NZ GLU 391.A O no hydrogen 2.786 N/A ASP 392.A N GLU 45.A O no hydrogen 3.141 N/A TYR 395.A N PHE 2.A O no hydrogen 3.025 N/A GLY 396.A N PRO 41.A O no hydrogen 2.667 N/A LEU 399.A N ASN 417.A OD1 no hydrogen 3.023 N/A SER 400.A OG ASP 402.A OD2 no hydrogen 3.426 N/A ASP 402.A N SER 400.A OG no hydrogen 3.052 N/A SER 403.A OG SER 400.A OG no hydrogen 3.364 N/A HIS 405.A N SER 403.A OG no hydrogen 3.355 N/A GLN 406.A N ASP 404.A OD1 no hydrogen 2.766 N/A PHE 407.A N VAL 415.A O no hydrogen 3.255 N/A LEU 408.A N MET 28.A O no hydrogen 2.845 N/A LEU 409.A N VAL 413.A O no hydrogen 2.807 N/A ALA 410.A N ASN 7.A O no hydrogen 3.234 N/A GLN 412.A N LEU 409.A O no hydrogen 3.313 N/A VAL 413.A N ASN 411.A OD1 no hydrogen 2.956 N/A VAL 414.A N THR 165.A O no hydrogen 2.972 N/A ASN 417.A N HIS 405.A O no hydrogen 2.450 N/A ASN 417.A ND2 HIS 405.A O no hydrogen 3.103 N/A