Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4iu8_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 5.A NE1 PHE 140.A O no hydrogen 2.529 N/A TRP 13.A N ASN 9.A O no hydrogen 2.782 N/A GLU 14.A N PRO 10.A O no hydrogen 2.529 N/A ASN 15.A N ALA 11.A O no hydrogen 2.670 N/A ASN 15.A ND2 ALA 11.A O no hydrogen 3.475 N/A LYS 16.A N TRP 13.A O no hydrogen 3.148 N/A GLY 17.A N PHE 12.A O no hydrogen 2.863 N/A LYS 18.A N TRP 13.A O no hydrogen 2.779 N/A HIS 19.A N LYS 16.A O no hydrogen 2.459 N/A ILE 20.A N LYS 16.A O no hydrogen 3.272 N/A ILE 20.A N GLY 17.A O no hydrogen 3.136 N/A ALA 21.A N GLY 17.A O no hydrogen 2.976 N/A ARG 23.A N HIS 19.A O no hydrogen 3.347 N/A ARG 23.A NH1 GLY 215.A O no hydrogen 3.376 N/A ASN 24.A N ILE 20.A O no hydrogen 2.743 N/A ASN 24.A ND2 ILE 20.A O no hydrogen 2.751 N/A ASN 24.A ND2 ASN 216.A OD1 no hydrogen 2.723 N/A LEU 25.A N ALA 21.A O no hydrogen 2.685 N/A TRP 26.A N ARG 22.A O no hydrogen 3.469 N/A SER 28.A N ASN 24.A O no hydrogen 2.966 N/A SER 28.A OG SER 135.A OG no hydrogen 2.391 N/A SER 28.A OG ASN 154.A OD1 no hydrogen 2.585 N/A VAL 29.A N LEU 25.A O no hydrogen 3.169 N/A SER 30.A OG TRP 26.A O no hydrogen 3.099 N/A CYS 31.A N ILE 27.A O no hydrogen 2.907 N/A CYS 31.A SG ILE 27.A O no hydrogen 3.698 N/A CYS 31.A SG ALA 208.A O no hydrogen 3.484 N/A LEU 32.A N VAL 29.A O no hydrogen 2.699 N/A LEU 33.A N VAL 29.A O no hydrogen 2.467 N/A LEU 34.A N SER 30.A O no hydrogen 3.123 N/A PHE 36.A N LEU 32.A O no hydrogen 2.758 N/A CYS 37.A N LEU 33.A O no hydrogen 2.816 N/A CYS 37.A SG LEU 33.A O no hydrogen 3.497 N/A CYS 37.A SG GLY 161.A O no hydrogen 3.222 N/A VAL 38.A N LEU 34.A O no hydrogen 2.883 N/A TRP 39.A N ALA 35.A O no hydrogen 2.913 N/A SER 42.A OG SER 238.A O no hydrogen 3.248 N/A ALA 43.A N LEU 40.A O no hydrogen 3.175 N/A VAL 44.A N LEU 40.A O no hydrogen 3.171 N/A THR 45.A OG1 PHE 41.A O no hydrogen 2.028 N/A ASN 47.A N ALA 43.A O no hydrogen 3.368 N/A ASN 49.A ND2 PHE 55.A O no hydrogen 3.493 N/A LYS 50.A NZ ASN 47.A OD1 no hydrogen 3.449 N/A ILE 51.A N LEU 48.A O no hydrogen 3.238 N/A ASN 54.A ND2 GLY 52.A O no hydrogen 3.676 N/A ASN 54.A ND2 PHE 53.A O no hydrogen 2.584 N/A PHE 55.A N ASN 49.A OD1 no hydrogen 2.851 N/A THR 56.A N GLN 59.A OE1 no hydrogen 2.957 N/A THR 56.A OG1 ASP 58.A OD1 no hydrogen 2.577 N/A ASP 58.A N THR 56.A OG1 no hydrogen 2.719 N/A GLN 59.A N THR 56.A OG1 no hydrogen 2.887 N/A LEU 60.A N THR 56.A O no hydrogen 3.102 N/A LEU 62.A N ASP 58.A O no hydrogen 3.138 N/A LEU 63.A N GLN 59.A O no hydrogen 2.807 N/A THR 64.A N LEU 60.A O no hydrogen 3.095 N/A THR 64.A OG1 PHE 61.A O no hydrogen 2.857 N/A ALA 65.A N PHE 61.A O no hydrogen 2.854 N/A ALA 65.A N LEU 62.A O no hydrogen 2.708 N/A LEU 66.A N LEU 63.A O no hydrogen 3.400 N/A SER 68.A OG GLY 372.A O no hydrogen 2.886 N/A VAL 69.A N LEU 66.A O no hydrogen 3.167 N/A SER 70.A OG PRO 67.A O no hydrogen 3.282 N/A SER 70.A OG LEU 123.A O no hydrogen 2.695 N/A GLY 71.A N PRO 67.A O no hydrogen 2.649 N/A ALA 72.A N SER 68.A O no hydrogen 2.852 N/A ALA 72.A N VAL 69.A O no hydrogen 3.327 N/A LEU 73.A N VAL 69.A O no hydrogen 3.249 N/A LEU 74.A N SER 70.A O no hydrogen 2.949 N/A ARG 75.A N GLY 71.A O no hydrogen 2.898 N/A ARG 75.A NE GLY 129.A O no hydrogen 2.970 N/A ARG 75.A NH1 SER 365.A O no hydrogen 3.492 N/A ARG 75.A NH2 GLY 129.A O no hydrogen 3.173 N/A VAL 76.A N LEU 73.A O no hydrogen 3.370 N/A TYR 78.A N LEU 74.A O no hydrogen 3.099 N/A SER 79.A N VAL 76.A O no hydrogen 2.878 N/A SER 79.A OG ARG 75.A O no hydrogen 3.361 N/A SER 79.A OG VAL 76.A O no hydrogen 2.842 N/A GLY 85.A N VAL 81.A O no hydrogen 2.217 N/A TRP 89.A N GLY 85.A O no hydrogen 2.900 N/A THR 90.A N GLY 86.A O no hydrogen 3.411 N/A THR 90.A OG1 GLY 86.A O no hydrogen 3.027 N/A VAL 91.A N ARG 87.A O no hydrogen 3.399 N/A VAL 91.A N ARG 88.A O no hydrogen 3.129 N/A PHE 92.A N ARG 88.A O no hydrogen 3.248 N/A SER 93.A N TRP 89.A O no hydrogen 2.893 N/A SER 93.A OG TRP 89.A O no hydrogen 2.829 N/A THR 94.A N VAL 91.A O no hydrogen 2.871 N/A THR 94.A OG1 THR 90.A O no hydrogen 2.788 N/A ALA 95.A N VAL 91.A O no hydrogen 2.715 N/A ILE 96.A N PHE 92.A O no hydrogen 2.760 N/A LEU 97.A N THR 94.A O no hydrogen 3.124 N/A ILE 98.A N ALA 95.A O no hydrogen 2.921 N/A CYS 101.A SG ALA 198.A O no hydrogen 3.567 N/A VAL 102.A N ILE 98.A O no hydrogen 2.846 N/A TRP 103.A N ILE 99.A O no hydrogen 3.058 N/A LEU 104.A N PRO 100.A O no hydrogen 2.696 N/A GLY 105.A N CYS 101.A O no hydrogen 3.140 N/A ILE 106.A N VAL 102.A O no hydrogen 3.055 N/A ALA 107.A N TRP 103.A O no hydrogen 2.833 N/A VAL 108.A N LEU 104.A O no hydrogen 2.883 N/A GLN 109.A N ILE 106.A O no hydrogen 3.000 N/A GLN 109.A NE2 GLY 181.A O no hydrogen 3.502 N/A ASN 110.A N ALA 107.A O no hydrogen 2.800 N/A ASN 110.A ND2 ILE 106.A O no hydrogen 3.465 N/A ILE 117.A N PRO 114.A O no hydrogen 3.087 N/A ILE 119.A N PHE 115.A O no hydrogen 3.066 N/A VAL 120.A N GLY 116.A O no hydrogen 3.017 N/A ILE 121.A N ILE 117.A O no hydrogen 2.944 N/A ALA 122.A N PHE 118.A O no hydrogen 2.555 N/A LEU 123.A N ILE 119.A O no hydrogen 2.930 N/A LEU 124.A N VAL 120.A O no hydrogen 2.908 N/A CYS 125.A N ALA 122.A O no hydrogen 3.101 N/A CYS 125.A SG VAL 38.A O no hydrogen 3.968 N/A CYS 125.A SG ILE 121.A O no hydrogen 3.535 N/A GLY 126.A N ALA 122.A O no hydrogen 3.122 N/A GLY 129.A N GLY 126.A O no hydrogen 2.900 N/A ALA 130.A N PHE 127.A O no hydrogen 2.742 N/A ASN 131.A ND2 SER 93.A O no hydrogen 2.827 N/A ALA 133.A N ALA 130.A O no hydrogen 3.165 N/A SER 134.A OG TYR 78.A O no hydrogen 2.800 N/A ILE 138.A N SER 135.A O no hydrogen 3.428 N/A PHE 142.A N SER 139.A O no hydrogen 2.894 N/A LYS 144.A N GLU 8.A OE1 no hydrogen 3.334 N/A ALA 150.A N LYS 146.A O no hydrogen 2.759 N/A LEU 151.A N GLN 147.A O no hydrogen 3.185 N/A GLY 152.A N GLY 148.A O no hydrogen 3.055 N/A ILE 153.A N SER 149.A O no hydrogen 3.003 N/A ILE 153.A N ALA 150.A O no hydrogen 3.019 N/A ASN 154.A N ALA 150.A O no hydrogen 2.992 N/A ASN 154.A ND2 SER 135.A OG no hydrogen 2.873 N/A GLY 155.A N LEU 151.A O no hydrogen 2.630 N/A GLY 156.A N GLY 152.A O no hydrogen 2.976 N/A GLY 158.A N ASN 154.A O no hydrogen 3.366 N/A GLY 158.A N GLY 155.A O no hydrogen 3.170 N/A ASN 159.A N GLY 155.A O no hydrogen 3.477 N/A GLY 161.A N GLY 158.A O no hydrogen 2.984 N/A VAL 164.A N LEU 160.A O no hydrogen 2.765 N/A GLN 165.A NE2 SER 42.A OG no hydrogen 2.921 N/A GLN 165.A NE2 SER 238.A O no hydrogen 3.027 N/A LEU 166.A N SER 163.A O no hydrogen 3.152 N/A VAL 167.A N VAL 164.A O no hydrogen 3.194 N/A LEU 170.A N VAL 167.A O no hydrogen 2.828 N/A VAL 171.A N VAL 167.A O no hydrogen 3.088 N/A PHE 173.A N LEU 170.A O no hydrogen 3.169 N/A VAL 174.A N VAL 171.A O no hydrogen 3.119 N/A VAL 176.A N VAL 174.A O no hydrogen 2.601 N/A LEU 180.A N PHE 177.A O no hydrogen 2.522 N/A GLY 181.A N ALA 178.A O no hydrogen 2.684 N/A ASN 183.A ND2 GLN 109.A O no hydrogen 2.924 N/A GLN 187.A N SER 191.A O no hydrogen 3.151 N/A GLN 187.A NE2 VAL 185.A O no hydrogen 3.694 N/A GLY 190.A N GLN 187.A O no hydrogen 2.788 N/A SER 193.A OG ASN 183.A O no hydrogen 2.950 N/A ASN 196.A ND2 VAL 171.A O no hydrogen 3.036 N/A ALA 197.A N LEU 194.A O no hydrogen 3.025 N/A ALA 198.A N ALA 195.A O no hydrogen 2.816 N/A TRP 199.A NE1 VAL 102.A O no hydrogen 3.181 N/A VAL 202.A N TRP 199.A O no hydrogen 2.867 N/A LEU 205.A N TRP 201.A O no hydrogen 2.641 N/A ALA 206.A N VAL 202.A O no hydrogen 2.827 N/A ILE 207.A N PRO 203.A O no hydrogen 2.871 N/A ALA 208.A N LEU 204.A O no hydrogen 2.984 N/A THR 209.A N LEU 205.A O no hydrogen 2.729 N/A THR 209.A OG1 VAL 91.A O no hydrogen 3.427 N/A ILE 210.A N ALA 206.A O no hydrogen 2.775 N/A ALA 211.A N ILE 207.A O no hydrogen 2.812 N/A ALA 212.A N ALA 208.A O no hydrogen 2.780 N/A TRP 213.A N THR 209.A O no hydrogen 3.259 N/A SER 214.A N ILE 210.A O no hydrogen 3.123 N/A SER 214.A OG ILE 210.A O no hydrogen 3.266 N/A LEU 225.A N LEU 222.A O no hydrogen 2.680 N/A LEU 228.A N SER 224.A O no hydrogen 3.116 N/A THR 230.A N TYR 227.A O no hydrogen 2.671 N/A PHE 231.A N LEU 228.A O no hydrogen 3.442 N/A GLY 232.A N LEU 228.A O no hydrogen 2.806 N/A SER 233.A OG ALA 229.A O no hydrogen 2.856 N/A SER 233.A OG TYR 397.A OH no hydrogen 2.704 N/A ILE 235.A N PHE 231.A O no hydrogen 3.025 N/A GLY 236.A N GLY 232.A O no hydrogen 2.705 N/A PHE 237.A N SER 233.A O no hydrogen 3.046 N/A SER 238.A N PHE 234.A O no hydrogen 2.916 N/A SER 238.A OG PHE 234.A O no hydrogen 2.618 N/A ALA 239.A N ILE 235.A O no hydrogen 2.757 N/A GLY 240.A N GLY 236.A O no hydrogen 3.205 N/A ALA 244.A N PHE 241.A O no hydrogen 2.705 N/A LYS 245.A NZ VAL 251.A O no hydrogen 3.272 N/A THR 246.A N LEU 243.A O no hydrogen 3.159 N/A THR 246.A OG1 LEU 243.A O no hydrogen 3.152 N/A GLN 247.A N LEU 243.A O no hydrogen 3.164 N/A PHE 248.A N ALA 244.A O no hydrogen 3.312 N/A VAL 251.A N PHE 248.A O no hydrogen 2.899 N/A ARG 255.A N ASN 252.A O no hydrogen 3.351 N/A LEU 256.A N ILE 253.A O no hydrogen 2.539 N/A ALA 257.A N ILE 253.A O no hydrogen 2.881 N/A PHE 259.A N LEU 256.A O no hydrogen 3.368 N/A PHE 262.A N PHE 258.A O no hydrogen 3.065 N/A ILE 263.A N PHE 259.A O no hydrogen 2.621 N/A GLY 264.A N GLY 260.A O no hydrogen 2.885 N/A ALA 265.A N PRO 261.A O no hydrogen 2.658 N/A ALA 267.A N ILE 263.A O no hydrogen 2.971 N/A ARG 268.A N GLY 264.A O no hydrogen 3.033 N/A ARG 268.A N ALA 265.A O no hydrogen 3.297 N/A ARG 268.A NH1 TYR 227.A OH no hydrogen 2.409 N/A SER 269.A N ILE 266.A O no hydrogen 2.977 N/A ILE 274.A N VAL 270.A O no hydrogen 3.019 N/A ASP 276.A N GLY 272.A O no hydrogen 2.855 N/A PHE 278.A N ASP 276.A O no hydrogen 2.504 N/A GLY 279.A N ASP 276.A O no hydrogen 3.187 N/A THR 284.A OG1 VAL 281.A O no hydrogen 3.501 N/A ILE 286.A N ARG 282.A O no hydrogen 3.479 N/A ASN 287.A N VAL 283.A O no hydrogen 2.692 N/A ASN 287.A ND2 THR 321.A O no hydrogen 3.388 N/A PHE 288.A N THR 284.A O no hydrogen 2.704 N/A ILE 289.A N LEU 285.A O no hydrogen 2.640 N/A PHE 293.A N PHE 290.A O no hydrogen 2.567 N/A ALA 295.A N ALA 291.A O no hydrogen 2.941 N/A LEU 296.A N ILE 292.A O no hydrogen 2.751 N/A LEU 297.A N PHE 293.A O no hydrogen 2.915 N/A PHE 298.A N ALA 295.A O no hydrogen 2.844 N/A LEU 299.A N LEU 296.A O no hydrogen 2.684 N/A THR 300.A N LEU 297.A O no hydrogen 3.432 N/A THR 300.A OG1 THR 300.A O no hydrogen 2.401 N/A PHE 312.A N ASN 308.A O no hydrogen 3.182 N/A TYR 313.A N PHE 309.A O no hydrogen 2.749 N/A TYR 313.A OH LEU 256.A O no hydrogen 2.906 N/A VAL 315.A N ALA 311.A O no hydrogen 2.934 N/A PHE 316.A N PHE 312.A O no hydrogen 3.038 N/A LEU 318.A N VAL 315.A O no hydrogen 2.914 N/A PHE 319.A N PHE 316.A O no hydrogen 2.826 N/A THR 321.A N GLY 317.A O no hydrogen 3.017 N/A THR 321.A OG1 GLY 317.A O no hydrogen 3.213 N/A THR 321.A OG1 LEU 318.A O no hydrogen 3.147 N/A ALA 322.A N LEU 318.A O no hydrogen 3.193 N/A GLY 323.A N LEU 320.A O no hydrogen 3.203 N/A LEU 324.A N LEU 320.A O no hydrogen 3.091 N/A GLY 325.A N THR 321.A O no hydrogen 3.425 N/A SER 326.A OG ALA 322.A O no hydrogen 3.404 N/A SER 326.A OG GLY 323.A O no hydrogen 2.594 N/A GLY 327.A N GLY 323.A O no hydrogen 3.446 N/A SER 328.A N LEU 324.A O no hydrogen 2.845 N/A SER 328.A OG GLY 325.A O no hydrogen 3.081 N/A THR 329.A N GLY 325.A O no hydrogen 2.357 N/A THR 329.A OG1 GLY 325.A O no hydrogen 3.225 N/A GLN 331.A N GLY 327.A O no hydrogen 3.125 N/A ALA 333.A N PHE 330.A O no hydrogen 3.061 N/A ALA 333.A N GLN 331.A O no hydrogen 3.194 N/A VAL 334.A N GLN 331.A O no hydrogen 3.268 N/A PHE 336.A N ILE 332.A O no hydrogen 2.910 N/A ARG 337.A N ALA 333.A O no hydrogen 2.646 N/A GLN 338.A N VAL 334.A O no hydrogen 2.755 N/A ILE 339.A N ILE 335.A O no hydrogen 2.958 N/A THR 340.A N PHE 336.A O no hydrogen 3.297 N/A THR 340.A OG1 PHE 336.A O no hydrogen 3.375 N/A ILE 341.A N ARG 337.A O no hydrogen 2.749 N/A TYR 342.A N GLN 338.A O no hydrogen 2.643 N/A LYS 345.A N ILE 341.A O no hydrogen 3.348 N/A LYS 345.A N TYR 342.A O no hydrogen 2.671 N/A GLY 347.A N VAL 344.A O no hydrogen 3.237 N/A LYS 351.A N GLN 348.A O no hydrogen 3.302 N/A GLU 352.A N GLN 348.A O no hydrogen 2.773 N/A THR 355.A N LYS 351.A O no hydrogen 3.465 N/A THR 357.A N ALA 353.A O no hydrogen 2.551 N/A THR 357.A OG1 ALA 333.A O no hydrogen 3.514 N/A ALA 358.A N VAL 354.A O no hydrogen 3.430 N/A ALA 359.A N GLU 356.A O no hydrogen 3.021 N/A ALA 360.A N GLU 356.A O no hydrogen 2.876 N/A LEU 361.A N THR 357.A O no hydrogen 3.064 N/A GLY 362.A N ALA 359.A O no hydrogen 2.504 N/A SER 365.A N LEU 361.A O no hydrogen 3.193 N/A SER 365.A N GLY 362.A O no hydrogen 3.054 N/A SER 365.A OG LEU 361.A O no hydrogen 3.568 N/A ALA 366.A N GLY 362.A O no hydrogen 2.871 N/A ILE 367.A N PHE 363.A O no hydrogen 3.029 N/A GLY 368.A N ILE 364.A O no hydrogen 2.912 N/A ALA 369.A N SER 365.A O no hydrogen 2.875 N/A VAL 370.A N ILE 367.A O no hydrogen 2.777 N/A PHE 373.A N VAL 370.A O no hydrogen 3.265 N/A PHE 374.A N VAL 370.A O no hydrogen 3.187 N/A ILE 375.A N GLY 371.A O no hydrogen 2.585 N/A GLN 377.A N PHE 373.A O no hydrogen 3.182 N/A ALA 378.A N PHE 374.A O no hydrogen 2.653 N/A PHE 379.A N ILE 375.A O no hydrogen 3.158 N/A GLY 380.A N PRO 376.A O no hydrogen 2.811 N/A SER 381.A OG SER 386.A O no hydrogen 2.332 N/A SER 381.A OG PRO 387.A O no hydrogen 2.116 N/A LEU 382.A N PHE 379.A O no hydrogen 3.046 N/A ASN 383.A N GLY 380.A O no hydrogen 2.933 N/A THR 384.A OG1 SER 381.A O no hydrogen 2.913 N/A GLY 385.A N THR 384.A OG1 no hydrogen 2.511 N/A SER 386.A N THR 384.A OG1 no hydrogen 3.161 N/A ALA 390.A N PRO 387.A O no hydrogen 3.427 N/A PHE 393.A N ALA 390.A O no hydrogen 3.088 N/A ILE 395.A N LYS 391.A O no hydrogen 2.866 N/A PHE 396.A N VAL 392.A O no hydrogen 2.987 N/A TYR 397.A N PHE 393.A O no hydrogen 3.188 N/A TYR 397.A OH SER 233.A OG no hydrogen 2.704 N/A ILE 398.A N LEU 394.A O no hydrogen 3.217 N/A VAL 399.A N ILE 395.A O no hydrogen 2.854 N/A CYS 400.A N PHE 396.A O no hydrogen 2.771 N/A CYS 400.A SG PHE 396.A O no hydrogen 3.353 N/A VAL 401.A N TYR 397.A O no hydrogen 2.413 N/A LEU 402.A N ILE 398.A O no hydrogen 2.627 N/A LEU 403.A N VAL 399.A O no hydrogen 2.732 N/A THR 404.A N CYS 400.A O no hydrogen 3.127 N/A THR 404.A OG1 CYS 400.A O no hydrogen 2.983 N/A THR 404.A OG1 VAL 401.A O no hydrogen 3.120 N/A TRP 405.A N LEU 402.A O no hydrogen 3.100 N/A TYR 408.A N TRP 405.A O no hydrogen 2.779 N/A