Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3lut_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 4.A N THR 15.A O no hydrogen 2.721 N/A ILE 6.A N PHE 13.A O no hydrogen 2.772 N/A ASN 7.A N TYR 45.A O no hydrogen 2.664 N/A ASN 7.A ND2 GLU 44.A OE2 no hydrogen 2.763 N/A ILE 8.A N LEU 11.A O no hydrogen 3.031 N/A SER 9.A N PHE 47.A O no hydrogen 3.071 N/A SER 9.A OG PHE 47.A O no hydrogen 3.464 N/A SER 9.A OG ARG 49.A O no hydrogen 2.658 N/A GLY 10.A N ASN 7.A OD1 no hydrogen 2.689 N/A LEU 11.A N ILE 8.A O no hydrogen 3.236 N/A ARG 12.A NE GLU 14.A OE1 no hydrogen 3.152 N/A ARG 12.A NH2 GLU 14.A OE1 no hydrogen 3.252 N/A PHE 13.A N ILE 6.A O no hydrogen 2.639 N/A THR 15.A N VAL 4.A O no hydrogen 3.079 N/A LEU 17.A N GLU 2.A O no hydrogen 2.890 N/A LEU 20.A N LEU 17.A O no hydrogen 3.209 N/A ALA 21.A N LEU 17.A O no hydrogen 2.995 N/A GLN 22.A NE2 TYR 61.A O no hydrogen 2.526 N/A PHE 23.A N LEU 20.A O no hydrogen 3.187 N/A THR 26.A N PHE 23.A O no hydrogen 3.155 N/A THR 26.A OG1 PHE 23.A O no hydrogen 2.575 N/A THR 26.A OG1 TYR 61.A OH no hydrogen 2.592 N/A LEU 27.A N TYR 85.A O no hydrogen 3.037 N/A GLY 29.A N THR 26.A OG1 no hydrogen 3.223 N/A ASP 30.A N LEU 27.A O no hydrogen 3.225 N/A LYS 33.A N ASP 30.A OD1 no hydrogen 3.286 N/A LYS 33.A NZ GLU 25.A O no hydrogen 2.749 N/A LYS 33.A NZ GLU 86.A OE1 no hydrogen 3.145 N/A ARG 34.A N ASP 30.A O no hydrogen 2.973 N/A ARG 34.A NE TYR 45.A OH no hydrogen 3.110 N/A ARG 34.A NH1 LEU 28.A O no hydrogen 2.616 N/A MET 35.A N PRO 31.A O no hydrogen 2.983 N/A TYR 37.A N ARG 34.A O no hydrogen 2.824 N/A PHE 38.A N MET 35.A O no hydrogen 3.429 N/A ASP 39.A N GLU 44.A O no hydrogen 2.730 N/A LEU 41.A N ASP 39.A OD1 no hydrogen 2.701 N/A ARG 42.A N ASP 39.A O no hydrogen 3.291 N/A ARG 42.A N ASP 39.A OD1 no hydrogen 3.166 N/A ARG 42.A NE ASP 39.A OD2 no hydrogen 2.967 N/A ASN 43.A N ASP 39.A O no hydrogen 2.824 N/A GLU 44.A N ASP 39.A O no hydrogen 3.435 N/A TYR 45.A N VAL 5.A O no hydrogen 2.748 N/A PHE 46.A N TYR 37.A O no hydrogen 2.876 N/A PHE 47.A N ASN 7.A O no hydrogen 2.938 N/A ARG 49.A NH1 GLU 81.A OE1 no hydrogen 2.677 N/A ARG 51.A NE SER 9.A O no hydrogen 3.191 N/A SER 53.A N ASN 50.A OD1 no hydrogen 3.082 N/A SER 53.A OG ASN 50.A OD1 no hydrogen 2.860 N/A PHE 54.A N ARG 51.A O no hydrogen 3.249 N/A ALA 56.A N SER 53.A O no hydrogen 2.972 N/A ILE 57.A N SER 53.A O no hydrogen 3.451 N/A LEU 58.A N PHE 54.A O no hydrogen 2.794 N/A TYR 59.A N ASP 55.A O no hydrogen 3.152 N/A TYR 60.A N ALA 56.A O no hydrogen 2.839 N/A TYR 61.A OH THR 26.A OG1 no hydrogen 2.592 N/A GLN 62.A N LEU 58.A O no hydrogen 3.183 N/A SER 63.A N TYR 59.A O no hydrogen 2.665 N/A SER 63.A OG TYR 59.A O no hydrogen 2.699 N/A SER 63.A OG TYR 60.A O no hydrogen 3.115 N/A SER 63.A OG ARG 66.A O no hydrogen 3.474 N/A GLY 64.A N TYR 61.A O no hydrogen 3.314 N/A ARG 66.A N SER 63.A OG no hydrogen 2.834 N/A ARG 66.A NH1 TYR 59.A OH no hydrogen 3.358 N/A ARG 69.A NE GLU 99.A OE2 no hydrogen 2.815 N/A ARG 69.A NH1 VAL 73.A O no hydrogen 2.490 N/A ARG 69.A NH2 GLU 99.A OE2 no hydrogen 2.705 N/A VAL 73.A N PRO 70.A O no hydrogen 2.767 N/A ILE 77.A N ASP 76.A OD1 no hydrogen 2.826 N/A PHE 78.A N PRO 74.A O no hydrogen 3.120 N/A SER 79.A N LEU 75.A O no hydrogen 3.073 N/A SER 79.A OG LEU 75.A O no hydrogen 3.138 N/A SER 79.A OG ASP 76.A O no hydrogen 2.663 N/A GLU 80.A N ASP 76.A O no hydrogen 3.254 N/A GLU 81.A N ILE 77.A O no hydrogen 3.152 N/A ILE 82.A N PHE 78.A O no hydrogen 3.092 N/A ARG 83.A N SER 79.A O no hydrogen 3.073 N/A PHE 84.A N GLU 80.A O no hydrogen 2.881 N/A TYR 85.A N GLU 81.A O no hydrogen 2.853 N/A GLU 86.A N ARG 83.A O no hydrogen 3.259 N/A LEU 87.A N ILE 82.A O no hydrogen 3.244 N/A MET 92.A N GLY 88.A O no hydrogen 3.024 N/A GLU 93.A N GLU 89.A O no hydrogen 3.055 N/A MET 94.A N GLU 90.A O no hydrogen 3.080 N/A PHE 95.A N ALA 91.A O no hydrogen 3.091 N/A ARG 96.A N MET 92.A O no hydrogen 2.869 N/A GLU 97.A N GLU 93.A O no hydrogen 2.890 N/A ASP 98.A N MET 94.A O no hydrogen 2.895 N/A GLU 99.A N PHE 95.A O no hydrogen 2.696 N/A TYR 101.A N ARG 96.A O no hydrogen 3.023 N/A GLU 113.A N LEU 109.A O no hydrogen 3.442 N/A GLN 115.A NE2 PHE 211.A O no hydrogen 3.123 N/A LEU 120.A N GLN 117.A O no hydrogen 2.419 N/A LEU 121.A N GLN 117.A O no hydrogen 2.868 N/A PHE 122.A N TRP 119.A O no hydrogen 3.315 N/A TYR 124.A N LEU 120.A O no hydrogen 3.032 N/A SER 127.A OG GLU 123.A O no hydrogen 2.839 N/A SER 127.A OG GLU 123.A OE2 no hydrogen 2.732 N/A ALA 135.A N ARG 132.A O no hydrogen 2.946 N/A VAL 137.A N ILE 133.A O no hydrogen 3.211 N/A SER 138.A N ILE 134.A O no hydrogen 3.250 N/A SER 138.A OG ILE 134.A O no hydrogen 3.253 N/A SER 138.A OG ALA 135.A O no hydrogen 2.852 N/A VAL 139.A N ALA 135.A O no hydrogen 3.359 N/A MET 140.A N ILE 136.A O no hydrogen 3.203 N/A VAL 141.A N VAL 137.A O no hydrogen 2.788 N/A ILE 142.A N SER 138.A O no hydrogen 3.021 N/A LEU 143.A N VAL 139.A O no hydrogen 2.939 N/A ILE 144.A N MET 140.A O no hydrogen 2.818 N/A SER 145.A N VAL 141.A O no hydrogen 2.782 N/A SER 145.A OG VAL 141.A O no hydrogen 2.469 N/A ILE 146.A N ILE 142.A O no hydrogen 2.778 N/A VAL 147.A N LEU 143.A O no hydrogen 2.939 N/A SER 148.A N ILE 144.A O no hydrogen 2.993 N/A PHE 149.A N SER 145.A O no hydrogen 3.018 N/A CYS 150.A N ILE 146.A O no hydrogen 3.012 N/A CYS 150.A SG ILE 146.A O no hydrogen 2.989 N/A LEU 151.A N VAL 147.A O no hydrogen 3.124 N/A GLU 152.A N SER 148.A O no hydrogen 2.943 N/A THR 153.A N PHE 149.A O no hydrogen 3.034 N/A THR 153.A N CYS 150.A O no hydrogen 3.198 N/A THR 153.A OG1 PHE 149.A O no hydrogen 3.050 N/A THR 153.A OG1 GLU 152.A OE2 no hydrogen 2.825 N/A LEU 154.A N LEU 151.A O no hydrogen 3.326 N/A GLY 166.A N HIS 165.A ND1 no hydrogen 3.193 N/A GLY 168.A N GLY 166.A O no hydrogen 2.851 N/A SER 175.A N HIS 172.A O no hydrogen 3.354 N/A SER 177.A OG TYR 174.A O no hydrogen 2.832 N/A GLN 183.A NE2 GLU 160.A OE2 no hydrogen 3.406 N/A PHE 191.A N THR 188.A O no hydrogen 2.901 N/A PHE 192.A N THR 188.A O no hydrogen 2.709 N/A ILE 193.A N ASP 189.A O no hydrogen 2.655 N/A VAL 194.A N PRO 190.A O no hydrogen 3.100 N/A GLU 195.A N PHE 191.A O no hydrogen 2.963 N/A THR 196.A N PHE 192.A O no hydrogen 2.627 N/A THR 196.A OG1 PHE 192.A O no hydrogen 2.725 N/A THR 196.A OG1 ILE 193.A O no hydrogen 3.101 N/A LEU 197.A N ILE 193.A O no hydrogen 2.951 N/A CYS 198.A N VAL 194.A O no hydrogen 3.221 N/A CYS 198.A SG GLU 195.A O no hydrogen 3.040 N/A ILE 199.A N GLU 195.A O no hydrogen 3.099 N/A TRP 201.A N LEU 197.A O no hydrogen 3.280 N/A PHE 202.A N CYS 198.A O no hydrogen 2.859 N/A SER 203.A N ILE 199.A O no hydrogen 2.929 N/A PHE 204.A N ILE 200.A O no hydrogen 2.731 N/A GLU 205.A N TRP 201.A O no hydrogen 2.995 N/A PHE 206.A N PHE 202.A O no hydrogen 2.771 N/A LEU 207.A N SER 203.A O no hydrogen 2.582 N/A VAL 208.A N PHE 204.A O no hydrogen 2.753 N/A ARG 209.A N GLU 205.A O no hydrogen 2.529 N/A PHE 210.A N LEU 207.A O no hydrogen 3.438 N/A PHE 211.A N VAL 208.A O no hydrogen 2.659 N/A CYS 213.A SG ALA 212.A O no hydrogen 3.020 N/A ILE 226.A N ASN 222.A O no hydrogen 3.172 N/A ILE 227.A N ILE 223.A O no hydrogen 2.879 N/A ASP 228.A N MET 224.A O no hydrogen 2.983 N/A ILE 229.A N ASN 225.A O no hydrogen 3.052 N/A VAL 230.A N ILE 226.A O no hydrogen 3.009 N/A ALA 231.A N ASP 228.A O no hydrogen 3.508 N/A ILE 233.A N ILE 229.A O no hydrogen 3.230 N/A PHE 236.A N ILE 232.A O no hydrogen 2.998 N/A ILE 237.A N ILE 233.A O no hydrogen 3.022 N/A THR 238.A N PRO 234.A O no hydrogen 2.799 N/A GLY 240.A N ILE 237.A O no hydrogen 3.195 N/A GLN 251.A N PRO 247.A O no hydrogen 2.345 N/A GLN 252.A N GLU 248.A O no hydrogen 2.513 N/A MET 257.A N GLN 254.A O no hydrogen 2.580 N/A LEU 262.A N SER 258.A O no hydrogen 2.533 N/A ARG 263.A N LEU 259.A O no hydrogen 2.773 N/A VAL 264.A N ALA 260.A O no hydrogen 2.969 N/A ILE 265.A N ILE 261.A O no hydrogen 3.193 N/A VAL 268.A N VAL 264.A O no hydrogen 2.738 N/A ARG 269.A NH2 GLU 152.A OE2 no hydrogen 3.402 N/A ARG 269.A NH2 GLU 195.A OE2 no hydrogen 2.708 N/A VAL 270.A N ARG 266.A O no hydrogen 2.918 N/A PHE 271.A N LEU 267.A O no hydrogen 3.033 N/A ARG 272.A N ARG 269.A O no hydrogen 3.218 N/A PHE 274.A N PHE 271.A O no hydrogen 3.234 N/A LYS 275.A N ARG 272.A O no hydrogen 3.283 N/A LYS 275.A NZ ASP 228.A OD1 no hydrogen 3.037 N/A LYS 275.A NZ ASP 228.A OD2 no hydrogen 2.491 N/A LEU 276.A N ILE 273.A O no hydrogen 3.063 N/A SER 277.A N PHE 274.A O no hydrogen 2.882 N/A SER 277.A OG PHE 274.A O no hydrogen 3.314 N/A ARG 278.A N LYS 275.A O no hydrogen 3.435 N/A HIS 279.A N LEU 276.A O no hydrogen 2.819 N/A LEU 283.A N SER 280.A OG no hydrogen 3.318 N/A GLN 284.A N SER 280.A O no hydrogen 3.365 N/A ILE 285.A N LYS 281.A O no hydrogen 2.847 N/A LEU 286.A N GLY 282.A O no hydrogen 2.637 N/A GLY 287.A N LEU 283.A O no hydrogen 2.774 N/A GLN 288.A N GLN 284.A O no hydrogen 3.136 N/A THR 289.A N ILE 285.A O no hydrogen 3.256 N/A THR 289.A OG1 LEU 286.A O no hydrogen 2.490 N/A LEU 290.A N LEU 286.A O no hydrogen 3.249 N/A LYS 291.A N GLY 287.A O no hydrogen 2.849 N/A ALA 292.A N GLN 288.A O no hydrogen 3.103 N/A SER 293.A N LEU 290.A O no hydrogen 3.051 N/A SER 293.A OG THR 289.A O no hydrogen 2.748 N/A GLU 296.A N GLU 296.A OE1 no hydrogen 2.640 N/A LEU 297.A N SER 293.A O no hydrogen 3.196 N/A GLY 298.A N MET 294.A O no hydrogen 2.573 N/A LEU 299.A N ARG 295.A O no hydrogen 3.026 N/A LEU 300.A N GLU 296.A O no hydrogen 3.271 N/A ILE 301.A N LEU 297.A O no hydrogen 3.292 N/A PHE 302.A N GLY 298.A O no hydrogen 3.136 N/A PHE 303.A N LEU 299.A O no hydrogen 2.662 N/A LEU 304.A N LEU 300.A O no hydrogen 2.823 N/A PHE 305.A N ILE 301.A O no hydrogen 2.823 N/A ILE 306.A N PHE 302.A O no hydrogen 3.106 N/A GLY 307.A N PHE 303.A O no hydrogen 2.896 N/A VAL 308.A N LEU 304.A O no hydrogen 2.721 N/A ILE 309.A N PHE 305.A O no hydrogen 2.912 N/A LEU 310.A N ILE 306.A O no hydrogen 3.041 N/A PHE 311.A N GLY 307.A O no hydrogen 2.894 N/A SER 312.A N VAL 308.A O no hydrogen 3.023 N/A SER 312.A N ILE 309.A O no hydrogen 3.098 N/A SER 312.A OG VAL 308.A O no hydrogen 2.719 N/A SER 312.A OG ALA 333.A O no hydrogen 3.081 N/A SER 313.A N ILE 309.A O no hydrogen 3.103 N/A SER 313.A N LEU 310.A O no hydrogen 3.066 N/A SER 313.A OG ILE 309.A O no hydrogen 3.265 N/A SER 313.A OG LEU 310.A O no hydrogen 2.678 N/A TYR 316.A N SER 312.A O no hydrogen 3.134 N/A PHE 317.A N SER 313.A O no hydrogen 3.261 N/A ALA 318.A N VAL 315.A O no hydrogen 3.033 N/A SER 325.A OG GLU 319.A O no hydrogen 3.430 N/A SER 329.A OG ASP 332.A OD2 no hydrogen 2.634 N/A ASP 332.A N SER 329.A O no hydrogen 2.812 N/A PHE 334.A N ILE 330.A O no hydrogen 2.998 N/A ALA 337.A N ALA 333.A O no hydrogen 3.099 N/A VAL 338.A N PHE 334.A O no hydrogen 3.136 N/A VAL 339.A N TRP 335.A O no hydrogen 3.040 N/A SER 340.A N TRP 336.A O no hydrogen 2.760 N/A SER 340.A OG TRP 336.A O no hydrogen 2.958 N/A SER 340.A OG ALA 337.A O no hydrogen 2.792 N/A MET 341.A N ALA 337.A O no hydrogen 3.270 N/A THR 342.A N VAL 338.A O no hydrogen 3.180 N/A THR 342.A OG1 VAL 338.A O no hydrogen 2.826 N/A THR 342.A OG1 VAL 339.A O no hydrogen 2.846 N/A THR 343.A OG1 THR 342.A O no hydrogen 2.671 N/A VAL 344.A N VAL 339.A O no hydrogen 2.749 N/A MET 349.A N ASP 348.A OD1 no hydrogen 2.845 N/A THR 353.A OG1 GLU 319.A OE1 no hydrogen 2.220 N/A LYS 357.A N ILE 354.A O no hydrogen 3.062 N/A GLY 360.A N GLY 356.A O no hydrogen 2.810 N/A SER 361.A N LYS 357.A O no hydrogen 3.273 N/A LEU 362.A N ILE 358.A O no hydrogen 2.692 N/A CYS 363.A N VAL 359.A O no hydrogen 2.576 N/A CYS 363.A SG SER 340.A OG no hydrogen 3.377 N/A ALA 364.A N GLY 360.A O no hydrogen 2.967 N/A ILE 365.A N SER 361.A O no hydrogen 2.965 N/A ALA 366.A N LEU 362.A O no hydrogen 2.911 N/A GLY 367.A N CYS 363.A O no hydrogen 2.766 N/A VAL 368.A N ALA 364.A O no hydrogen 3.357 N/A LEU 369.A N ILE 365.A O no hydrogen 3.163 N/A THR 370.A N ALA 366.A O no hydrogen 2.909 N/A THR 370.A OG1 ALA 366.A O no hydrogen 3.273 N/A ILE 371.A N GLY 367.A O no hydrogen 2.691 N/A ALA 372.A N VAL 368.A O no hydrogen 2.937 N/A LEU 373.A N THR 370.A O no hydrogen 3.289 N/A VAL 375.A N ALA 372.A O no hydrogen 3.356 N/A VAL 379.A N VAL 375.A O no hydrogen 2.936 N/A SER 380.A N PRO 376.A O no hydrogen 2.977 N/A SER 380.A OG PRO 376.A O no hydrogen 2.670 N/A ASN 381.A N VAL 377.A O no hydrogen 2.926 N/A PHE 382.A N ILE 378.A O no hydrogen 2.976 N/A ASN 383.A N VAL 379.A O no hydrogen 2.809 N/A TYR 384.A N SER 380.A O no hydrogen 3.053 N/A PHE 385.A N ASN 381.A O no hydrogen 2.968 N/A TYR 386.A N PHE 382.A O no hydrogen 2.767 N/A HIS 387.A N ASN 383.A O no hydrogen 3.012 N/A ARG 388.A N TYR 384.A O no hydrogen 3.081 N/A ARG 388.A N PHE 385.A O no hydrogen 3.227 N/A GLU 389.A N PHE 385.A O no hydrogen 3.413 N/A THR 390.A OG1 TYR 386.A O no hydrogen 2.721 N/A