Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3e0g_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 4.A SG GLU 74.A OE1 no hydrogen 3.293 N/A VAL 5.A N GLN 13.A O no hydrogen 3.425 N/A THR 6.A OG1 VAL 11.A O no hydrogen 2.789 N/A ASN 8.A ND2 ASN 7.A OD1 no hydrogen 3.235 N/A VAL 11.A N ASN 8.A O no hydrogen 3.426 N/A TRP 12.A N ILE 49.A O no hydrogen 2.920 N/A GLN 13.A N VAL 5.A O no hydrogen 2.993 N/A SER 15.A N LYS 3.A O no hydrogen 2.823 N/A THR 22.A OG1 HIS 65.A O no hydrogen 3.103 N/A THR 26.A OG1 GLY 23.A O no hydrogen 3.503 N/A TYR 28.A N LEU 42.A O no hydrogen 2.512 N/A GLU 29.A N ASN 62.A O no hydrogen 3.428 N/A VAL 30.A N TYR 40.A O no hydrogen 3.120 N/A CYS 31.A N THR 60.A O no hydrogen 2.820 N/A ILE 32.A N SER 38.A O no hydrogen 3.126 N/A GLU 33.A N GLU 58.A O no hydrogen 2.734 N/A TYR 40.A N VAL 30.A O no hydrogen 2.440 N/A LEU 42.A N TYR 28.A O no hydrogen 2.770 N/A SER 46.A OG GLN 13.A OE1 no hydrogen 3.237 N/A SER 46.A OG CYS 14.A O no hydrogen 3.357 N/A ILE 47.A N CYS 14.A O no hydrogen 3.111 N/A ILE 49.A N TRP 12.A O no hydrogen 2.757 N/A ALA 51.A N GLN 10.A O no hydrogen 3.162 N/A TYR 57.A OH PRO 50.A O no hydrogen 3.013 N/A ILE 59.A N LEU 72.A O no hydrogen 3.216 N/A THR 60.A N CYS 31.A O no hydrogen 2.829 N/A ILE 61.A N PHE 70.A O no hydrogen 3.289 N/A ASN 62.A N GLU 29.A O no hydrogen 3.092 N/A SER 63.A OG SER 68.A OG no hydrogen 3.200 N/A SER 68.A OG SER 63.A OG no hydrogen 3.200 N/A PHE 70.A N SER 68.A O no hydrogen 2.701 N/A ASN 73.A ND2 TYR 57.A O no hydrogen 2.799 N/A ASN 73.A ND2 GLU 58.A OE1 no hydrogen 3.347 N/A GLN 75.A NE2 ASP 56.A OD2 no hydrogen 2.797 N/A SER 78.A OG GLU 179.A OE2 no hydrogen 2.507 N/A LEU 79.A N LEU 177.A O no hydrogen 2.736 N/A ILE 80.A N THR 6.A O no hydrogen 2.811 N/A THR 83.A OG1 PRO 84.A O no hydrogen 3.101 N/A GLN 88.A N LYS 101.A O no hydrogen 2.982 N/A SER 90.A N TYR 99.A O no hydrogen 2.821 N/A SER 90.A OG TYR 99.A O no hydrogen 3.562 N/A ASP 92.A N THR 97.A O no hydrogen 2.970 N/A SER 94.A OG ASP 92.A OD2 no hydrogen 2.710 N/A THR 95.A OG1 ASP 92.A O no hydrogen 3.187 N/A SER 96.A N PHE 93.A O no hydrogen 3.165 N/A SER 96.A OG PHE 93.A O no hydrogen 3.151 N/A THR 97.A N ASP 92.A O no hydrogen 3.258 N/A LEU 98.A N TRP 150.A O no hydrogen 2.650 N/A TYR 99.A N SER 90.A O no hydrogen 2.716 N/A LEU 100.A N TRP 148.A O no hydrogen 2.757 N/A TRP 102.A N HIS 146.A O no hydrogen 3.243 N/A SER 107.A N ASP 143.A OD2 no hydrogen 2.721 N/A SER 107.A OG ASP 143.A OD1 no hydrogen 3.280 N/A SER 107.A OG ASP 143.A OD2 no hydrogen 2.522 N/A VAL 108.A N ARG 105.A O no hydrogen 3.110 N/A PHE 109.A N GLY 106.A O no hydrogen 2.805 N/A SER 113.A OG HIS 111.A O no hydrogen 3.411 N/A VAL 115.A N GLN 136.A O no hydrogen 2.745 N/A ILE 116.A N TYR 168.A O no hydrogen 2.723 N/A TRP 117.A N THR 134.A O no hydrogen 3.081 N/A TRP 117.A NE1 GLN 136.A OE1 no hydrogen 3.278 N/A GLU 118.A N ARG 166.A O no hydrogen 2.877 N/A ILE 119.A N LEU 132.A O no hydrogen 3.068 N/A LYS 120.A N GLU 164.A O no hydrogen 3.079 N/A LYS 120.A NZ GLU 164.A OE2 no hydrogen 3.179 N/A VAL 121.A N VAL 130.A O no hydrogen 3.283 N/A LEU 122.A N PHE 162.A O no hydrogen 2.943 N/A ARG 123.A N MET 127.A O no hydrogen 3.023 N/A LYS 124.A NZ ASP 238.A OD2 no hydrogen 3.554 N/A LEU 129.A N VAL 121.A O no hydrogen 2.749 N/A LEU 132.A N ILE 119.A O no hydrogen 3.066 N/A THR 134.A N TRP 117.A O no hydrogen 3.189 N/A GLN 136.A N VAL 115.A O no hydrogen 2.959 N/A GLN 136.A NE2 HIS 146.A NE2 no hydrogen 2.652 N/A THR 138.A N SER 113.A O no hydrogen 2.583 N/A LYS 142.A N LEU 139.A O no hydrogen 2.537 N/A THR 144.A OG1 ASP 104.A OD1 no hydrogen 3.290 N/A THR 144.A OG1 ASP 104.A OD2 no hydrogen 2.521 N/A HIS 146.A N TRP 102.A O no hydrogen 2.935 N/A TRP 148.A N LEU 100.A O no hydrogen 3.059 N/A TRP 150.A N LEU 98.A O no hydrogen 3.040 N/A SER 152.A N SER 96.A O no hydrogen 2.931 N/A SER 152.A OG MET 154.A O no hydrogen 2.804 N/A MET 154.A N SER 152.A OG no hydrogen 2.909 N/A HIS 161.A N ILE 189.A O no hydrogen 3.280 N/A PHE 162.A N LEU 122.A O no hydrogen 2.894 N/A VAL 163.A N LYS 187.A O no hydrogen 3.015 N/A GLU 164.A N LYS 120.A O no hydrogen 2.997 N/A ARG 166.A N GLU 118.A O no hydrogen 3.112 N/A ARG 166.A NE GLU 118.A OE1 no hydrogen 2.902 N/A ARG 166.A NH2 GLU 118.A OE1 no hydrogen 3.347 N/A CYS 167.A N SER 181.A OG no hydrogen 2.907 N/A TYR 168.A N ILE 116.A O no hydrogen 2.879 N/A ASP 170.A N ASN 114.A O no hydrogen 3.080 N/A ASN 171.A N GLU 178.A OE1 no hydrogen 3.085 N/A ASN 171.A ND2 SER 113.A OG no hydrogen 2.844 N/A HIS 173.A N ASN 171.A OD1 no hydrogen 3.189 N/A PHE 174.A N ASN 171.A O no hydrogen 2.910 N/A LEU 177.A N VAL 77.A O no hydrogen 3.130 N/A GLU 179.A N LEU 79.A O no hydrogen 3.013 N/A SER 181.A N CYS 167.A O no hydrogen 3.002 N/A SER 181.A OG CYS 167.A O no hydrogen 3.542 N/A SER 181.A OG ASP 182.A O no hydrogen 2.984 N/A SER 184.A N ILE 165.A O no hydrogen 2.630 N/A SER 184.A OG PRO 185.A O no hydrogen 3.088 N/A LYS 187.A N VAL 163.A O no hydrogen 3.419 N/A ILE 189.A N HIS 161.A O no hydrogen 2.882 N/A SER 190.A OG TRP 191.A O no hydrogen 3.343 N/A GLN 196.A N SER 195.A OG no hydrogen 2.619 N/A THR 197.A OG1 VAL 199.A O no hydrogen 2.811 N/A PHE 200.A N CYS 215.A O no hydrogen 3.026 N/A GLN 202.A NE2 VAL 199.A O no hydrogen 3.511 N/A GLN 202.A NE2 GLY 269.A O no hydrogen 3.384 N/A ASP 203.A N THR 270.A OG1 no hydrogen 3.266 N/A ILE 206.A N PHE 273.A O no hydrogen 2.958 N/A VAL 208.A N GLY 275.A O no hydrogen 3.053 N/A GLY 209.A N ILE 249.A O no hydrogen 2.624 N/A SER 210.A OG LEU 207.A O no hydrogen 2.429 N/A ILE 212.A N ILE 246.A O no hydrogen 2.971 N/A THR 213.A OG1 ASP 153.A O no hydrogen 2.889 N/A PHE 214.A N ILE 244.A O no hydrogen 2.853 N/A CYS 215.A N PHE 200.A O no hydrogen 2.593 N/A CYS 215.A SG PRO 155.A O no hydrogen 3.683 N/A CYS 216.A SG LYS 198.A O no hydrogen 3.847 N/A CYS 216.A SG VAL 217.A O no hydrogen 3.707 N/A VAL 217.A N LYS 198.A O no hydrogen 2.880 N/A SER 218.A N ASN 241.A OD1 no hydrogen 3.094 N/A SER 218.A OG GLU 220.A O no hydrogen 2.924 N/A GLU 220.A N SER 218.A OG no hydrogen 3.234 N/A LEU 223.A N THR 262.A O no hydrogen 2.861 N/A LEU 226.A N VAL 260.A O no hydrogen 3.227 N/A THR 230.A OG1 GLY 228.A O no hydrogen 2.566 N/A CYS 232.A N ALA 225.A O no hydrogen 2.791 N/A ILE 235.A N ALA 243.A O no hydrogen 2.789 N/A LEU 237.A N ASN 241.A O no hydrogen 2.867 N/A VAL 242.A N CYS 216.A O no hydrogen 3.017 N/A ALA 243.A N ILE 235.A O no hydrogen 2.797 N/A ILE 244.A N PHE 214.A O no hydrogen 3.054 N/A ILE 246.A N ILE 212.A O no hydrogen 2.717 N/A ASN 248.A N ASP 211.A OD2 no hydrogen 2.894 N/A ILE 249.A N SER 210.A O no hydrogen 2.764 N/A SER 252.A N ALA 274.A O no hydrogen 3.151 N/A SER 252.A OG THR 257.A OG1 no hydrogen 3.396 N/A SER 252.A OG ILE 272.A O no hydrogen 3.486 N/A SER 252.A OG ALA 274.A O no hydrogen 3.522 N/A SER 255.A OG GLY 256.A O no hydrogen 3.557 N/A VAL 259.A N THR 270.A O no hydrogen 3.052 N/A VAL 260.A N LEU 226.A O no hydrogen 3.147 N/A PHE 261.A N PHE 268.A O no hydrogen 2.904 N/A THR 262.A N SER 224.A O no hydrogen 2.830 N/A THR 262.A OG1 SER 224.A O no hydrogen 3.053 N/A THR 263.A N ASN 266.A O no hydrogen 2.924 N/A THR 263.A OG1 ASN 266.A O no hydrogen 2.796 N/A PHE 268.A N PHE 261.A O no hydrogen 2.892 N/A THR 270.A N VAL 259.A O no hydrogen 2.896 N/A THR 270.A OG1 PRO 201.A O no hydrogen 3.242 N/A THR 270.A OG1 VAL 271.A O no hydrogen 3.335 N/A VAL 271.A N THR 270.A OG1 no hydrogen 2.578 N/A ILE 272.A N THR 257.A O no hydrogen 2.801 N/A PHE 273.A N LYS 204.A O no hydrogen 3.214 N/A ALA 274.A N SER 252.A OG no hydrogen 2.520 N/A GLY 275.A N ILE 206.A O no hydrogen 3.278 N/A TYR 276.A N THR 304.A O no hydrogen 2.876 N/A THR 280.A N ASP 279.A OD2 no hydrogen 3.135 N/A GLN 282.A N ASN 299.A O no hydrogen 2.916 N/A GLN 282.A NE2 GLN 283.A OE1 no hydrogen 2.689 N/A ASN 285.A N SER 297.A O no hydrogen 3.121 N/A GLU 287.A N ILE 295.A O no hydrogen 3.054 N/A THR 288.A OG1 GLU 293.A O no hydrogen 2.974 N/A LYS 292.A N ASP 290.A O no hydrogen 2.720 N/A ILE 294.A N PHE 342.A O no hydrogen 2.721 N/A ILE 295.A N GLU 287.A O no hydrogen 3.042 N/A SER 297.A N ASN 285.A O no hydrogen 2.814 N/A TRP 298.A N TYR 338.A O no hydrogen 3.140 N/A ASN 299.A N GLN 282.A O no hydrogen 3.065 N/A ASN 299.A ND2 PRO 300.A O no hydrogen 2.603 N/A ARG 302.A N ASP 279.A OD1 no hydrogen 2.924 N/A LEU 306.A N THR 304.A OG1 no hydrogen 2.824 N/A ARG 310.A N VAL 307.A O no hydrogen 3.170 N/A ALA 311.A N GLY 308.A O no hydrogen 2.542 N/A THR 312.A OG1 HIS 358.A O no hydrogen 3.390 N/A SER 313.A N HIS 358.A O no hydrogen 2.984 N/A THR 315.A N ASN 356.A O no hydrogen 2.869 N/A LEU 316.A N VAL 325.A O no hydrogen 2.899 N/A VAL 317.A N THR 354.A O no hydrogen 3.162 N/A GLU 318.A N LYS 323.A O no hydrogen 2.793 N/A SER 319.A N ASN 352.A O no hydrogen 2.985 N/A GLY 322.A N GLU 318.A O no hydrogen 2.935 N/A LYS 323.A N SER 321.A OG no hydrogen 3.349 N/A LYS 323.A NZ GLN 343.A O no hydrogen 2.541 N/A LYS 323.A NZ GLN 343.A OE1 no hydrogen 3.043 N/A ARG 326.A NH2 SER 313.A OG no hydrogen 3.146 N/A ALA 332.A N ALA 330.A O no hydrogen 2.809 N/A SER 337.A OG TRP 298.A O no hydrogen 2.625 N/A TYR 338.A N TRP 298.A O no hydrogen 3.329 N/A LEU 340.A N CYS 296.A O no hydrogen 3.304 N/A PHE 342.A N ILE 294.A O no hydrogen 3.043 N/A GLN 343.A N GLN 343.A OE1 no hydrogen 2.574 N/A MET 344.A N LYS 292.A O no hydrogen 2.627 N/A LEU 345.A N TYR 351.A OH no hydrogen 3.275 N/A TYR 351.A N VAL 370.A O no hydrogen 2.970 N/A ASN 352.A N GLU 318.A OE2 no hydrogen 3.140 N/A PHE 353.A N ILE 368.A O no hydrogen 3.075 N/A THR 354.A N VAL 317.A O no hydrogen 3.163 N/A LEU 355.A N SER 366.A O no hydrogen 2.939 N/A ASN 356.A N THR 315.A O no hydrogen 2.785 N/A ALA 357.A N SER 364.A O no hydrogen 2.904 N/A HIS 358.A N SER 313.A O no hydrogen 2.808 N/A ASN 359.A ND2 TYR 276.A O no hydrogen 3.372 N/A LEU 361.A N ASN 359.A OD1 no hydrogen 2.808 N/A SER 364.A N ALA 357.A O no hydrogen 3.086 N/A SER 364.A OG ASP 279.A O no hydrogen 3.080 N/A SER 366.A N LEU 355.A O no hydrogen 3.207 N/A SER 366.A OG PRO 281.A O no hydrogen 3.456 N/A ILE 368.A N PHE 353.A O no hydrogen 2.692 N/A VAL 370.A N TYR 351.A O no hydrogen 2.850 N/A ASN 371.A ND2 THR 373.A OG1 no hydrogen 3.347 N/A GLU 374.A N ASN 371.A O no hydrogen 2.792 N/A LYS 375.A N ILE 372.A O no hydrogen 3.101 N/A TYR 377.A N THR 288.A O no hydrogen 2.374 N/A THR 380.A OG1 LYS 466.A O no hydrogen 2.609 N/A THR 380.A OG1 TRP 467.A O no hydrogen 3.115 N/A THR 382.A N HIS 399.A O no hydrogen 2.752 N/A THR 382.A OG1 SER 383.A OG no hydrogen 3.159 N/A SER 383.A OG THR 382.A OG1 no hydrogen 3.159 N/A THR 392.A N SER 391.A OG no hydrogen 2.763 N/A SER 397.A OG TYR 437.A O no hydrogen 3.508 N/A ASN 403.A ND2 LEU 291.A O no hydrogen 3.091 N/A ILE 407.A N PHE 404.A O no hydrogen 3.031 N/A ASN 408.A ND2 GLU 459.A OE1 no hydrogen 2.863 N/A PHE 409.A N ILE 429.A O no hydrogen 3.285 N/A LEU 410.A N SER 457.A O no hydrogen 3.455 N/A ILE 413.A N ARG 425.A O no hydrogen 2.974 N/A GLU 414.A N ARG 453.A O no hydrogen 3.199 N/A LYS 416.A N THR 451.A O no hydrogen 2.999 N/A LYS 417.A N VAL 421.A O no hydrogen 2.770 N/A SER 420.A OG SER 418.A O no hydrogen 3.116 N/A GLN 422.A NE2 GLU 414.A OE2 no hydrogen 2.747 N/A GLN 424.A NE2 GLN 422.A O no hydrogen 2.717 N/A ARG 425.A N ILE 413.A O no hydrogen 3.404 N/A THR 428.A OG1 PHE 409.A O no hydrogen 3.402 N/A SER 435.A N GLU 433.A O no hydrogen 2.422 N/A SER 435.A OG GLU 433.A O no hydrogen 3.306 N/A TYR 437.A N TRP 398.A O no hydrogen 2.807 N/A VAL 439.A N LEU 396.A O no hydrogen 3.240 N/A THR 448.A OG1 PRO 446.A O no hydrogen 3.169 N/A TYR 450.A OH ASN 445.A OD1 no hydrogen 2.771 N/A THR 451.A N LYS 416.A O no hydrogen 2.833 N/A THR 451.A OG1 LYS 416.A O no hydrogen 2.897 N/A PHE 452.A N LYS 471.A O no hydrogen 2.563 N/A ARG 453.A NE SER 468.A O no hydrogen 2.926 N/A SER 457.A OG THR 458.A O no hydrogen 3.550 N/A GLU 459.A N ASN 408.A O no hydrogen 2.763 N/A THR 460.A OG1 THR 373.A O no hydrogen 2.716 N/A SER 465.A OG PRO 378.A O no hydrogen 3.406 N/A LYS 466.A NZ HIS 379.A NE2 no hydrogen 2.943 N/A SER 468.A N ILE 454.A O no hydrogen 3.349 N/A THR 475.A OG1 ASP 388.A OD2 no hydrogen 3.537 N/A