Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6wwe_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N THR 130.A OG1 no hydrogen 3.284 N/A CYS 4.A N THR 51.A O no hydrogen 3.198 N/A SER 6.A N ARG 64.A O no hydrogen 3.365 N/A ILE 7.A N LEU 136.A O no hydrogen 2.685 N/A HIS 8.A N VAL 66.A O no hydrogen 3.278 N/A VAL 9.A N PHE 138.A O no hydrogen 3.376 N/A GLY 10.A N VAL 68.A O no hydrogen 3.102 N/A GLY 13.A N VAL 9.A O no hydrogen 2.813 N/A VAL 14.A N GLY 10.A O no hydrogen 2.890 N/A GLN 15.A N GLN 11.A O no hydrogen 2.930 N/A ILE 16.A N ALA 12.A O no hydrogen 2.925 N/A GLY 17.A N GLY 13.A O no hydrogen 2.879 N/A ASN 18.A N VAL 14.A O no hydrogen 2.876 N/A ALA 19.A N GLN 15.A O no hydrogen 3.015 N/A CYS 20.A N ILE 16.A O no hydrogen 2.828 N/A CYS 20.A SG ILE 16.A O no hydrogen 3.127 N/A CYS 20.A SG SER 232.A OG no hydrogen 2.855 N/A TRP 21.A N GLY 17.A O no hydrogen 2.896 N/A TRP 21.A NE1 HIS 8.A NE2 no hydrogen 3.085 N/A LEU 23.A N ALA 19.A O no hydrogen 2.986 N/A TYR 24.A N CYS 20.A O no hydrogen 2.857 N/A TYR 24.A OH THR 239.A OG1 no hydrogen 3.071 N/A CYS 25.A N TRP 21.A O no hydrogen 2.925 N/A CYS 25.A SG TRP 21.A O no hydrogen 3.383 N/A GLU 27.A N LEU 23.A O no hydrogen 2.936 N/A HIS 28.A N TYR 24.A O no hydrogen 3.328 N/A GLY 29.A N LEU 26.A O no hydrogen 3.281 N/A ILE 30.A N CYS 25.A O no hydrogen 2.524 N/A GLN 35.A N ASP 33.A OD1 no hydrogen 3.047 N/A SER 38.A OG GLY 29.A O no hydrogen 2.648 N/A LYS 40.A N MET 36.A O no hydrogen 2.785 N/A THR 41.A N PRO 37.A O no hydrogen 2.883 N/A THR 41.A OG1 PRO 37.A O no hydrogen 2.839 N/A ILE 42.A N SER 38.A O no hydrogen 2.911 N/A GLY 44.A N ASP 39.A OD1 no hydrogen 2.577 N/A SER 48.A OG SER 48.A O no hydrogen 2.318 N/A SER 48.A OG GLU 55.A OE1 no hydrogen 3.140 N/A SER 48.A OG HIS 61.A NE2 no hydrogen 2.793 N/A PHE 53.A N PHE 49.A O no hydrogen 3.300 N/A SER 54.A N VAL 62.A O no hydrogen 2.879 N/A THR 56.A N LYS 60.A O no hydrogen 3.175 N/A THR 56.A OG1 LYS 60.A O no hydrogen 2.864 N/A GLY 59.A N THR 56.A O no hydrogen 3.222 N/A HIS 61.A NE2 SER 48.A OG no hydrogen 2.793 N/A VAL 62.A N SER 54.A O no hydrogen 2.947 N/A ARG 64.A N PHE 52.A O no hydrogen 3.027 N/A ARG 64.A NE PHE 52.A O no hydrogen 2.680 N/A VAL 66.A N SER 6.A O no hydrogen 3.301 N/A VAL 68.A N HIS 8.A O no hydrogen 3.254 N/A GLU 71.A N ASP 69.A OD1 no hydrogen 3.285 N/A VAL 74.A N GLU 71.A O no hydrogen 3.047 N/A GLU 77.A N VAL 74.A O no hydrogen 3.193 N/A ARG 79.A N ILE 75.A O no hydrogen 2.868 N/A ARG 79.A NH1 ASP 76.A OD2 no hydrogen 3.185 N/A THR 80.A N GLU 77.A O no hydrogen 2.787 N/A THR 80.A OG1 ASP 76.A O no hydrogen 2.725 N/A THR 80.A OG1 GLU 77.A O no hydrogen 3.029 N/A GLY 81.A N GLU 77.A O no hydrogen 2.430 N/A ARG 84.A NH1 GLY 81.A O no hydrogen 3.450 N/A GLN 85.A N GLN 85.A OE1 no hydrogen 3.277 N/A GLU 90.A N HIS 88.A ND1 no hydrogen 3.169 N/A GLN 91.A N PRO 89.A O no hydrogen 2.945 N/A GLY 95.A N ILE 93.A O no hydrogen 2.468 N/A ASN 102.A N ALA 99.A O no hydrogen 2.713 N/A TYR 103.A OH HIS 107.A ND1 no hydrogen 3.125 N/A TYR 103.A OH THR 193.A OG1 no hydrogen 3.384 N/A HIS 107.A N TYR 103.A O no hydrogen 3.284 N/A TYR 108.A N.A ALA 104.A O no hydrogen 2.910 N/A TYR 108.A N.B ALA 104.A O no hydrogen 2.905 N/A THR 109.A OG1 GLU 411.A OE1 no hydrogen 3.551 N/A ILE 110.A N ARG 105.A O no hydrogen 2.791 N/A VAL 118.A N ILE 114.A O no hydrogen 2.841 N/A LEU 119.A N ILE 115.A O no hydrogen 2.929 N/A ASP 120.A N ASP 116.A O no hydrogen 2.909 N/A ARG 121.A N LEU 117.A O no hydrogen 2.899 N/A ILE 122.A N VAL 118.A O no hydrogen 2.882 N/A ARG 123.A N LEU 119.A O no hydrogen 2.947 N/A LYS 124.A N ASP 120.A O no hydrogen 2.896 N/A LEU 125.A N ARG 121.A O no hydrogen 2.897 N/A ALA 126.A N ILE 122.A O no hydrogen 2.893 N/A ALA 126.A N ARG 123.A O no hydrogen 3.018 N/A ASP 127.A N ARG 123.A O no hydrogen 3.203 N/A GLN 128.A N GLN 128.A OE1 no hydrogen 2.564 N/A GLN 128.A NE2 LYS 124.A O no hydrogen 2.548 N/A CYS 129.A N LEU 125.A O no hydrogen 3.393 N/A CYS 129.A SG GLY 131.A O no hydrogen 3.467 N/A CYS 129.A SG LEU 132.A O no hydrogen 3.173 N/A GLN 133.A NE2 ALA 126.A O no hydrogen 3.024 N/A PHE 135.A N SER 165.A O no hydrogen 2.736 N/A LEU 136.A N ILE 5.A O no hydrogen 2.991 N/A VAL 137.A N LEU 167.A O no hydrogen 2.910 N/A PHE 138.A N ILE 7.A O no hydrogen 3.031 N/A SER 140.A OG PHE 141.A O no hydrogen 3.497 N/A PHE 141.A N ILE 171.A O no hydrogen 2.954 N/A GLY 143.A N PHE 141.A O no hydrogen 2.746 N/A THR 145.A OG1 ASP 69.A O no hydrogen 3.113 N/A SER 147.A N GLY 144.A O no hydrogen 3.457 N/A SER 147.A OG GLY 143.A O no hydrogen 3.185 N/A SER 147.A OG GLY 144.A O no hydrogen 2.535 N/A SER 147.A OG ASN 186.A OD1 no hydrogen 2.493 N/A THR 150.A OG1 GLY 146.A O no hydrogen 2.841 N/A SER 151.A N SER 147.A O no hydrogen 2.896 N/A SER 151.A OG GLY 148.A O no hydrogen 2.510 N/A LEU 152.A N GLY 148.A O no hydrogen 2.931 N/A LEU 153.A N PHE 149.A O no hydrogen 2.885 N/A MET 154.A N THR 150.A O no hydrogen 2.924 N/A GLU 155.A N SER 151.A O no hydrogen 3.316 N/A ARG 156.A N LEU 152.A O no hydrogen 2.961 N/A ARG 156.A NH2 ASP 116.A OD1 no hydrogen 3.391 N/A LEU 157.A N LEU 153.A O no hydrogen 2.854 N/A SER 158.A N MET 154.A O no hydrogen 2.948 N/A SER 158.A OG GLU 155.A O no hydrogen 2.703 N/A VAL 159.A N ARG 156.A O no hydrogen 2.982 N/A ASP 160.A N ARG 156.A O no hydrogen 2.899 N/A TYR 161.A N LEU 157.A O no hydrogen 2.919 N/A GLY 162.A N LEU 157.A O no hydrogen 3.257 N/A LYS 164.A N GLY 162.A O no hydrogen 2.509 N/A LYS 164.A NZ TYR 161.A O no hydrogen 2.528 N/A LEU 167.A N PHE 135.A O no hydrogen 2.917 N/A GLU 168.A N CYS 200.A O no hydrogen 3.226 N/A PHE 169.A N VAL 137.A O no hydrogen 2.918 N/A SER 170.A OG ILE 171.A O no hydrogen 3.569 N/A TYR 172.A N VAL 204.A O no hydrogen 3.097 N/A SER 178.A OG ALA 180.A O no hydrogen 2.695 N/A SER 178.A OG GLU 183.A OE1 no hydrogen 2.740 N/A ALA 180.A N SER 178.A OG no hydrogen 2.500 N/A ASN 186.A N VAL 182.A O no hydrogen 3.406 N/A ASN 186.A ND2 GLY 142.A O no hydrogen 2.535 N/A ASN 186.A ND2 GLY 143.A O no hydrogen 2.510 N/A SER 187.A N PRO 184.A O no hydrogen 2.981 N/A ILE 188.A N PRO 184.A O no hydrogen 2.877 N/A THR 191.A N ILE 188.A O no hydrogen 3.136 N/A THR 191.A OG1 ILE 188.A O no hydrogen 2.034 N/A HIS 192.A N ILE 188.A O no hydrogen 3.274 N/A THR 193.A N LEU 189.A O no hydrogen 2.976 N/A THR 193.A OG1 TYR 103.A OH no hydrogen 3.384 N/A THR 193.A OG1 LEU 189.A O no hydrogen 3.012 N/A THR 194.A N THR 190.A O no hydrogen 2.880 N/A THR 194.A OG1 THR 190.A O no hydrogen 2.519 N/A THR 194.A OG1 THR 191.A O no hydrogen 3.131 N/A LEU 195.A N THR 191.A O no hydrogen 3.042 N/A HIS 197.A N THR 194.A O no hydrogen 3.231 N/A SER 198.A N THR 194.A O no hydrogen 3.066 N/A SER 198.A OG THR 194.A O no hydrogen 2.704 N/A SER 198.A OG HIS 266.A NE2 no hydrogen 3.289 N/A ALA 201.A N HIS 266.A O no hydrogen 3.329 N/A ASP 205.A N MET 302.A O no hydrogen 3.078 N/A ALA 208.A N ASP 205.A O no hydrogen 3.240 N/A TYR 210.A N ASN 206.A O no hydrogen 2.920 N/A ASP 211.A N GLU 207.A O no hydrogen 2.886 N/A ILE 212.A N ALA 208.A O no hydrogen 2.906 N/A CYS 213.A N ILE 209.A O no hydrogen 2.911 N/A CYS 213.A SG ILE 209.A O no hydrogen 3.103 N/A ASN 216.A ND2 ASN 300.A OD1 no hydrogen 2.789 N/A ILE 219.A N CYS 213.A O no hydrogen 2.793 N/A THR 223.A N ASN 226.A OD1 no hydrogen 3.089 N/A THR 223.A OG1 THR 225.A OG1 no hydrogen 2.719 N/A THR 223.A OG1 ASN 226.A OD1 no hydrogen 2.904 N/A THR 225.A OG1 THR 223.A OG1 no hydrogen 2.719 N/A ASN 226.A ND2 ASP 367.A OD2 no hydrogen 3.172 N/A LEU 227.A N TYR 224.A O no hydrogen 2.917 N/A ASN 228.A N TYR 224.A O no hydrogen 2.982 N/A ARG 229.A N THR 225.A O no hydrogen 2.956 N/A ARG 229.A NE GLU 22.A OE1 no hydrogen 3.350 N/A ARG 229.A NH2 GLU 22.A OE1 no hydrogen 2.759 N/A ILE 231.A N LEU 227.A O no hydrogen 2.997 N/A SER 232.A N ASN 228.A O no hydrogen 2.840 N/A SER 232.A OG ASN 228.A O no hydrogen 3.070 N/A GLN 233.A N ARG 229.A O no hydrogen 2.914 N/A ILE 234.A N LEU 230.A O no hydrogen 2.942 N/A VAL 235.A N ILE 231.A O no hydrogen 2.973 N/A SER 236.A N SER 232.A O no hydrogen 2.876 N/A SER 236.A OG GLU 27.A OE1 no hydrogen 3.475 N/A SER 236.A OG GLU 27.A OE2 no hydrogen 2.360 N/A SER 237.A N GLN 233.A O no hydrogen 2.860 N/A SER 237.A OG GLN 233.A O no hydrogen 2.671 N/A ILE 238.A N ILE 234.A O no hydrogen 3.005 N/A ILE 238.A N VAL 235.A O no hydrogen 3.246 N/A THR 239.A N VAL 235.A O no hydrogen 2.883 N/A THR 239.A OG1 TYR 24.A OH no hydrogen 3.071 N/A THR 239.A OG1 VAL 235.A O no hydrogen 2.930 N/A THR 239.A OG1 SER 236.A O no hydrogen 3.519 N/A ALA 240.A N SER 236.A O no hydrogen 2.891 N/A SER 241.A N ILE 238.A O no hydrogen 3.481 N/A SER 241.A OG VAL 250.A O no hydrogen 2.247 N/A ARG 243.A N THR 239.A O no hydrogen 3.005 N/A ARG 243.A NE THR 239.A OG1 no hydrogen 2.832 N/A ARG 243.A NH2 SER 236.A O no hydrogen 2.829 N/A ARG 243.A NH2 SER 236.A OG no hydrogen 2.682 N/A ARG 243.A NH2 THR 239.A OG1 no hydrogen 3.038 N/A PHE 244.A N ALA 240.A O no hydrogen 3.261 N/A VAL 250.A N SER 241.A OG no hydrogen 2.463 N/A ASP 251.A N GLU 254.A OE2 no hydrogen 3.353 N/A THR 253.A N ASP 251.A OD1 no hydrogen 2.747 N/A THR 253.A OG1 ASP 251.A OD1 no hydrogen 3.159 N/A GLU 254.A N ASP 251.A O no hydrogen 2.870 N/A THR 257.A N GLU 254.A O no hydrogen 2.913 N/A THR 257.A OG1 THR 253.A O no hydrogen 2.989 N/A ASN 258.A N GLU 254.A O no hydrogen 2.912 N/A ARG 264.A NE ASP 431.A OD2 no hydrogen 3.379 N/A HIS 266.A NE2 SER 198.A OG no hydrogen 3.289 N/A PHE 267.A N ILE 265.A O no hydrogen 2.988 N/A LEU 269.A N SER 379.A O no hydrogen 2.844 N/A THR 271.A N MET 377.A O no hydrogen 2.917 N/A ALA 273.A N VAL 375.A O no hydrogen 3.445 N/A SER 277.A OG LEU 217.A O no hydrogen 2.703 N/A GLU 279.A N GLU 279.A OE1 no hydrogen 2.596 N/A LYS 280.A NZ ASN 216.A O no hydrogen 2.966 N/A LYS 280.A NZ ASP 218.A OD2 no hydrogen 2.804 N/A TYR 282.A N GLU 279.A O no hydrogen 3.240 N/A SER 287.A N GLU 290.A OE2 no hydrogen 2.998 N/A ILE 291.A N SER 287.A O no hydrogen 3.300 N/A THR 292.A N VAL 288.A O no hydrogen 2.898 N/A THR 292.A OG1 VAL 288.A O no hydrogen 3.325 N/A THR 292.A OG1 TYR 319.A OH no hydrogen 2.599 N/A ASN 293.A N ALA 289.A O no hydrogen 2.880 N/A ALA 294.A N GLU 290.A O no hydrogen 2.921 N/A CYS 295.A N ILE 291.A O no hydrogen 2.896 N/A CYS 295.A SG ILE 291.A O no hydrogen 3.113 N/A PHE 296.A N ASN 293.A O no hydrogen 3.142 N/A GLU 297.A N ALA 294.A O no hydrogen 3.436 N/A GLN 301.A N PRO 298.A O no hydrogen 3.425 N/A LYS 304.A NZ ASP 211.A OD1 no hydrogen 3.439 N/A CYS 305.A N VAL 303.A O no hydrogen 2.811 N/A HIS 309.A N ASP 306.A O no hydrogen 3.122 N/A GLY 310.A N PRO 307.A O no hydrogen 2.797 N/A LYS 311.A N THR 382.A OG1 no hydrogen 2.602 N/A MET 313.A N ASN 380.A O no hydrogen 2.863 N/A ALA 314.A N ASN 380.A O no hydrogen 2.943 N/A CYS 315.A N GLY 350.A O no hydrogen 3.173 N/A CYS 315.A SG GLY 350.A O no hydrogen 3.673 N/A CYS 316.A N LEU 378.A O no hydrogen 2.849 N/A CYS 316.A SG LEU 317.A O no hydrogen 3.712 N/A CYS 316.A SG LYS 352.A O no hydrogen 3.836 N/A LEU 317.A N LYS 352.A O no hydrogen 3.092 N/A LEU 318.A N CYS 376.A O no hydrogen 2.920 N/A TYR 319.A N GLY 354.A O no hydrogen 3.196 N/A ARG 320.A N ALA 374.A O no hydrogen 2.890 N/A ARG 320.A NE GLN 358.A O no hydrogen 3.071 N/A GLY 321.A N ASN 356.A O no hydrogen 3.245 N/A ASP 322.A N GLN 372.A O no hydrogen 3.474 N/A VAL 328.A N VAL 324.A O no hydrogen 3.020 N/A ASN 329.A N PRO 325.A O no hydrogen 2.888 N/A ALA 330.A N LYS 326.A O no hydrogen 2.897 N/A ALA 331.A N ASP 327.A O no hydrogen 2.931 N/A ILE 332.A N VAL 328.A O no hydrogen 2.907 N/A ALA 333.A N ASN 329.A O no hydrogen 2.902 N/A THR 334.A N ALA 330.A O no hydrogen 2.877 N/A THR 334.A OG1 ALA 330.A O no hydrogen 2.551 N/A ILE 335.A N ALA 331.A O no hydrogen 2.935 N/A LYS 336.A N ILE 332.A O no hydrogen 2.905 N/A LYS 336.A NZ PRO 348.A O no hydrogen 2.954 N/A THR 337.A N THR 334.A O no hydrogen 3.450 N/A THR 337.A OG1 ALA 333.A O no hydrogen 2.480 N/A ARG 339.A NH1 THR 337.A O no hydrogen 2.344 N/A CYS 347.A N VAL 344.A O no hydrogen 3.410 N/A CYS 347.A SG MET 313.A O no hydrogen 3.030 N/A CYS 347.A SG TRP 346.A O no hydrogen 3.109 N/A PHE 351.A N THR 349.A O no hydrogen 2.784 N/A LYS 352.A N CYS 315.A O no hydrogen 3.475 N/A ILE 355.A N LEU 248.A O no hydrogen 2.580 N/A GLN 358.A N ASN 356.A OD1 no hydrogen 3.081 N/A GLN 358.A NE2 PRO 359.A O no hydrogen 2.612 N/A THR 361.A OG1 VAL 362.A O no hydrogen 3.564 N/A GLY 366.A N VAL 363.A O no hydrogen 3.379 N/A ARG 373.A NE ASP 322.A O no hydrogen 2.687 N/A ARG 373.A NH2 ASP 322.A OD2 no hydrogen 3.157 N/A CYS 376.A N LEU 318.A O no hydrogen 2.911 N/A CYS 376.A SG THR 271.A O no hydrogen 3.202 N/A CYS 376.A SG MET 377.A O no hydrogen 3.768 N/A MET 377.A N THR 271.A O no hydrogen 2.903 N/A LEU 378.A N CYS 316.A O no hydrogen 2.898 N/A SER 379.A N LEU 269.A O no hydrogen 2.922 N/A ASN 380.A N ALA 314.A O no hydrogen 2.881 N/A ASN 380.A ND2 LEU 259.A O no hydrogen 3.074 N/A ASN 380.A ND2 ILE 265.A O no hydrogen 2.750 N/A THR 382.A N LYS 311.A O no hydrogen 2.714 N/A THR 382.A OG1 LYS 311.A O no hydrogen 3.215 N/A ALA 383.A N THR 381.A OG1 no hydrogen 3.060 N/A GLU 386.A N ALA 383.A O no hydrogen 3.129 N/A TRP 388.A N ILE 384.A O no hydrogen 3.163 N/A ALA 389.A N ALA 385.A O no hydrogen 2.540 N/A ARG 390.A N ALA 387.A O no hydrogen 2.937 N/A LEU 391.A N ALA 387.A O no hydrogen 3.331 N/A LEU 391.A N TRP 388.A O no hydrogen 2.957 N/A LYS 394.A N ARG 390.A O no hydrogen 2.828 N/A LYS 394.A NZ PRO 175.A O no hydrogen 2.315 N/A PHE 395.A N ASP 392.A O no hydrogen 3.237 N/A ASP 396.A N ASP 392.A O no hydrogen 2.696 N/A MET 398.A N PHE 395.A O no hydrogen 2.888 N/A TYR 399.A N PHE 395.A O no hydrogen 3.306 N/A TYR 399.A OH SER 419.A OG no hydrogen 2.511 N/A ALA 400.A N ASP 396.A O no hydrogen 2.904 N/A LYS 401.A N LEU 397.A O no hydrogen 2.957 N/A ARG 402.A NH1 TYR 399.A O no hydrogen 2.504 N/A ALA 403.A N MET 398.A O no hydrogen 3.126 N/A TYR 408.A N VAL 405.A O no hydrogen 2.744 N/A GLU 411.A N TYR 408.A O no hydrogen 2.984 N/A GLY 412.A N VAL 409.A O no hydrogen 3.000 N/A GLU 415.A N GLU 415.A OE1 no hydrogen 2.432 N/A PHE 418.A N GLU 415.A O no hydrogen 2.921 N/A SER 419.A OG TYR 399.A OH no hydrogen 2.511 N/A GLU 420.A N GLY 416.A O no hydrogen 2.815 N/A ALA 421.A N GLU 417.A O no hydrogen 2.757 N/A ARG 422.A N PHE 418.A O no hydrogen 2.608 N/A ARG 422.A NE ASP 396.A OD1 no hydrogen 2.874 N/A ARG 422.A NE ASP 396.A OD2 no hydrogen 3.385 N/A ARG 422.A NH2 ASP 396.A OD2 no hydrogen 2.625 N/A GLU 423.A N SER 419.A O no hydrogen 3.196 N/A MET 425.A N ALA 421.A O no hydrogen 3.012 N/A ALA 426.A N ARG 422.A O no hydrogen 2.853 N/A ALA 427.A N GLU 423.A O no hydrogen 2.633 N/A LEU 428.A N ASP 424.A O no hydrogen 2.909 N/A GLU 429.A N MET 425.A O no hydrogen 2.944 N/A LYS 430.A N ALA 426.A O no hydrogen 3.090 N/A ASP 431.A N ALA 427.A O no hydrogen 3.071 N/A TYR 432.A N LEU 428.A O no hydrogen 3.063 N/A TYR 432.A OH ILE 265.A O no hydrogen 3.119 N/A GLU 433.A N GLU 429.A O no hydrogen 2.702 N/A GLU 434.A N ASP 431.A O no hydrogen 3.191 N/A VAL 435.A N ASP 431.A O no hydrogen 3.305 N/A VAL 437.A N VAL 435.A O no hydrogen 2.680 N/A