Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2yu1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 2.A N GLY 208.A O no hydrogen 3.115 N/A GLU 7.A N ASP 4.A OD1 no hydrogen 2.615 N/A LYS 8.A N ASP 4.A O no hydrogen 3.276 N/A LYS 8.A NZ GLU 7.A OE2 no hydrogen 2.940 N/A LYS 8.A NZ ASP 214.A OD2 no hydrogen 2.749 N/A LEU 9.A N GLU 6.A O no hydrogen 3.016 N/A HIS 10.A N GLU 6.A O no hydrogen 2.967 N/A HIS 10.A N GLU 7.A O no hydrogen 3.192 N/A THR 11.A N GLU 7.A O no hydrogen 2.851 N/A THR 11.A OG1 GLU 7.A O no hydrogen 2.946 N/A LYS 13.A NZ ASP 214.A OD1 no hydrogen 2.964 N/A TYR 14.A OH ASP 214.A OD1 no hydrogen 2.978 N/A ALA 16.A N CYS 219.A O no hydrogen 3.054 N/A ASN 17.A ND2 VAL 19.A O no hydrogen 3.634 N/A PHE 18.A N GLN 220.A OE1 no hydrogen 2.756 N/A VAL 19.A N GLN 220.A OE1 no hydrogen 2.688 N/A THR 20.A N PRO 40.A O no hydrogen 3.041 N/A MET 22.A N ILE 42.A O no hydrogen 3.290 N/A LYS 25.A NZ ASP 26.A OD1 no hydrogen 2.766 N/A ASP 26.A N GLU 23.A O no hydrogen 2.640 N/A PHE 27.A N GLY 24.A O no hydrogen 2.939 N/A ASN 28.A N ASP 26.A O no hydrogen 3.246 N/A TYR 31.A N ASN 28.A O no hydrogen 2.966 N/A TYR 31.A N ASN 28.A OD1 no hydrogen 3.045 N/A ILE 32.A N ASN 28.A O no hydrogen 3.393 N/A GLN 33.A N VAL 29.A O no hydrogen 2.904 N/A GLN 33.A NE2 THR 378.A OG1 no hydrogen 3.262 N/A ARG 34.A N GLU 30.A O no hydrogen 2.869 N/A GLY 35.A N TYR 31.A O no hydrogen 2.763 N/A GLY 36.A N ILE 32.A O no hydrogen 2.563 N/A ARG 38.A NH1 GLY 36.A O no hydrogen 2.611 N/A ARG 38.A NH1 PHE 257.A O no hydrogen 2.489 N/A LEU 41.A N VAL 231.A O no hydrogen 2.811 N/A ILE 42.A N THR 20.A O no hydrogen 3.233 N/A PHE 43.A N THR 229.A O no hydrogen 2.945 N/A LEU 49.A N SER 46.A O no hydrogen 3.415 N/A LYS 52.A N GLN 123.A O no hydrogen 3.105 N/A ASP 55.A N ASP 55.A OD1 no hydrogen 2.579 N/A ASP 57.A N ASP 57.A OD2 no hydrogen 2.431 N/A PHE 58.A N ASP 55.A O no hydrogen 2.982 N/A THR 59.A N ASP 62.A OD2 no hydrogen 2.627 N/A THR 59.A OG1 ASP 57.A O no hydrogen 3.003 N/A THR 59.A OG1 ASP 62.A OD2 no hydrogen 3.209 N/A VAL 63.A N THR 59.A O no hydrogen 3.106 N/A VAL 63.A N VAL 60.A O no hydrogen 2.720 N/A LYS 64.A N VAL 60.A O no hydrogen 2.756 N/A LYS 64.A NZ ASN 61.A OD1 no hydrogen 3.452 N/A MET 65.A N ASN 61.A O no hydrogen 3.284 N/A CYS 66.A SG ASP 62.A O no hydrogen 3.045 N/A VAL 67.A N VAL 63.A O no hydrogen 3.409 N/A VAL 73.A N MET 86.A O no hydrogen 2.636 N/A MET 76.A N ASN 107.A O no hydrogen 2.935 N/A VAL 78.A N LEU 105.A O no hydrogen 2.973 N/A ASN 79.A N ASP 77.A OD2 no hydrogen 2.847 N/A THR 80.A N ASP 77.A O no hydrogen 2.628 N/A THR 87.A OG1 GLN 90.A OE1 no hydrogen 2.662 N/A ALA 89.A N THR 87.A OG1 no hydrogen 2.883 N/A GLN 90.A N GLN 90.A OE1 no hydrogen 2.500 N/A TRP 91.A N THR 87.A O no hydrogen 2.996 N/A THR 92.A N MET 88.A O no hydrogen 2.654 N/A THR 92.A OG1 MET 88.A O no hydrogen 2.750 N/A ARG 93.A N ALA 89.A O no hydrogen 3.511 N/A TYR 94.A N GLN 90.A O no hydrogen 3.238 N/A TYR 94.A OH LYS 104.A O no hydrogen 2.264 N/A TYR 95.A N TRP 91.A O no hydrogen 2.846 N/A GLU 96.A N THR 92.A O no hydrogen 3.319 N/A THR 97.A N TYR 94.A O no hydrogen 2.985 N/A THR 97.A OG1 ARG 93.A O no hydrogen 3.048 N/A THR 97.A OG1 TYR 94.A O no hydrogen 3.515 N/A ARG 102.A N PRO 98.A O no hydrogen 2.806 N/A ARG 102.A NH1 TYR 94.A O no hydrogen 3.442 N/A ARG 102.A NH1 ASP 245.A OD2 no hydrogen 3.454 N/A ARG 102.A NH2 ASP 245.A OD1 no hydrogen 3.318 N/A ARG 102.A NH2 ASP 245.A OD2 no hydrogen 3.062 N/A TYR 106.A N TYR 94.A OH no hydrogen 2.906 N/A ASN 107.A N MET 76.A O no hydrogen 2.979 N/A ASN 107.A ND2 MET 156.A O no hydrogen 3.332 N/A ASN 107.A ND2 SER 157.A OG no hydrogen 2.351 N/A VAL 108.A N MET 156.A O no hydrogen 3.137 N/A SER 114.A OG GLU 112.A OE2 no hydrogen 2.258 N/A SER 114.A OG HIS 115.A ND1 no hydrogen 3.411 N/A THR 116.A N PHE 113.A O no hydrogen 2.659 N/A THR 116.A OG1 PHE 113.A O no hydrogen 2.772 N/A GLU 119.A N THR 116.A O no hydrogen 3.079 N/A MET 121.A N LEU 118.A O no hydrogen 2.948 N/A VAL 122.A N GLU 119.A O no hydrogen 2.792 N/A GLN 123.A N LYS 52.A O no hydrogen 2.919 N/A GLN 123.A NE2 VAL 122.A O no hydrogen 3.470 N/A ARG 124.A NE ASP 129.A OD1 no hydrogen 3.019 N/A ARG 124.A NH2 ASP 135.A OD2 no hydrogen 2.599 N/A SER 126.A N LEU 49.A O no hydrogen 3.140 N/A SER 126.A OG LEU 49.A O no hydrogen 3.130 N/A THR 127.A OG1 PHE 27.A O no hydrogen 2.283 N/A VAL 128.A N PRO 125.A O no hydrogen 2.818 N/A ASP 129.A N SER 126.A O no hydrogen 2.942 N/A PHE 130.A N SER 126.A O no hydrogen 3.205 N/A PHE 130.A N THR 127.A O no hydrogen 2.974 N/A ILE 131.A N THR 127.A O no hydrogen 3.316 N/A ASP 132.A N VAL 128.A O no hydrogen 3.073 N/A TRP 133.A N LEU 254.A O no hydrogen 2.751 N/A TRP 133.A NE1 SER 256.A OG no hydrogen 2.648 N/A ASP 135.A N ASP 132.A OD2 no hydrogen 2.714 N/A ASN 136.A N ASP 132.A O no hydrogen 3.207 N/A ASN 136.A ND2 ASP 129.A O no hydrogen 2.965 N/A ASN 136.A ND2 ASP 132.A O no hydrogen 2.668 N/A MET 137.A N TRP 133.A O no hydrogen 2.695 N/A TRP 138.A N VAL 134.A O no hydrogen 3.279 N/A TRP 138.A NE1 GLN 146.A O no hydrogen 3.093 N/A ARG 140.A NH1 SER 312.A O no hydrogen 3.423 N/A ARG 140.A NH1 ASP 316.A OD1 no hydrogen 3.222 N/A ARG 140.A NH2 ASP 316.A OD1 no hydrogen 2.575 N/A LEU 142.A N PRO 139.A O no hydrogen 3.001 N/A LYS 143.A N ARG 140.A O no hydrogen 3.182 N/A GLN 151.A NE2 ASP 135.A OD1 no hydrogen 2.813 N/A LYS 152.A N GLU 112.A OE2 no hydrogen 3.169 N/A LYS 152.A NZ GLU 119.A OE2 no hydrogen 2.898 N/A TYR 153.A N GLY 250.A O no hydrogen 2.601 N/A CYS 154.A N LEU 111.A O no hydrogen 2.820 N/A LEU 155.A N VAL 248.A O no hydrogen 2.822 N/A MET 156.A N VAL 108.A O no hydrogen 2.747 N/A SER 157.A N THR 246.A O no hydrogen 2.923 N/A ARG 159.A N ASP 245.A OD1 no hydrogen 3.151 N/A GLY 160.A N THR 242.A O no hydrogen 2.744 N/A CYS 161.A N VAL 158.A O no hydrogen 3.085 N/A CYS 161.A SG VAL 158.A O no hydrogen 2.973 N/A CYS 161.A SG THR 242.A OG1 no hydrogen 3.569 N/A TYR 162.A OH ASP 164.A OD1 no hydrogen 2.472 N/A THR 163.A N VAL 240.A O no hydrogen 2.672 N/A HIS 166.A N HIS 238.A O no hydrogen 2.941 N/A HIS 166.A ND1 ASP 164.A O no hydrogen 3.141 N/A GLY 170.A N GLU 269.A OE2 no hydrogen 2.968 N/A GLY 171.A N ASP 168.A O no hydrogen 3.097 N/A THR 172.A N PHE 169.A O no hydrogen 3.092 N/A THR 172.A OG1 PHE 169.A O no hydrogen 2.683 N/A THR 172.A OG1 ASN 252.A OD1 no hydrogen 3.495 N/A SER 173.A N PHE 253.A O no hydrogen 2.876 N/A VAL 174.A N ILE 232.A O no hydrogen 3.012 N/A TRP 175.A N GLY 251.A O no hydrogen 2.997 N/A TYR 176.A N PHE 230.A O no hydrogen 2.741 N/A HIS 177.A N PHE 249.A O no hydrogen 2.959 N/A HIS 177.A ND1 THR 229.A OG1 no hydrogen 2.759 N/A ILE 178.A N TYR 228.A O no hydrogen 3.038 N/A HIS 179.A N LEU 247.A O no hydrogen 3.004 N/A GLN 180.A N LEU 247.A O no hydrogen 3.185 N/A LYS 183.A N LEU 224.A O no hydrogen 2.965 N/A LYS 183.A NZ SER 157.A OG no hydrogen 3.164 N/A LYS 183.A NZ THR 242.A OG1 no hydrogen 2.492 N/A VAL 184.A N TYR 241.A O no hydrogen 2.822 N/A PHE 185.A N ILE 222.A O no hydrogen 2.727 N/A TRP 186.A N ALA 239.A O no hydrogen 3.049 N/A TRP 186.A NE1 LYS 8.A O no hydrogen 3.132 N/A LEU 187.A N GLN 220.A O no hydrogen 2.817 N/A ILE 188.A N ILE 237.A O no hydrogen 2.821 N/A THR 191.A N PRO 189.A O no hydrogen 2.552 N/A ASN 194.A ND2 PRO 189.A O no hydrogen 2.959 N/A LEU 195.A N THR 191.A O no hydrogen 2.780 N/A GLU 196.A N ALA 192.A O no hydrogen 3.223 N/A GLU 196.A N HIS 193.A O no hydrogen 3.026 N/A LEU 197.A N HIS 193.A O no hydrogen 3.056 N/A TYR 198.A N ASN 194.A O no hydrogen 2.876 N/A GLU 199.A N LEU 195.A O no hydrogen 3.315 N/A ASN 200.A N GLU 196.A O no hydrogen 2.919 N/A ASN 200.A ND2 GLU 196.A OE1 no hydrogen 3.401 N/A TRP 201.A N LEU 197.A O no hydrogen 2.943 N/A LEU 202.A N TYR 198.A O no hydrogen 3.018 N/A LEU 202.A N GLU 199.A O no hydrogen 3.066 N/A LEU 203.A N GLU 199.A O no hydrogen 3.181 N/A LEU 203.A N ASN 200.A O no hydrogen 3.334 N/A SER 204.A N ASN 200.A O no hydrogen 3.142 N/A SER 204.A OG TRP 201.A O no hydrogen 3.249 N/A SER 206.A N TRP 201.A O no hydrogen 2.687 N/A SER 206.A OG SER 206.A O no hydrogen 2.377 N/A ASP 214.A N PHE 211.A O no hydrogen 2.781 N/A ARG 215.A N LEU 212.A O no hydrogen 2.936 N/A SER 217.A OG ASP 218.A OD2 no hydrogen 3.034 N/A CYS 219.A SG LEU 187.A O no hydrogen 3.577 N/A GLN 220.A N LEU 187.A O no hydrogen 2.995 N/A ARG 221.A N TYR 14.A O no hydrogen 3.116 N/A ARG 221.A NH1 LYS 8.A O no hydrogen 2.866 N/A ARG 221.A NH1 THR 11.A O no hydrogen 2.672 N/A ARG 221.A NH2 THR 11.A O no hydrogen 2.946 N/A ARG 221.A NH2 ASN 12.A OD1 no hydrogen 3.448 N/A ILE 222.A N PHE 185.A O no hydrogen 2.508 N/A LEU 224.A N LYS 183.A O no hydrogen 2.750 N/A GLN 226.A NE2 HIS 179.A O no hydrogen 3.472 N/A GLY 227.A N ILE 178.A O no hydrogen 2.781 N/A TYR 228.A N LYS 225.A O no hydrogen 3.292 N/A THR 229.A N PHE 43.A O no hydrogen 3.034 N/A THR 229.A OG1 HIS 177.A ND1 no hydrogen 2.759 N/A PHE 230.A N TYR 176.A O no hydrogen 2.570 N/A VAL 231.A N LEU 41.A O no hydrogen 2.834 N/A ILE 232.A N VAL 174.A O no hydrogen 2.787 N/A SER 234.A OG GLY 171.A O no hydrogen 2.595 N/A TRP 236.A N PRO 233.A O no hydrogen 3.316 N/A ILE 237.A N ILE 188.A O no hydrogen 2.941 N/A HIS 238.A N HIS 166.A O no hydrogen 3.032 N/A HIS 238.A ND1 TRP 236.A O no hydrogen 3.143 N/A ALA 239.A N TRP 186.A O no hydrogen 3.119 N/A VAL 240.A N THR 163.A O no hydrogen 2.778 N/A TYR 241.A N VAL 184.A O no hydrogen 2.986 N/A THR 242.A N CYS 161.A O no hydrogen 2.921 N/A THR 246.A N SER 157.A O no hydrogen 2.754 N/A LEU 247.A N GLN 180.A O no hydrogen 2.811 N/A VAL 248.A N LEU 155.A O no hydrogen 2.833 N/A PHE 249.A N HIS 177.A O no hydrogen 3.303 N/A GLY 250.A N TYR 153.A O no hydrogen 2.778 N/A GLY 251.A N TRP 175.A O no hydrogen 2.951 N/A PHE 253.A N SER 173.A O no hydrogen 2.989 N/A HIS 255.A N GLN 262.A OE1 no hydrogen 3.037 N/A GLN 262.A N ASN 258.A O no hydrogen 3.306 N/A GLN 262.A NE2 HIS 255.A O no hydrogen 3.208 N/A LEU 263.A N ILE 259.A O no hydrogen 2.914 N/A LYS 264.A N PRO 260.A O no hydrogen 2.809 N/A ILE 265.A N MET 261.A O no hydrogen 2.851 N/A TYR 266.A N GLN 262.A O no hydrogen 3.229 N/A ASN 267.A N LEU 263.A O no hydrogen 3.034 N/A ILE 268.A N ILE 265.A O no hydrogen 3.068 N/A GLU 269.A N ILE 265.A O no hydrogen 3.035 N/A ASP 270.A N TYR 266.A O no hydrogen 2.833 N/A ARG 271.A N ASN 267.A O no hydrogen 3.119 N/A THR 272.A N ILE 268.A O no hydrogen 2.743 N/A THR 272.A OG1 ILE 268.A O no hydrogen 2.716 N/A ARG 273.A N ASP 270.A O no hydrogen 3.409 N/A VAL 274.A N GLU 269.A O no hydrogen 3.050 N/A PHE 278.A N PRO 275.A O no hydrogen 2.923 N/A ARG 279.A NH1 TYR 266.A O no hydrogen 3.530 N/A ARG 279.A NH2 ASP 270.A OD1 no hydrogen 2.529 N/A TYR 283.A OH GLY 170.A O no hydrogen 3.324 N/A MET 286.A N PHE 282.A O no hydrogen 2.960 N/A CYS 287.A N TYR 283.A O no hydrogen 3.113 N/A CYS 287.A SG TYR 283.A O no hydrogen 3.336 N/A TRP 288.A N TYR 284.A O no hydrogen 3.119 N/A TRP 288.A NE1 LYS 345.A O no hydrogen 2.656 N/A TYR 289.A N GLU 285.A O no hydrogen 3.337 N/A VAL 290.A N MET 286.A O no hydrogen 2.886 N/A LEU 291.A N CYS 287.A O no hydrogen 3.125 N/A GLU 292.A N TRP 288.A O no hydrogen 3.139 N/A ARG 293.A N TYR 289.A O no hydrogen 2.800 N/A ARG 293.A NE ASN 136.A O no hydrogen 3.371 N/A ARG 293.A NH2 GLN 384.A O no hydrogen 3.036 N/A TYR 294.A N VAL 290.A O no hydrogen 2.996 N/A TYR 294.A OH GLU 326.A OE1 no hydrogen 2.808 N/A VAL 295.A N LEU 291.A O no hydrogen 2.856 N/A TYR 296.A N GLU 292.A O no hydrogen 2.974 N/A CYS 297.A N ARG 293.A O no hydrogen 2.673 N/A CYS 297.A SG ARG 293.A O no hydrogen 3.149 N/A ILE 298.A N TYR 294.A O no hydrogen 2.824 N/A THR 299.A N VAL 295.A O no hydrogen 2.648 N/A ASN 300.A N TYR 296.A O no hydrogen 2.727 N/A SER 302.A OG GLU 292.A OE2 no hydrogen 3.415 N/A HIS 303.A N GLU 292.A OE2 no hydrogen 2.788 N/A LEU 304.A N SER 302.A OG no hydrogen 3.415 N/A THR 305.A N GLY 350.A O no hydrogen 2.958 N/A THR 305.A OG1 GLU 307.A OE1 no hydrogen 3.399 N/A GLN 309.A N THR 305.A O no hydrogen 2.909 N/A GLN 309.A NE2 LEU 304.A O no hydrogen 2.500 N/A GLN 309.A NE2 THR 305.A O no hydrogen 3.461 N/A LYS 310.A N LYS 306.A O no hydrogen 2.891 N/A GLU 311.A N GLU 307.A O no hydrogen 3.073 N/A SER 312.A N PHE 308.A O no hydrogen 2.994 N/A LEU 313.A N GLN 309.A O no hydrogen 2.907 N/A SER 314.A N LYS 310.A O no hydrogen 2.716 N/A SER 314.A OG LYS 310.A O no hydrogen 3.089 N/A MET 315.A N GLU 311.A O no hydrogen 2.801 N/A ASP 316.A N SER 312.A O no hydrogen 3.115 N/A LEU 317.A N LEU 313.A O no hydrogen 2.926 N/A LEU 322.A N SER 371.A OG no hydrogen 3.340 N/A THR 323.A N GLU 326.A OE2 no hydrogen 3.216 N/A THR 323.A OG1 GLU 326.A OE2 no hydrogen 2.552 N/A GLU 326.A N THR 323.A OG1 no hydrogen 3.382 N/A LEU 327.A N THR 323.A O no hydrogen 3.214 N/A GLU 328.A N HIS 324.A O no hydrogen 2.766 N/A GLY 329.A N PHE 325.A O no hydrogen 2.956 N/A LEU 330.A N GLU 326.A O no hydrogen 2.610 N/A ARG 331.A N LEU 327.A O no hydrogen 3.116 N/A ARG 331.A NE ASP 335.A OD2 no hydrogen 3.220 N/A ARG 331.A NH2 ASP 335.A OD1 no hydrogen 2.834 N/A CYS 332.A N GLU 328.A O no hydrogen 3.148 N/A CYS 332.A SG GLU 328.A O no hydrogen 3.560 N/A LEU 333.A N GLY 329.A O no hydrogen 2.982 N/A VAL 334.A N LEU 330.A O no hydrogen 2.910 N/A ASP 335.A N ARG 331.A O no hydrogen 2.908 N/A LYS 336.A N CYS 332.A O no hydrogen 2.668 N/A LYS 336.A NZ ASN 267.A OD1 no hydrogen 3.160 N/A LEU 337.A N LEU 333.A O no hydrogen 3.083 N/A GLU 338.A N VAL 334.A O no hydrogen 3.034 N/A SER 339.A N ASP 335.A O no hydrogen 3.037 N/A SER 339.A N LYS 336.A O no hydrogen 2.882 N/A SER 339.A OG ASP 335.A O no hydrogen 3.453 N/A SER 339.A OG LYS 336.A O no hydrogen 2.759 N/A LYS 344.A N PRO 341.A O no hydrogen 2.649 N/A LYS 345.A NZ LEU 337.A O no hydrogen 2.888 N/A LYS 345.A NZ GLU 338.A O no hydrogen 3.345 N/A LYS 345.A NZ LEU 340.A O no hydrogen 2.640 N/A CYS 346.A SG LYS 344.A O no hydrogen 3.896 N/A GLY 350.A N TYR 289.A OH no hydrogen 3.213 N/A GLU 352.A N HIS 303.A O no hydrogen 3.220 N/A ALA 356.A N ASP 353.A OD1 no hydrogen 2.871 N/A LEU 357.A N ASP 353.A O no hydrogen 3.222 N/A ILE 358.A N GLU 354.A O no hydrogen 2.680 N/A ALA 359.A N ASP 355.A O no hydrogen 2.706 N/A ASP 360.A N ALA 356.A O no hydrogen 2.865 N/A VAL 361.A N LEU 357.A O no hydrogen 2.883 N/A VAL 361.A N ILE 358.A O no hydrogen 3.190 N/A LYS 362.A N ILE 358.A O no hydrogen 3.037 N/A LYS 362.A NZ GLU 338.A OE2 no hydrogen 2.712 N/A ILE 363.A N ALA 359.A O no hydrogen 3.116 N/A LEU 364.A N ASP 360.A O no hydrogen 2.990 N/A LEU 365.A N VAL 361.A O no hydrogen 2.628 N/A GLU 366.A N LYS 362.A O no hydrogen 3.197 N/A GLU 366.A N ILE 363.A O no hydrogen 3.155 N/A GLU 367.A N ILE 363.A O no hydrogen 3.019 N/A LEU 368.A N LEU 364.A O no hydrogen 3.109 N/A ALA 369.A N GLU 366.A O no hydrogen 3.393 N/A SER 371.A OG LEU 368.A O no hydrogen 2.736 N/A ASP 372.A N HIS 321.A ND1 no hydrogen 2.930 N/A LEU 375.A N ASP 372.A OD1 no hydrogen 2.929 N/A ALA 376.A N ASP 372.A O no hydrogen 2.727 N/A LEU 377.A N PRO 373.A O no hydrogen 3.239 N/A LEU 377.A N LYS 374.A O no hydrogen 3.124 N/A THR 378.A N ALA 376.A O no hydrogen 2.557 N/A THR 378.A OG1 VAL 380.A O no hydrogen 2.782 N/A GLY 379.A N GLN 33.A OE1 no hydrogen 2.818 N/A VAL 380.A N THR 378.A OG1 no hydrogen 3.333 N/A GLN 384.A NE2 PRO 381.A O no hydrogen 3.638 N/A