Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1s1u_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 6.A N ASP 110.A OD2 no hydrogen 3.062 N/A LYS 7.A N GLN 81.A OE1 no hydrogen 2.829 N/A LYS 9.A N ARG 79.A O no hydrogen 2.690 N/A LYS 9.A NZ LYS 78.A O no hydrogen 2.840 N/A LYS 9.A NZ THR 80.A O no hydrogen 3.011 N/A MET 12.A N LYS 9.A O no hydrogen 3.081 N/A GLY 14.A N ASP 13.A OD1 no hydrogen 2.516 N/A VAL 17.A N ASN 53.A O no hydrogen 2.925 N/A GLN 19.A NE2 TRP 20.A O no hydrogen 3.031 N/A GLN 19.A NE2 VAL 56.A O no hydrogen 2.978 N/A LYS 26.A NZ ALA 58.A O no hydrogen 3.036 N/A LYS 26.A NZ THR 376.A O no hydrogen 3.543 N/A ILE 27.A N THR 23.A O no hydrogen 2.932 N/A LYS 28.A N GLU 24.A O no hydrogen 2.872 N/A ALA 29.A N GLU 25.A O no hydrogen 3.200 N/A LEU 30.A N LYS 26.A O no hydrogen 2.908 N/A VAL 31.A N ILE 27.A O no hydrogen 2.822 N/A GLU 32.A N LYS 28.A O no hydrogen 2.938 N/A ILE 33.A N ALA 29.A O no hydrogen 3.000 N/A CYS 34.A N LEU 30.A O no hydrogen 2.900 N/A CYS 34.A SG LEU 30.A O no hydrogen 3.511 N/A THR 35.A N VAL 31.A O no hydrogen 2.825 N/A THR 35.A OG1 VAL 31.A O no hydrogen 2.500 N/A GLU 36.A N GLU 32.A O no hydrogen 3.441 N/A MET 37.A N ILE 33.A O no hydrogen 3.010 N/A GLU 38.A N CYS 34.A O no hydrogen 2.878 N/A LYS 39.A N THR 35.A O no hydrogen 3.225 N/A GLU 40.A N GLU 36.A O no hydrogen 3.139 N/A GLY 41.A N GLU 38.A O no hydrogen 2.655 N/A LYS 42.A N MET 37.A O no hydrogen 2.752 N/A LYS 42.A NZ GLU 40.A OE1 no hydrogen 2.883 N/A ILE 43.A N MET 37.A O no hydrogen 3.281 N/A SER 44.A N GLN 134.A O no hydrogen 2.955 N/A SER 44.A OG ASN 136.A OD1 no hydrogen 2.916 N/A ILE 46.A N ARG 132.A O no hydrogen 2.939 N/A ASN 50.A N GLY 47.A O no hydrogen 2.936 N/A ASN 50.A ND2 LYS 115.A O no hydrogen 3.161 N/A ASN 50.A ND2 GLN 134.A OE1 no hydrogen 3.397 N/A TYR 52.A N ASN 50.A OD1 no hydrogen 2.969 N/A TYR 52.A OH ASP 13.A OD1 no hydrogen 2.458 N/A ASN 53.A N PRO 15.A O no hydrogen 2.694 N/A ASN 53.A ND2 VAL 17.A O no hydrogen 3.196 N/A VAL 56.A N GLN 19.A OE1 no hydrogen 2.694 N/A PHE 57.A N LEU 70.A O no hydrogen 2.633 N/A ILE 59.A N ARG 68.A O no hydrogen 2.869 N/A LYS 61.A N LYS 66.A O no hydrogen 3.013 N/A LYS 62.A NZ MET 208.A O no hydrogen 3.121 N/A ARG 68.A N ILE 59.A O no hydrogen 2.654 N/A ARG 68.A NH2 ASP 174.A OD1 no hydrogen 3.167 N/A LYS 69.A NZ TYR 135.A OH no hydrogen 2.949 N/A LEU 70.A N PHE 57.A O no hydrogen 2.624 N/A ASP 72.A N PRO 55.A O no hydrogen 3.064 N/A PHE 73.A N VAL 71.A O no hydrogen 2.776 N/A ARG 74.A NE ASP 72.A OD1 no hydrogen 3.226 N/A ARG 74.A NE ASP 72.A OD2 no hydrogen 2.694 N/A ARG 74.A NH2 ASP 72.A OD1 no hydrogen 3.127 N/A ASN 77.A N PHE 73.A O no hydrogen 2.678 N/A ASN 77.A ND2 GLY 141.A O no hydrogen 2.946 N/A LYS 78.A N ARG 74.A O no hydrogen 3.024 N/A ARG 79.A N GLU 75.A O no hydrogen 3.318 N/A ARG 79.A N LEU 76.A O no hydrogen 2.638 N/A ARG 79.A NE GLU 75.A OE2 no hydrogen 2.711 N/A ARG 79.A NH1 ASP 13.A O no hydrogen 3.203 N/A ARG 79.A NH2 GLU 75.A OE2 no hydrogen 2.889 N/A THR 80.A N ASN 77.A O no hydrogen 3.396 N/A THR 80.A OG1 LEU 76.A O no hydrogen 2.912 N/A GLN 81.A N LYS 7.A O no hydrogen 3.090 N/A ILE 89.A N PRO 86.A O no hydrogen 3.190 N/A LYS 91.A N GLY 88.A O no hydrogen 3.067 N/A LYS 92.A N GLY 88.A O no hydrogen 3.201 N/A LYS 92.A N ILE 89.A O no hydrogen 2.921 N/A LYS 92.A NZ GLY 179.A O no hydrogen 3.282 N/A LYS 93.A N SER 180.A O no hydrogen 2.900 N/A LYS 93.A N ASP 181.A OD2 no hydrogen 2.891 N/A SER 94.A N SER 180.A O no hydrogen 2.864 N/A VAL 95.A N LEU 212.A O no hydrogen 3.160 N/A THR 96.A N VAL 178.A O no hydrogen 2.931 N/A THR 96.A OG1 HIS 187.A NE2 no hydrogen 2.714 N/A LEU 98.A N LEU 176.A O no hydrogen 2.751 N/A VAL 100.A N ASP 174.A O no hydrogen 2.784 N/A ALA 103.A N VAL 100.A O no hydrogen 2.965 N/A TYR 104.A OH MET 173.A O no hydrogen 3.059 N/A SER 106.A N ALA 103.A O no hydrogen 2.784 N/A SER 106.A OG ALA 103.A O no hydrogen 3.221 N/A VAL 107.A N TYR 104.A O no hydrogen 2.801 N/A LEU 109.A N ASN 136.A O no hydrogen 2.592 N/A GLU 111.A N GLU 111.A OE2 no hydrogen 2.699 N/A PHE 113.A N ASP 110.A O no hydrogen 2.681 N/A ARG 114.A N ASP 110.A O no hydrogen 3.341 N/A ARG 114.A NE LEU 109.A O no hydrogen 2.814 N/A ARG 114.A NH2 LEU 109.A O no hydrogen 3.107 N/A LYS 115.A NZ ASP 112.A O no hydrogen 2.805 N/A TYR 116.A N PHE 113.A O no hydrogen 2.710 N/A THR 117.A N ARG 114.A O no hydrogen 3.007 N/A THR 117.A OG1 ARG 114.A O no hydrogen 2.416 N/A ALA 118.A N LYS 115.A O no hydrogen 3.202 N/A PHE 119.A N TYR 133.A O no hydrogen 3.047 N/A THR 120.A OG1 ASN 53.A OD1 no hydrogen 2.715 N/A ILE 121.A N ILE 131.A O no hydrogen 2.609 N/A SER 123.A OG ILE 124.A O no hydrogen 3.500 N/A ASN 125.A ND2 GLU 127.A OE1 no hydrogen 3.365 N/A ASN 126.A N SER 123.A O no hydrogen 3.118 N/A GLU 127.A N ILE 124.A O no hydrogen 2.886 N/A THR 128.A N SER 123.A OG no hydrogen 2.552 N/A ILE 131.A N ILE 121.A O no hydrogen 2.812 N/A ARG 132.A NH1 TYR 52.A O no hydrogen 3.286 N/A ARG 132.A NH1 ASN 53.A OD1 no hydrogen 2.780 N/A ARG 132.A NH1 THR 120.A OG1 no hydrogen 2.718 N/A ARG 132.A NH2 ASN 50.A O no hydrogen 2.903 N/A ARG 132.A NH2 TYR 52.A O no hydrogen 2.594 N/A TYR 133.A N PHE 119.A O no hydrogen 3.315 N/A GLN 134.A N SER 44.A O no hydrogen 3.000 N/A TYR 135.A N THR 117.A OG1 no hydrogen 2.781 N/A ASN 136.A N LYS 42.A O no hydrogen 2.740 N/A VAL 137.A N LYS 42.A O no hydrogen 3.347 N/A LEU 138.A N VAL 107.A O no hydrogen 2.882 N/A GLY 141.A N ASP 174.A OD2 no hydrogen 2.967 N/A TRP 142.A N PRO 139.A O no hydrogen 3.317 N/A TRP 142.A NE1 THR 80.A OG1 no hydrogen 3.245 N/A LYS 143.A N ASN 77.A OD1 no hydrogen 3.049 N/A LYS 143.A NZ THR 80.A O no hydrogen 3.068 N/A LYS 143.A NZ GLN 81.A O no hydrogen 3.327 N/A SER 145.A N TRP 142.A O no hydrogen 2.865 N/A SER 145.A OG PRO 139.A O no hydrogen 2.676 N/A SER 145.A OG TRP 142.A O no hydrogen 3.170 N/A ILE 148.A N GLY 144.A O no hydrogen 2.932 N/A PHE 149.A N SER 145.A O no hydrogen 2.805 N/A GLN 150.A N ALA 147.A O no hydrogen 2.570 N/A GLN 150.A NE2 GLN 150.A O no hydrogen 3.252 N/A MET 153.A N PHE 149.A O no hydrogen 2.887 N/A THR 154.A N GLN 150.A O no hydrogen 2.781 N/A THR 154.A OG1 GLN 150.A O no hydrogen 3.418 N/A THR 154.A OG1 SER 151.A O no hydrogen 2.590 N/A LYS 155.A N SER 151.A O no hydrogen 3.077 N/A ILE 156.A N SER 152.A O no hydrogen 3.264 N/A LEU 157.A N THR 154.A O no hydrogen 2.861 N/A ARG 161.A N LEU 157.A O no hydrogen 3.102 N/A ARG 161.A NH2 ILE 169.A O no hydrogen 2.968 N/A LYS 162.A N GLU 158.A O no hydrogen 3.114 N/A LYS 162.A N PRO 159.A O no hydrogen 3.075 N/A GLN 163.A N PRO 159.A O no hydrogen 2.528 N/A ASN 164.A ND2 ASP 166.A OD1 no hydrogen 3.433 N/A ASP 166.A N ASP 166.A OD1 no hydrogen 2.630 N/A ILE 167.A N ASN 164.A O no hydrogen 3.053 N/A VAL 168.A N GLY 179.A O no hydrogen 2.967 N/A TYR 170.A N TYR 177.A O no hydrogen 2.831 N/A TYR 170.A OH GLY 357.A O no hydrogen 3.334 N/A TYR 172.A N ASP 175.A O no hydrogen 2.838 N/A ASP 175.A N TYR 172.A O no hydrogen 2.835 N/A LEU 176.A N LEU 98.A O no hydrogen 2.844 N/A TYR 177.A N TYR 170.A O no hydrogen 2.700 N/A VAL 178.A N THR 96.A O no hydrogen 2.820 N/A GLY 179.A N VAL 168.A O no hydrogen 2.628 N/A SER 180.A N SER 94.A O no hydrogen 2.729 N/A SER 180.A OG HIS 187.A ND1 no hydrogen 2.884 N/A HIS 187.A N GLU 183.A O no hydrogen 2.749 N/A HIS 187.A ND1 SER 180.A OG no hydrogen 2.884 N/A HIS 187.A NE2 THR 96.A OG1 no hydrogen 2.714 N/A ARG 188.A N ILE 184.A O no hydrogen 3.293 N/A THR 189.A N GLY 185.A O no hydrogen 3.417 N/A THR 189.A OG1 GLY 185.A O no hydrogen 3.076 N/A LYS 190.A N GLN 186.A O no hydrogen 3.048 N/A ILE 191.A N HIS 187.A O no hydrogen 2.920 N/A GLU 192.A N ARG 188.A O no hydrogen 3.193 N/A GLU 193.A N THR 189.A O no hydrogen 3.046 N/A LEU 194.A N LYS 190.A O no hydrogen 3.353 N/A ARG 195.A N ILE 191.A O no hydrogen 3.068 N/A GLN 196.A N GLU 192.A O no hydrogen 3.195 N/A HIS 197.A N GLU 193.A O no hydrogen 2.819 N/A LEU 198.A N ARG 195.A O no hydrogen 3.206 N/A LEU 199.A N ARG 195.A O no hydrogen 2.939 N/A ARG 200.A N GLN 196.A O no hydrogen 2.707 N/A TRP 201.A N LEU 198.A O no hydrogen 2.710 N/A GLY 202.A N LEU 198.A O no hydrogen 2.592 N/A LEU 206.A N VAL 97.A O no hydrogen 2.772 N/A LYS 216.A N HIS 213.A O no hydrogen 3.277 N/A LYS 216.A NZ ASP 215.A OD2 no hydrogen 3.429 N/A TRP 217.A N PRO 214.A O no hydrogen 2.688 N/A GLN 220.A N THR 329.A O no hydrogen 3.472 N/A SER 229.A OG ASP 228.A OD1 no hydrogen 3.452 N/A THR 231.A N ASP 234.A OD1 no hydrogen 2.818 N/A THR 231.A OG1 ASP 234.A OD1 no hydrogen 2.859 N/A VAL 232.A N GLU 269.A O no hydrogen 3.121 N/A ASN 233.A N LEU 267.A O no hydrogen 3.161 N/A ILE 235.A N THR 231.A O no hydrogen 3.117 N/A GLN 236.A N VAL 232.A O no hydrogen 2.894 N/A LYS 237.A N ASN 233.A O no hydrogen 2.844 N/A LEU 238.A N ASP 234.A O no hydrogen 2.744 N/A VAL 239.A N ILE 235.A O no hydrogen 2.750 N/A GLY 240.A N GLN 236.A O no hydrogen 2.941 N/A LYS 241.A N LYS 237.A O no hydrogen 2.776 N/A LYS 241.A NZ VAL 223.A O no hydrogen 3.306 N/A LEU 242.A N LEU 238.A O no hydrogen 2.714 N/A ASN 243.A N VAL 239.A O no hydrogen 2.646 N/A TRP 244.A N GLY 240.A O no hydrogen 3.207 N/A ALA 245.A N LYS 241.A O no hydrogen 3.078 N/A SER 246.A N ASN 243.A O no hydrogen 3.012 N/A SER 246.A OG ASN 243.A O no hydrogen 2.277 N/A GLN 247.A N TRP 244.A O no hydrogen 2.872 N/A ILE 248.A N ALA 245.A O no hydrogen 3.168 N/A TYR 249.A N ALA 245.A O no hydrogen 2.869 N/A TYR 249.A OH GLU 290.A O no hydrogen 2.357 N/A ILE 252.A N TYR 249.A O no hydrogen 3.292 N/A LYS 253.A N ASN 284.A OD1 no hydrogen 2.953 N/A GLN 256.A N GLU 280.A OE1 no hydrogen 2.882 N/A LEU 257.A N GLU 280.A OE2 no hydrogen 2.796 N/A CYS 258.A N VAL 254.A O no hydrogen 2.966 N/A LYS 259.A N ARG 255.A O no hydrogen 3.241 N/A LYS 259.A N GLN 256.A O no hydrogen 3.135 N/A LEU 260.A N LEU 257.A O no hydrogen 2.797 N/A LEU 261.A N CYS 258.A O no hydrogen 3.054 N/A ARG 262.A N LYS 259.A O no hydrogen 3.258 N/A LYS 265.A NZ LEU 260.A O no hydrogen 3.056 N/A LYS 265.A NZ ARG 262.A O no hydrogen 2.544 N/A GLU 269.A N ALA 266.A O no hydrogen 3.080 N/A ILE 271.A N TRP 230.A O no hydrogen 2.571 N/A ALA 277.A N THR 274.A OG1 no hydrogen 3.237 N/A GLU 278.A N THR 274.A O no hydrogen 3.111 N/A LEU 279.A N GLU 275.A O no hydrogen 3.214 N/A GLU 280.A N GLU 276.A O no hydrogen 2.974 N/A LEU 281.A N ALA 277.A O no hydrogen 2.963 N/A ALA 282.A N GLU 278.A O no hydrogen 3.135 N/A GLU 283.A N LEU 279.A O no hydrogen 2.804 N/A ASN 284.A N GLU 280.A O no hydrogen 3.023 N/A ASN 284.A ND2 LYS 253.A O no hydrogen 2.863 N/A ARG 285.A N LEU 281.A O no hydrogen 2.491 N/A ARG 285.A NH1 LEU 224.A O no hydrogen 3.264 N/A GLU 286.A N ALA 282.A O no hydrogen 2.727 N/A ILE 287.A N GLU 283.A O no hydrogen 2.991 N/A LEU 288.A N ASN 284.A O no hydrogen 3.066 N/A LYS 289.A N GLU 286.A O no hydrogen 3.266 N/A LYS 289.A NZ GLU 286.A OE1 no hydrogen 3.319 N/A ASP 298.A N GLN 321.A OE1 no hydrogen 2.630 N/A SER 300.A N ASP 298.A OD1 no hydrogen 2.858 N/A SER 300.A OG ASP 298.A OD1 no hydrogen 2.853 N/A SER 300.A OG ASP 298.A OD2 no hydrogen 3.102 N/A LYS 301.A N ASP 298.A O no hydrogen 3.080 N/A ILE 304.A N TYR 320.A O no hydrogen 2.767 N/A ALA 305.A N LYS 361.A O no hydrogen 3.065 N/A GLU 306.A N GLN 318.A O no hydrogen 3.238 N/A GLN 308.A N THR 316.A O no hydrogen 2.704 N/A GLN 308.A NE2 GLN 318.A OE1 no hydrogen 2.935 N/A LYS 309.A NZ ASP 337.A OD1 no hydrogen 2.947 N/A GLN 310.A N GLN 314.A O no hydrogen 2.815 N/A GLN 310.A NE2 THR 316.A OG1 no hydrogen 2.930 N/A GLN 310.A NE2 LYS 397.A O no hydrogen 3.274 N/A GLY 311.A N GLN 314.A O no hydrogen 3.175 N/A GLN 314.A N GLY 311.A O no hydrogen 2.799 N/A GLN 314.A NE2 GLY 311.A O no hydrogen 3.002 N/A TRP 315.A N TYR 332.A O no hydrogen 2.656 N/A TRP 315.A NE1 GLN 340.A OE1 no hydrogen 2.872 N/A THR 316.A N GLN 308.A O no hydrogen 2.980 N/A THR 316.A OG1 GLN 308.A O no hydrogen 3.522 N/A THR 316.A OG1 GLN 308.A OE1 no hydrogen 2.838 N/A TYR 317.A OH GLU 351.A OE1 no hydrogen 3.308 N/A GLN 318.A N GLU 306.A O no hydrogen 3.163 N/A GLN 318.A NE2 GLN 308.A OE1 no hydrogen 2.505 N/A ILE 319.A N LYS 328.A O no hydrogen 2.577 N/A TYR 320.A N ILE 304.A O no hydrogen 3.021 N/A TYR 320.A OH GLU 306.A OE1 no hydrogen 3.359 N/A GLN 321.A NE2 ASP 298.A O no hydrogen 2.674 N/A LYS 325.A N GLU 322.A O no hydrogen 2.681 N/A LEU 327.A N ILE 319.A O no hydrogen 2.514 N/A LYS 328.A N ILE 319.A O no hydrogen 3.031 N/A LYS 328.A NZ GLU 351.A OE1 no hydrogen 3.164 N/A THR 329.A OG1 GLN 220.A O no hydrogen 2.800 N/A GLY 330.A N TYR 317.A O no hydrogen 3.020 N/A TYR 332.A N TRP 315.A O no hydrogen 2.837 N/A TYR 332.A OH GLU 343.A OE1 no hydrogen 2.854 N/A ARG 334.A N GLY 313.A O no hydrogen 3.114 N/A ASN 336.A ND2 TYR 378.A OH no hydrogen 2.786 N/A LYS 339.A N ASN 336.A OD1 no hydrogen 2.944 N/A GLN 340.A N ASN 336.A O no hydrogen 2.984 N/A GLN 340.A NE2 THR 335.A OG1 no hydrogen 2.844 N/A LEU 341.A N ASP 337.A O no hydrogen 2.617 N/A THR 342.A N VAL 338.A O no hydrogen 2.698 N/A THR 342.A OG1 VAL 338.A O no hydrogen 3.480 N/A THR 342.A OG1 LYS 339.A O no hydrogen 2.610 N/A GLU 343.A N LYS 339.A O no hydrogen 2.998 N/A ALA 344.A N GLN 340.A O no hydrogen 2.948 N/A VAL 345.A N LEU 341.A O no hydrogen 2.906 N/A GLN 346.A N THR 342.A O no hydrogen 2.918 N/A LYS 347.A N GLU 343.A O no hydrogen 3.011 N/A ILE 348.A N ALA 344.A O no hydrogen 2.675 N/A THR 349.A N VAL 345.A O no hydrogen 2.604 N/A THR 349.A OG1 VAL 345.A O no hydrogen 2.694 N/A THR 350.A N GLN 346.A O no hydrogen 2.890 N/A THR 350.A OG1 GLN 346.A O no hydrogen 3.419 N/A GLU 351.A N LYS 347.A O no hydrogen 3.136 N/A SER 352.A N ILE 348.A O no hydrogen 3.082 N/A SER 352.A OG ILE 348.A O no hydrogen 3.397 N/A ILE 353.A N THR 349.A O no hydrogen 2.874 N/A VAL 354.A N THR 350.A O no hydrogen 2.740 N/A ILE 355.A N GLU 351.A O no hydrogen 2.689 N/A TRP 356.A N SER 352.A O no hydrogen 2.732 N/A LYS 358.A N SER 352.A O no hydrogen 3.346 N/A LYS 361.A N LEU 303.A O no hydrogen 2.659 N/A LYS 361.A NZ GLU 386.A OE2 no hydrogen 3.232 N/A PHE 362.A N GLU 386.A O no hydrogen 3.188 N/A LYS 363.A N ALA 305.A O no hydrogen 2.817 N/A LYS 363.A NZ GLU 388.A OE1 no hydrogen 2.917 N/A LEU 364.A N GLU 388.A O no hydrogen 2.882 N/A TRP 371.A N GLN 367.A O no hydrogen 3.003 N/A GLU 372.A N LYS 368.A O no hydrogen 2.685 N/A THR 373.A N GLU 369.A O no hydrogen 3.031 N/A THR 373.A OG1 GLU 369.A O no hydrogen 2.470 N/A TRP 374.A N THR 370.A O no hydrogen 3.077 N/A TRP 374.A N TRP 371.A O no hydrogen 3.141 N/A TRP 375.A N TRP 371.A O no hydrogen 2.920 N/A GLU 377.A N TRP 374.A O no hydrogen 2.490 N/A TYR 378.A N TRP 375.A O no hydrogen 3.308 N/A TRP 379.A N TRP 375.A O no hydrogen 3.054 N/A TRP 379.A NE1 TRP 383.A O no hydrogen 3.124 N/A GLN 380.A N GLN 346.A OE1 no hydrogen 2.869 N/A GLN 380.A NE2 LYS 60.A O no hydrogen 3.308 N/A ALA 381.A N GLN 346.A OE1 no hydrogen 2.936 N/A THR 382.A OG1 ASP 175.A OD2 no hydrogen 2.992 N/A GLU 388.A N PHE 362.A O no hydrogen 3.208 N/A VAL 390.A N LEU 364.A O no hydrogen 2.787 N/A LYS 397.A N PRO 393.A O no hydrogen 3.379 N/A LYS 397.A NZ GLN 310.A O no hydrogen 2.894 N/A LYS 397.A NZ GLN 310.A OE1 no hydrogen 3.419 N/A LEU 398.A N PRO 394.A O no hydrogen 3.364 N/A TRP 399.A N LEU 395.A O no hydrogen 2.887 N/A TYR 400.A N LYS 397.A O no hydrogen 3.356 N/A GLN 401.A NE2 GLN 310.A OE1 no hydrogen 2.715 N/A