Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3io1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 6.A N GLN 2.A O no hydrogen 2.826 N/A LEU 7.A N LEU 3.A O no hydrogen 2.943 N/A ARG 8.A NH2 GLU 5.A OE2 no hydrogen 2.515 N/A GLN 9.A N TYR 6.A O no hydrogen 2.719 N/A LEU 10.A N LEU 7.A O no hydrogen 2.983 N/A ALA 11.A N LEU 7.A O no hydrogen 3.036 N/A SER 13.A N LEU 10.A O no hydrogen 2.708 N/A THR 14.A OG1 ALA 11.A O no hydrogen 3.452 N/A THR 14.A OG1 PRO 12.A O no hydrogen 3.325 N/A TRP 16.A N SER 13.A O no hydrogen 2.939 N/A ARG 18.A N THR 14.A O no hydrogen 3.095 N/A ASP 19.A N GLN 15.A O no hydrogen 3.051 N/A PHE 20.A N TRP 16.A O no hydrogen 2.858 N/A HIS 21.A N ARG 18.A O no hydrogen 2.926 N/A LEU 22.A N ARG 18.A O no hydrogen 2.589 N/A HIS 23.A N ASP 19.A O no hydrogen 2.962 N/A SER 26.A OG ASP 117.A OD2 no hydrogen 2.753 N/A TRP 28.A N GLU 30.A OE2 no hydrogen 3.004 N/A LEU 29.A N SER 26.A O no hydrogen 2.997 N/A GLU 30.A N GLU 30.A OE1 no hydrogen 2.547 N/A ARG 32.A N GLU 25.A OE2 no hydrogen 2.702 N/A ARG 32.A NE GLN 78.A O no hydrogen 3.003 N/A ARG 32.A NH1 ASP 19.A OD2 no hydrogen 3.332 N/A ARG 32.A NH2 ASP 19.A OD1 no hydrogen 3.066 N/A ARG 32.A NH2 ASP 19.A OD2 no hydrogen 3.463 N/A THR 33.A N GLU 25.A OE1 no hydrogen 2.905 N/A THR 33.A OG1 GLU 25.A OE1 no hydrogen 2.438 N/A ALA 34.A N GLU 30.A O no hydrogen 3.080 N/A SER 35.A N PHE 31.A O no hydrogen 3.060 N/A SER 35.A OG PHE 31.A O no hydrogen 2.883 N/A LYS 36.A N ARG 32.A O no hydrogen 2.851 N/A VAL 37.A N THR 33.A O no hydrogen 2.887 N/A ALA 38.A N ALA 34.A O no hydrogen 2.888 N/A ASP 39.A N SER 35.A O no hydrogen 2.999 N/A ILE 40.A N LYS 36.A O no hydrogen 3.164 N/A LEU 41.A N VAL 37.A O no hydrogen 2.859 N/A ASP 42.A N ALA 38.A O no hydrogen 2.824 N/A GLY 43.A N ASP 39.A O no hydrogen 2.982 N/A LEU 44.A N ILE 40.A O no hydrogen 3.061 N/A LEU 44.A N LEU 41.A O no hydrogen 3.244 N/A GLY 45.A N ASP 42.A O no hydrogen 2.902 N/A TYR 46.A N LEU 41.A O no hydrogen 3.110 N/A TYR 46.A OH ALA 132.A O no hydrogen 2.614 N/A GLN 47.A N THR 98.A O no hydrogen 3.001 N/A GLN 47.A NE2 GLY 45.A O no hydrogen 3.247 N/A ALA 49.A N VAL 96.A O no hydrogen 3.203 N/A GLY 51.A N GLY 94.A O no hydrogen 3.384 N/A ASP 53.A N LEU 50.A O no hydrogen 2.961 N/A VAL 54.A N GLY 51.A O no hydrogen 2.955 N/A ILE 55.A N GLY 51.A O no hydrogen 2.834 N/A ASP 56.A N ALA 162.A O no hydrogen 2.738 N/A SER 59.A N ASP 56.A OD2 no hydrogen 3.028 N/A SER 59.A OG ASP 56.A OD2 no hydrogen 2.714 N/A ARG 60.A N ALA 57.A O no hydrogen 3.368 N/A ARG 60.A NE ALA 57.A O no hydrogen 3.140 N/A ARG 60.A NH1 GLY 90.A O no hydrogen 2.885 N/A ARG 60.A NH1 GLY 91.A O no hydrogen 2.670 N/A THR 67.A N ASP 64.A OD1 no hydrogen 2.652 N/A THR 67.A OG1 ASP 64.A OD1 no hydrogen 3.099 N/A THR 67.A OG1 ASP 64.A OD2 no hydrogen 3.395 N/A LEU 68.A N ASP 64.A O no hydrogen 3.125 N/A ALA 69.A N GLU 66.A O no hydrogen 2.960 N/A ARG 70.A N GLU 66.A O no hydrogen 3.315 N/A ARG 70.A NH2 GLU 66.A OE1 no hydrogen 2.839 N/A ALA 71.A N THR 67.A O no hydrogen 3.227 N/A PHE 72.A N LEU 68.A O no hydrogen 3.201 N/A GLU 73.A N ALA 69.A O no hydrogen 2.991 N/A ARG 74.A N ARG 70.A O no hydrogen 2.732 N/A ALA 75.A N ALA 71.A O no hydrogen 3.069 N/A ALA 75.A N PHE 72.A O no hydrogen 3.135 N/A ARG 76.A N PHE 72.A O no hydrogen 3.167 N/A GLU 77.A N GLU 73.A O no hydrogen 2.871 N/A GLN 78.A N ALA 75.A O no hydrogen 2.820 N/A ALA 80.A N ALA 75.A O no hydrogen 3.164 N/A ARG 83.A NH2 ASP 42.A OD2 no hydrogen 3.316 N/A LEU 85.A N PRO 81.A O no hydrogen 3.156 N/A ALA 87.A N TRP 84.A O no hydrogen 2.697 N/A PHE 88.A N LEU 85.A O no hydrogen 2.946 N/A GLU 89.A N PRO 86.A O no hydrogen 3.383 N/A PHE 92.A N PHE 88.A O no hydrogen 3.012 N/A VAL 95.A N PHE 150.A O no hydrogen 3.346 N/A VAL 96.A N ALA 49.A O no hydrogen 3.232 N/A ALA 97.A N LEU 148.A O no hydrogen 2.873 N/A THR 98.A N GLN 47.A O no hydrogen 3.003 N/A LEU 99.A N ILE 146.A O no hydrogen 2.923 N/A THR 101.A N GLY 144.A O no hydrogen 3.250 N/A THR 101.A OG1 ARG 103.A O no hydrogen 3.268 N/A THR 101.A OG1 GLY 144.A O no hydrogen 2.868 N/A GLY 102.A N ASP 100.A OD1 no hydrogen 2.832 N/A ARG 103.A NE LEU 142.A O no hydrogen 3.201 N/A THR 107.A N ASP 172.A OD2 no hydrogen 2.761 N/A THR 107.A OG1 ASP 170.A O no hydrogen 3.469 N/A THR 107.A OG1 ASP 172.A OD2 no hydrogen 3.539 N/A LEU 108.A N VAL 145.A O no hydrogen 2.701 N/A ALA 109.A N TYR 173.A O no hydrogen 2.844 N/A PHE 110.A N LYS 147.A O no hydrogen 2.971 N/A ARG 111.A N THR 175.A O no hydrogen 3.025 N/A ARG 111.A NE GLN 151.A OE1 no hydrogen 3.008 N/A ARG 111.A NH2 GLN 151.A OE1 no hydrogen 2.782 N/A ARG 111.A NH2 GLU 340.A OE2 no hydrogen 2.819 N/A VAL 112.A N ILE 149.A O no hydrogen 2.862 N/A ALA 115.A N GLU 25.A O no hydrogen 2.656 N/A CYS 119.A SG HIS 21.A ND1 no hydrogen 3.123 N/A CYS 119.A SG HIS 21.A O no hydrogen 3.631 N/A HIS 124.A ND1 ASP 113.A OD1 no hydrogen 3.352 N/A THR 125.A OG1 ASP 113.A O no hydrogen 3.209 N/A GLY 128.A N HIS 124.A O no hydrogen 3.197 N/A LEU 129.A N THR 125.A O no hydrogen 3.154 N/A GLY 130.A N ALA 126.A O no hydrogen 2.774 N/A LEU 131.A N ILE 127.A O no hydrogen 2.968 N/A ALA 132.A N GLY 128.A O no hydrogen 3.134 N/A HIS 133.A N LEU 129.A O no hydrogen 3.107 N/A VAL 134.A N GLY 130.A O no hydrogen 3.286 N/A LEU 135.A N LEU 131.A O no hydrogen 3.016 N/A LYS 136.A N ALA 132.A O no hydrogen 3.214 N/A LYS 136.A N HIS 133.A O no hydrogen 2.827 N/A GLN 137.A N HIS 133.A O no hydrogen 3.257 N/A TYR 138.A N VAL 134.A O no hydrogen 3.317 N/A TYR 138.A OH LEU 1.A O no hydrogen 3.160 N/A ALA 139.A N LYS 136.A O no hydrogen 2.713 N/A GLN 141.A N TYR 138.A O no hydrogen 3.045 N/A LEU 142.A N ALA 139.A O no hydrogen 2.849 N/A GLY 144.A N ARG 103.A O no hydrogen 2.796 N/A VAL 145.A N PRO 106.A O no hydrogen 2.928 N/A ILE 146.A N LEU 99.A O no hydrogen 2.991 N/A LYS 147.A N LEU 108.A O no hydrogen 2.757 N/A LYS 147.A NZ VAL 167.A O no hydrogen 2.780 N/A LYS 147.A NZ ASP 170.A OD1 no hydrogen 2.974 N/A LEU 148.A N ALA 97.A O no hydrogen 2.788 N/A ILE 149.A N PHE 110.A O no hydrogen 2.787 N/A PHE 150.A N VAL 95.A O no hydrogen 2.849 N/A GLN 151.A N VAL 112.A O no hydrogen 2.719 N/A GLN 151.A NE2 PRO 152.A O no hydrogen 3.067 N/A GLN 151.A NE2 ASP 341.A OD1 no hydrogen 3.024 N/A GLN 151.A NE2 ASP 341.A OD2 no hydrogen 2.865 N/A ALA 153.A N GLU 30.A OE2 no hydrogen 2.630 N/A GLU 154.A N ASP 114.A OD2 no hydrogen 2.962 N/A GLU 155.A N ASP 114.A OD1 no hydrogen 3.138 N/A THR 157.A N GLU 154.A O no hydrogen 2.803 N/A THR 157.A OG1 GLY 156.A O no hydrogen 2.643 N/A ARG 158.A N ALA 153.A O no hydrogen 3.091 N/A GLY 159.A N ALA 153.A O no hydrogen 2.887 N/A ALA 160.A N ASP 341.A OD2 no hydrogen 3.214 N/A ALA 164.A N ARG 161.A O no hydrogen 2.866 N/A GLY 166.A N VAL 163.A O no hydrogen 2.772 N/A ASP 169.A N GLY 166.A O no hydrogen 3.123 N/A VAL 171.A N VAL 168.A O no hydrogen 3.476 N/A ASP 172.A N THR 107.A O no hydrogen 2.988 N/A TYR 173.A N THR 107.A O no hydrogen 3.273 N/A PHE 174.A N LEU 353.A O no hydrogen 2.858 N/A THR 175.A N ALA 109.A O no hydrogen 2.913 N/A ALA 176.A N SER 355.A O no hydrogen 3.034 N/A ILE 177.A N ARG 111.A O no hydrogen 3.476 N/A ILE 179.A N HIS 124.A NE2 no hydrogen 3.133 N/A VAL 183.A N GLY 180.A O no hydrogen 3.201 N/A ALA 185.A N GLU 361.A O no hydrogen 3.217 N/A THR 187.A N PRO 184.A O no hydrogen 2.929 N/A VAL 189.A N ILE 357.A O no hydrogen 2.777 N/A GLY 192.A N TYR 356.A O no hydrogen 3.064 N/A ASN 194.A ND2 ILE 333.A O no hydrogen 3.606 N/A ALA 196.A N GLY 270.A O no hydrogen 2.884 N/A THR 197.A N ALA 303.A O no hydrogen 2.935 N/A THR 197.A OG1 THR 268.A O no hydrogen 2.587 N/A THR 198.A N THR 268.A O no hydrogen 3.110 N/A THR 198.A OG1 ASN 276.A OD1 no hydrogen 2.794 N/A LYS 199.A N GLY 301.A O no hydrogen 2.769 N/A LYS 199.A NZ THR 197.A OG1 no hydrogen 3.036 N/A LYS 199.A NZ GLU 267.A OE1 no hydrogen 3.224 N/A PHE 200.A N VAL 266.A O no hydrogen 3.071 N/A ASP 201.A N ARG 300.A O no hydrogen 2.958 N/A VAL 202.A N LEU 264.A O no hydrogen 2.791 N/A GLN 203.A N GLU 298.A O no hydrogen 2.905 N/A PHE 204.A N ALA 262.A O no hydrogen 2.767 N/A SER 205.A N ARG 296.A O no hydrogen 2.924 N/A GLY 206.A N SER 260.A O no hydrogen 2.629 N/A ALA 209.A N ASP 217.A O no hydrogen 2.916 N/A GLU 216.A N GLU 216.A OE1 no hydrogen 3.119 N/A ASP 217.A N LYS 214.A O no hydrogen 2.664 N/A GLY 218.A N PRO 215.A O no hydrogen 3.164 N/A ARG 219.A NH1 GLU 216.A O no hydrogen 3.181 N/A ARG 219.A NH1 GLY 218.A O no hydrogen 2.640 N/A ALA 221.A N PRO 259.A O no hydrogen 3.326 N/A LEU 223.A N ASN 220.A OD1 no hydrogen 2.920 N/A ALA 224.A N ASN 220.A O no hydrogen 3.171 N/A ALA 225.A N ALA 221.A O no hydrogen 2.976 N/A ALA 226.A N LEU 222.A O no hydrogen 2.799 N/A GLN 227.A N LEU 223.A O no hydrogen 2.883 N/A ALA 228.A N ALA 224.A O no hydrogen 2.921 N/A ALA 229.A N ALA 225.A O no hydrogen 2.656 N/A LEU 230.A N ALA 226.A O no hydrogen 3.157 N/A GLY 231.A N GLN 227.A O no hydrogen 2.963 N/A LEU 232.A N ALA 228.A O no hydrogen 2.738 N/A HIS 233.A N ALA 229.A O no hydrogen 3.172 N/A ALA 234.A N GLY 231.A O no hydrogen 2.886 N/A ILE 235.A N LEU 232.A O no hydrogen 3.183 N/A GLY 241.A N HIS 238.A O no hydrogen 3.461 N/A ALA 242.A N GLU 271.A OE1 no hydrogen 3.197 N/A ARG 244.A N ARG 269.A O no hydrogen 2.590 N/A ARG 244.A NH1 SER 243.A O no hydrogen 3.234 N/A ASN 246.A N GLU 267.A O no hydrogen 2.967 N/A VAL 247.A N HIS 233.A NE2 no hydrogen 3.182 N/A VAL 249.A N LYS 265.A O no hydrogen 3.484 N/A GLY 252.A N SER 261.A O no hydrogen 3.328 N/A VAL 257.A N GLY 254.A O no hydrogen 2.858 N/A ALA 262.A N PHE 204.A O no hydrogen 2.950 N/A LEU 263.A N GLN 250.A O no hydrogen 2.710 N/A LEU 264.A N VAL 202.A O no hydrogen 2.847 N/A LYS 265.A N VAL 249.A O no hydrogen 2.944 N/A VAL 266.A N PHE 200.A O no hydrogen 2.820 N/A GLU 267.A N ASN 246.A O no hydrogen 3.048 N/A THR 268.A N THR 198.A O no hydrogen 2.873 N/A THR 268.A OG1 THR 198.A O no hydrogen 3.506 N/A ARG 269.A N ARG 244.A O no hydrogen 2.799 N/A ARG 269.A NE GLU 267.A OE2 no hydrogen 3.013 N/A ARG 269.A NH2 GLU 267.A OE2 no hydrogen 2.954 N/A GLY 270.A N ALA 196.A O no hydrogen 3.113 N/A GLU 271.A N ALA 242.A O no hydrogen 2.834 N/A ILE 275.A N SER 272.A OG no hydrogen 3.248 N/A ASN 276.A N SER 272.A O no hydrogen 3.095 N/A ASN 276.A ND2 THR 268.A OG1 no hydrogen 2.756 N/A GLN 277.A N GLU 273.A O no hydrogen 2.916 N/A TYR 278.A N ALA 274.A O no hydrogen 2.842 N/A TYR 278.A OH PRO 236.A O no hydrogen 2.677 N/A VAL 279.A N ILE 275.A O no hydrogen 2.983 N/A PHE 280.A N ASN 276.A O no hydrogen 2.978 N/A GLU 281.A N GLN 277.A O no hydrogen 2.967 N/A ARG 282.A N TYR 278.A O no hydrogen 3.213 N/A ALA 283.A N VAL 279.A O no hydrogen 3.035 N/A GLN 284.A N PHE 280.A O no hydrogen 3.191 N/A GLN 284.A NE2 PHE 280.A O no hydrogen 3.529 N/A HIS 285.A N GLU 281.A O no hydrogen 3.400 N/A VAL 286.A N ARG 282.A O no hydrogen 2.897 N/A VAL 287.A N ALA 283.A O no hydrogen 2.977 N/A ALA 288.A N GLN 284.A O no hydrogen 3.126 N/A GLY 289.A N HIS 285.A O no hydrogen 3.105 N/A ALA 290.A N VAL 286.A O no hydrogen 3.057 N/A ALA 291.A N VAL 287.A O no hydrogen 3.066 N/A ALA 292.A N ALA 288.A O no hydrogen 3.028 N/A TYR 293.A OH GLN 227.A OE1 no hydrogen 2.825 N/A GLU 294.A N ALA 292.A O no hydrogen 2.644 N/A ALA 295.A N ALA 291.A O no hydrogen 2.749 N/A ARG 296.A N SER 205.A O no hydrogen 2.750 N/A GLU 298.A N GLN 203.A O no hydrogen 2.805 N/A ARG 300.A N ASP 201.A O no hydrogen 2.991 N/A ALA 302.A N THR 157.A O no hydrogen 2.948 N/A ALA 303.A N THR 197.A O no hydrogen 3.187 N/A THR 304.A N THR 343.A OG1 no hydrogen 3.081 N/A THR 304.A OG1 GLU 273.A OE2 no hydrogen 3.225 N/A ALA 305.A N THR 304.A OG1 no hydrogen 2.658 N/A SER 306.A OG GLY 192.A O no hydrogen 2.862 N/A SER 309.A N ALA 354.A O no hydrogen 2.871 N/A SER 309.A OG GLN 348.A OE1 no hydrogen 3.283 N/A SER 309.A OG ALA 354.A O no hydrogen 3.386 N/A TRP 312.A NE1 THR 175.A OG1 no hydrogen 2.873 N/A VAL 313.A N SER 309.A O no hydrogen 2.893 N/A ASP 314.A N PRO 310.A O no hydrogen 2.951 N/A TYR 315.A N ALA 311.A O no hydrogen 3.061 N/A TYR 315.A OH VAL 376.A O no hydrogen 2.569 N/A LEU 316.A N TRP 312.A O no hydrogen 2.952 N/A ARG 317.A N VAL 313.A O no hydrogen 2.820 N/A ARG 317.A NH1 ASP 314.A OD1 no hydrogen 2.760 N/A ARG 317.A NH1 ASP 331.A OD1 no hydrogen 2.834 N/A ARG 317.A NH2 ASP 314.A OD1 no hydrogen 3.252 N/A GLU 318.A N ASP 314.A O no hydrogen 2.852 N/A GLN 319.A N TYR 315.A O no hydrogen 3.101 N/A ALA 320.A N LEU 316.A O no hydrogen 2.984 N/A ALA 321.A N ARG 317.A O no hydrogen 3.111 N/A ARG 322.A N GLN 319.A O no hydrogen 3.386 N/A VAL 323.A N ALA 320.A O no hydrogen 3.262 N/A VAL 326.A N VAL 323.A O no hydrogen 3.052 N/A GLN 327.A N GLY 186.A O no hydrogen 2.880 N/A ASP 331.A N ALA 329.A O no hydrogen 2.365 N/A GLY 338.A N ASN 194.A O no hydrogen 3.026 N/A ALA 342.A N GLU 340.A OE2 no hydrogen 3.209 N/A THR 343.A N GLU 340.A O no hydrogen 3.144 N/A THR 343.A OG1 THR 304.A O no hydrogen 3.109 N/A THR 343.A OG1 GLU 340.A O no hydrogen 2.901 N/A LEU 344.A N ASP 341.A O no hydrogen 2.779 N/A ARG 346.A N LEU 344.A O no hydrogen 3.114 N/A ARG 346.A NE ASP 169.A OD1 no hydrogen 2.683 N/A ARG 346.A NH2 ASP 169.A OD1 no hydrogen 3.315 N/A ALA 349.A N ALA 345.A O no hydrogen 2.939 N/A ARG 350.A N ARG 346.A O no hydrogen 3.144 N/A ARG 350.A N VAL 347.A O no hydrogen 3.314 N/A ARG 350.A NE ASP 169.A O no hydrogen 3.435 N/A ARG 350.A NH2 ASP 169.A O no hydrogen 2.994 N/A GLY 351.A N GLN 348.A O no hydrogen 3.360 N/A LEU 353.A N ASP 172.A O no hydrogen 2.781 N/A ALA 354.A N SER 309.A OG no hydrogen 2.850 N/A SER 355.A N PHE 174.A O no hydrogen 2.921 N/A SER 355.A OG CYS 190.A O no hydrogen 2.480 N/A TYR 356.A OH HIS 178.A ND1 no hydrogen 3.330 N/A TYR 356.A OH GLU 340.A OE1 no hydrogen 2.624 N/A PHE 358.A N HIS 178.A O no hydrogen 2.823 N/A GLY 359.A N THR 187.A O no hydrogen 2.717 N/A THR 360.A N VAL 183.A O no hydrogen 2.983 N/A GLU 361.A N VAL 183.A O no hydrogen 2.978 N/A ALA 369.A N VAL 366.A O no hydrogen 3.077 N/A GLU 371.A N ALA 367.A O no hydrogen 3.023 N/A THR 372.A N VAL 368.A O no hydrogen 3.021 N/A THR 372.A OG1 VAL 368.A O no hydrogen 2.553 N/A LEU 373.A N ALA 369.A O no hydrogen 2.928 N/A ALA 374.A N VAL 370.A O no hydrogen 2.718 N/A ARG 375.A N GLU 371.A O no hydrogen 2.816 N/A ARG 375.A NH2 GLU 371.A OE2 no hydrogen 3.085 N/A VAL 376.A N THR 372.A O no hydrogen 3.016 N/A ALA 377.A N LEU 373.A O no hydrogen 3.286 N/A ALA 377.A N ALA 374.A O no hydrogen 3.171 N/A LEU 378.A N ALA 374.A O no hydrogen 3.074 N/A ASN 379.A N ARG 375.A O no hydrogen 2.949 N/A PHE 380.A N ALA 377.A O no hydrogen 2.984 N/A TRP 382.A N PHE 380.A O no hydrogen 2.785 N/A