Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4x9i_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 1.A N ASN 31.A O no hydrogen 3.065 N/A LYS 2.A N ASN 31.A O no hydrogen 3.111 N/A GLY 3.A N GLU 387.A OE1 no hydrogen 3.160 N/A VAL 5.A N SER 29.A O no hydrogen 3.301 N/A LEU 7.A N LYS 27.A O no hydrogen 2.861 N/A LYS 8.A N LYS 27.A O no hydrogen 3.110 N/A THR 11.A OG1 ARG 13.A O no hydrogen 3.061 N/A ASN 12.A ND2 SER 381.A O no hydrogen 2.997 N/A ILE 14.A N HIS 97.A O no hydrogen 2.759 N/A PHE 16.A N ARG 99.A O no hydrogen 3.274 N/A SER 17.A OG THR 20.A OG1 no hydrogen 3.031 N/A ASN 18.A N VAL 101.A O no hydrogen 3.004 N/A ASN 18.A ND2 PHE 66.A O no hydrogen 2.934 N/A THR 20.A N SER 17.A OG no hydrogen 2.999 N/A THR 20.A OG1 SER 17.A O no hydrogen 3.139 N/A THR 20.A OG1 SER 17.A OG no hydrogen 3.031 N/A THR 20.A OG1 GLY 21.A O no hydrogen 3.314 N/A GLY 21.A N SER 17.A O no hydrogen 3.066 N/A ALA 22.A N PHE 63.A O no hydrogen 2.944 N/A ILE 24.A N LEU 61.A O no hydrogen 2.775 N/A CYS 26.A SG LYS 8.A O no hydrogen 4.018 N/A LYS 27.A N LYS 8.A O no hydrogen 3.228 N/A SER 29.A N VAL 5.A O no hydrogen 2.961 N/A ASN 31.A N LYS 2.A O no hydrogen 3.290 N/A GLU 35.A N ARG 85.A O no hydrogen 3.088 N/A ILE 37.A N LEU 83.A O no hydrogen 2.737 N/A TRP 38.A NE1 GLY 59.A O no hydrogen 2.873 N/A ILE 39.A N ALA 81.A O no hydrogen 2.953 N/A ARG 40.A N THR 44.A O no hydrogen 2.930 N/A SER 41.A N VAL 79.A O no hydrogen 3.241 N/A GLY 43.A N ARG 40.A O no hydrogen 3.194 N/A THR 44.A N ASP 42.A OD1 no hydrogen 3.403 N/A THR 44.A OG1 ASP 42.A OD1 no hydrogen 2.854 N/A VAL 46.A N TRP 38.A O no hydrogen 3.320 N/A VAL 49.A N ARG 53.A O no hydrogen 2.691 N/A LEU 52.A N VAL 49.A O no hydrogen 2.905 N/A ARG 53.A N VAL 49.A O no hydrogen 2.874 N/A ARG 53.A NE GLY 47.A O no hydrogen 3.206 N/A ARG 53.A NH1 TYR 80.A OH no hydrogen 2.657 N/A GLN 54.A N VAL 62.A O no hydrogen 2.923 N/A ILE 55.A N ASP 48.A OD1 no hydrogen 2.846 N/A SER 56.A N LYS 60.A O no hydrogen 2.784 N/A SER 56.A OG LYS 60.A O no hydrogen 3.519 N/A ASP 58.A N SER 56.A OG no hydrogen 3.211 N/A GLY 59.A N SER 56.A O no hydrogen 3.366 N/A LYS 60.A N SER 56.A OG no hydrogen 2.945 N/A LEU 61.A N ILE 24.A O no hydrogen 2.954 N/A VAL 62.A N GLN 54.A O no hydrogen 2.745 N/A PHE 63.A N ALA 22.A O no hydrogen 2.814 N/A PHE 66.A N ASN 18.A O no hydrogen 2.966 N/A ASP 70.A N ARG 67.A O no hydrogen 2.923 N/A TYR 71.A N ALA 68.A O no hydrogen 3.301 N/A ARG 72.A N HIS 76.A ND1 no hydrogen 3.159 N/A ARG 72.A NE GLU 74.A OE1 no hydrogen 3.231 N/A ARG 72.A NH2 GLU 74.A OE2 no hydrogen 2.461 N/A VAL 75.A N ARG 72.A O no hydrogen 3.353 N/A HIS 76.A N ARG 72.A O no hydrogen 2.875 N/A HIS 76.A ND1 ARG 72.A O no hydrogen 3.106 N/A ALA 77.A N GLN 73.A O no hydrogen 3.124 N/A GLN 78.A NE2 VAL 79.A O no hydrogen 3.318 N/A TYR 80.A N VAL 96.A O no hydrogen 2.618 N/A TYR 80.A OH VAL 75.A O no hydrogen 2.622 N/A ALA 81.A N ILE 39.A O no hydrogen 2.745 N/A CYS 82.A N SER 93.A OG no hydrogen 2.599 N/A LEU 83.A N ILE 37.A O no hydrogen 2.770 N/A ALA 84.A N ILE 91.A O no hydrogen 2.960 N/A ARG 85.A N GLU 35.A O no hydrogen 3.143 N/A ARG 85.A NE GLU 35.A OE2 no hydrogen 3.167 N/A ARG 85.A NH2 GLU 35.A OE2 no hydrogen 3.139 N/A ASN 86.A N GLY 89.A O no hydrogen 2.536 N/A ASN 86.A ND2 PRO 32.A O no hydrogen 3.010 N/A GLY 89.A N ASN 86.A O no hydrogen 3.048 N/A SER 90.A N ASP 347.A OD1 no hydrogen 3.220 N/A ILE 91.A N ALA 84.A O no hydrogen 2.913 N/A ILE 92.A N GLN 372.A OE1 no hydrogen 2.869 N/A SER 93.A N CYS 82.A O no hydrogen 2.798 N/A SER 93.A OG CYS 82.A O no hydrogen 3.472 N/A SER 93.A OG ARG 94.A O no hydrogen 3.330 N/A ARG 94.A N GLU 9.A OE1 no hydrogen 2.674 N/A ARG 94.A NE PRO 10.A O no hydrogen 2.820 N/A ARG 94.A NH2 GLU 9.A O no hydrogen 3.189 N/A ARG 94.A NH2 PRO 10.A O no hydrogen 3.239 N/A ASP 95.A N SER 381.A OG no hydrogen 3.122 N/A VAL 96.A N TYR 80.A O no hydrogen 2.738 N/A HIS 97.A N ASN 12.A O no hydrogen 2.609 N/A VAL 98.A N GLN 78.A O no hydrogen 3.261 N/A ARG 99.A N ILE 14.A O no hydrogen 2.913 N/A ALA 100.A N HIS 76.A O no hydrogen 3.386 N/A VAL 101.A N PHE 16.A O no hydrogen 2.851 N/A ILE 103.A N ASN 18.A OD1 no hydrogen 3.453 N/A TYR 106.A OH THR 186.A OG1 no hydrogen 3.008 N/A GLU 109.A N GLU 126.A O no hydrogen 3.195 N/A ALA 110.A N THR 199.A O no hydrogen 3.371 N/A VAL 115.A N VAL 204.A O no hydrogen 2.767 N/A ILE 116.A N GLN 240.A OE1 no hydrogen 3.336 N/A ARG 117.A N THR 206.A O no hydrogen 3.221 N/A GLY 118.A N VAL 173.A O no hydrogen 3.072 N/A ASN 119.A N ILE 116.A O no hydrogen 3.215 N/A ASN 119.A ND2 ILE 116.A O no hydrogen 3.428 N/A ASN 119.A ND2 ALA 241.A O no hydrogen 2.735 N/A SER 120.A OG SER 272.A OG no hydrogen 2.980 N/A VAL 121.A N ILE 170.A O no hydrogen 2.876 N/A MET 123.A N LEU 168.A O no hydrogen 2.784 N/A LYS 124.A NZ GLU 113.A OE2 no hydrogen 2.221 N/A GLU 126.A N GLU 109.A O no hydrogen 3.049 N/A TYR 130.A OH SER 105.A O no hydrogen 2.897 N/A VAL 131.A N PRO 128.A O no hydrogen 3.174 N/A ALA 132.A N SER 129.A O no hydrogen 3.235 N/A PHE 134.A N VAL 131.A O no hydrogen 2.926 N/A PHE 136.A N LYS 187.A O no hydrogen 3.061 N/A ASP 138.A N ARG 185.A O no hydrogen 2.711 N/A LEU 139.A N ARG 185.A O no hydrogen 3.476 N/A TRP 140.A N TYR 148.A O no hydrogen 2.930 N/A TRP 140.A NE1 GLY 166.A O no hydrogen 2.918 N/A LEU 141.A N GLN 183.A O no hydrogen 2.577 N/A ASP 142.A N ARG 146.A O no hydrogen 3.343 N/A SER 143.A N SER 181.A O no hydrogen 3.024 N/A SER 143.A OG GLU 144.A OE1 no hydrogen 2.784 N/A GLY 145.A N ASP 142.A O no hydrogen 2.847 N/A ARG 146.A N ASP 142.A OD1 no hydrogen 2.401 N/A ASN 147.A ND2 TYR 149.A OH no hydrogen 2.845 N/A TYR 148.A N TRP 140.A O no hydrogen 2.962 N/A ASP 157.A N GLU 155.A OE1 no hydrogen 3.090 N/A LYS 159.A NZ ARG 171.A O no hydrogen 2.651 N/A LYS 159.A NZ GLU 172.A O no hydrogen 3.104 N/A LYS 159.A NZ ASP 177.A OD2 no hydrogen 3.108 N/A TYR 160.A OH TYR 182.A OH no hydrogen 3.234 N/A LEU 161.A N HIS 169.A O no hydrogen 2.893 N/A LEU 163.A N GLU 167.A O no hydrogen 2.786 N/A SER 165.A OG GLU 167.A OE1 no hydrogen 2.357 N/A GLY 166.A N LEU 163.A O no hydrogen 2.865 N/A GLU 167.A N GLU 167.A OE1 no hydrogen 2.723 N/A LEU 168.A N MET 123.A O no hydrogen 3.063 N/A HIS 169.A N LEU 161.A O no hydrogen 2.725 N/A ILE 170.A N VAL 121.A O no hydrogen 2.849 N/A ARG 171.A N LYS 159.A O no hydrogen 3.097 N/A ARG 171.A NH2 THR 156.A O no hydrogen 3.421 N/A GLU 172.A N SER 120.A OG no hydrogen 3.391 N/A VAL 173.A N ASN 119.A O no hydrogen 3.406 N/A GLY 174.A N ASP 177.A OD2 no hydrogen 3.194 N/A GLU 176.A N GLU 176.A OE2 no hydrogen 2.638 N/A ASP 177.A N GLY 174.A O no hydrogen 3.181 N/A GLY 178.A N PRO 175.A O no hydrogen 3.198 N/A LYS 180.A NZ TYR 160.A OH no hydrogen 3.351 N/A TYR 182.A N GLY 201.A O no hydrogen 2.465 N/A TYR 182.A OH TYR 160.A OH no hydrogen 3.234 N/A GLN 183.A N LEU 141.A O no hydrogen 2.556 N/A GLN 183.A NE2 SER 197.A O no hydrogen 2.905 N/A CYS 184.A N SER 197.A OG no hydrogen 3.208 N/A ARG 185.A N LEU 139.A O no hydrogen 2.786 N/A ARG 185.A NH1 ASP 138.A OD2 no hydrogen 3.326 N/A THR 186.A N ARG 195.A O no hydrogen 2.813 N/A THR 186.A OG1 TYR 106.A OH no hydrogen 3.008 N/A THR 186.A OG1 ARG 195.A O no hydrogen 2.974 N/A LYS 187.A N PHE 136.A O no hydrogen 2.751 N/A HIS 188.A N GLU 193.A O no hydrogen 3.280 N/A ARG 189.A N PHE 134.A O no hydrogen 2.749 N/A LEU 190.A N HIS 188.A ND1 no hydrogen 3.325 N/A THR 191.A N HIS 188.A ND1 no hydrogen 3.300 N/A GLY 192.A N HIS 188.A O no hydrogen 2.759 N/A GLU 193.A N THR 191.A OG1 no hydrogen 3.197 N/A ARG 195.A N THR 186.A O no hydrogen 3.003 N/A SER 197.A N CYS 184.A O no hydrogen 2.949 N/A SER 197.A OG CYS 184.A O no hydrogen 3.393 N/A SER 197.A OG THR 199.A O no hydrogen 3.429 N/A ALA 198.A N SER 108.A O no hydrogen 2.879 N/A THR 199.A OG1 ALA 110.A O no hydrogen 3.561 N/A LYS 200.A NZ GLN 183.A OE1 no hydrogen 2.933 N/A GLY 201.A N TYR 182.A O no hydrogen 2.806 N/A ARG 202.A N ASN 112.A OD1 no hydrogen 2.990 N/A VAL 204.A N GLU 113.A O no hydrogen 3.007 N/A THR 206.A N VAL 115.A O no hydrogen 2.770 N/A THR 206.A OG1 VAL 115.A O no hydrogen 3.136 N/A LYS 212.A N PHE 242.A O no hydrogen 2.799 N/A THR 215.A N GLN 240.A O no hydrogen 3.290 N/A THR 215.A OG1 PHE 216.A O no hydrogen 3.501 N/A SER 220.A OG ILE 222.A O no hydrogen 2.922 N/A SER 223.A N GLU 302.A O no hydrogen 3.192 N/A LEU 225.A N VAL 304.A O no hydrogen 3.143 N/A GLY 227.A N THR 306.A O no hydrogen 2.950 N/A SER 229.A N THR 308.A O no hydrogen 2.747 N/A SER 229.A OG THR 308.A O no hydrogen 3.346 N/A SER 230.A N ALA 280.A O no hydrogen 2.535 N/A SER 230.A OG SER 229.A O no hydrogen 2.184 N/A SER 231.A N SER 228.A O no hydrogen 3.314 N/A SER 231.A OG SER 228.A O no hydrogen 2.572 N/A ILE 233.A N ILE 277.A O no hydrogen 2.654 N/A LEU 235.A N LEU 275.A O no hydrogen 2.683 N/A GLN 240.A N THR 215.A O no hydrogen 3.263 N/A GLN 240.A NE2 TYR 114.A O no hydrogen 3.096 N/A ALA 241.A N ASN 119.A OD1 no hydrogen 3.475 N/A TYR 246.A N ASN 293.A O no hydrogen 3.061 N/A ARG 248.A N VAL 291.A O no hydrogen 3.009 N/A TRP 249.A NE1 GLY 273.A O no hydrogen 3.026 N/A TYR 250.A N LEU 289.A O no hydrogen 2.852 N/A LYS 251.A N GLN 260.A O no hydrogen 2.660 N/A LYS 251.A NZ GLU 283.A O no hydrogen 3.208 N/A LYS 251.A NZ SER 285.A O no hydrogen 3.261 N/A LYS 251.A NZ TYR 288.A OH no hydrogen 3.221 N/A PHE 252.A N LYS 287.A O no hydrogen 2.962 N/A ILE 253.A N ARG 258.A O no hydrogen 2.823 N/A THR 256.A N ILE 253.A O no hydrogen 2.950 N/A THR 256.A OG1 GLU 254.A O no hydrogen 2.934 N/A GLN 260.A N LYS 251.A O no hydrogen 2.786 N/A VAL 262.A N TRP 249.A O no hydrogen 3.005 N/A ASN 265.A N VAL 268.A O no hydrogen 2.734 N/A ARG 267.A N ASN 265.A OD1 no hydrogen 2.971 N/A ARG 267.A NH1 LYS 278.A O no hydrogen 2.684 N/A ARG 267.A NH1 ASP 284.A OD2 no hydrogen 3.417 N/A ARG 267.A NH2 ASP 284.A OD1 no hydrogen 2.877 N/A ARG 267.A NH2 ASP 284.A OD2 no hydrogen 2.879 N/A VAL 268.A N ASN 265.A OD1 no hydrogen 2.520 N/A LYS 269.A N ILE 276.A O no hydrogen 2.857 N/A LYS 269.A NZ ASP 266.A O no hydrogen 3.461 N/A GLN 270.A NE2 THR 247.A O no hydrogen 2.985 N/A GLN 270.A NE2 SER 272.A O no hydrogen 2.714 N/A VAL 271.A N THR 274.A O no hydrogen 2.779 N/A SER 272.A OG SER 120.A OG no hydrogen 2.980 N/A THR 274.A N VAL 271.A O no hydrogen 2.811 N/A LEU 275.A N LEU 235.A O no hydrogen 2.862 N/A ILE 276.A N LYS 269.A O no hydrogen 2.750 N/A ILE 277.A N ILE 233.A O no hydrogen 2.666 N/A LYS 278.A N ARG 267.A O no hydrogen 3.351 N/A LYS 278.A NZ ALA 153.A O no hydrogen 2.905 N/A ASP 279.A N ASP 232.A OD1 no hydrogen 3.208 N/A ALA 280.A N SER 231.A O no hydrogen 3.254 N/A VAL 281.A N ASP 284.A OD2 no hydrogen 3.074 N/A ASP 284.A N VAL 281.A O no hydrogen 2.885 N/A SER 285.A N VAL 282.A O no hydrogen 2.981 N/A SER 285.A OG VAL 282.A O no hydrogen 2.838 N/A GLY 286.A N LEU 305.A O no hydrogen 2.967 N/A TYR 288.A N THR 303.A O no hydrogen 2.665 N/A TYR 288.A OH ASP 284.A O no hydrogen 2.712 N/A LEU 289.A N TYR 250.A O no hydrogen 2.820 N/A CYS 290.A N VAL 301.A O no hydrogen 2.837 N/A VAL 291.A N ARG 248.A O no hydrogen 2.952 N/A VAL 292.A N GLU 299.A O no hydrogen 2.956 N/A ASN 293.A N TYR 246.A O no hydrogen 3.197 N/A ASN 294.A N GLY 297.A O no hydrogen 2.784 N/A ASN 294.A ND2 LYS 212.A O no hydrogen 2.954 N/A ASN 294.A ND2 PRO 243.A O no hydrogen 3.524 N/A GLY 297.A N ASN 294.A O no hydrogen 3.300 N/A GLY 297.A N ASN 294.A OD1 no hydrogen 2.793 N/A GLU 299.A N VAL 292.A O no hydrogen 2.926 N/A VAL 301.A N CYS 290.A O no hydrogen 3.007 N/A GLU 302.A N LYS 221.A O no hydrogen 2.735 N/A THR 303.A N TYR 288.A O no hydrogen 2.815 N/A VAL 304.A N SER 223.A O no hydrogen 2.878 N/A LEU 305.A N GLY 286.A O no hydrogen 2.861 N/A THR 306.A N LEU 225.A O no hydrogen 3.286 N/A VAL 307.A N SER 285.A OG no hydrogen 2.818 N/A THR 308.A N GLY 227.A O no hydrogen 2.619 N/A THR 308.A OG1 GLY 227.A O no hydrogen 3.046 N/A ALA 309.A N ASN 337.A O no hydrogen 3.023 N/A LEU 311.A N GLU 380.A OE1 no hydrogen 3.213 N/A SER 312.A N THR 335.A O no hydrogen 3.181 N/A LYS 314.A N GLN 333.A O no hydrogen 2.792 N/A ASP 316.A N THR 331.A O no hydrogen 2.987 N/A THR 319.A OG1 GLU 387.A OE2 no hydrogen 2.676 N/A GLN 320.A N GLU 387.A O no hydrogen 3.412 N/A GLN 320.A NE2 VAL 329.A O no hydrogen 2.717 N/A VAL 322.A N LYS 389.A O no hydrogen 3.081 N/A GLY 325.A N VAL 363.A O no hydrogen 3.043 N/A ARG 326.A N ASP 323.A O no hydrogen 2.994 N/A ALA 328.A N ILE 360.A O no hydrogen 2.766 N/A PHE 330.A N LEU 358.A O no hydrogen 2.681 N/A THR 331.A N ASP 316.A O no hydrogen 3.121 N/A CYS 332.A N PRO 356.A O no hydrogen 2.966 N/A GLN 333.A N LYS 314.A O no hydrogen 2.630 N/A THR 335.A N SER 312.A O no hydrogen 3.087 N/A ASN 337.A N ALA 309.A O no hydrogen 3.240 N/A ASN 337.A ND2 VAL 307.A O no hydrogen 3.353 N/A LYS 340.A N ARG 376.A O no hydrogen 3.130 N/A SER 343.A N PHE 374.A O no hydrogen 2.859 N/A TRP 344.A NE1 GLU 355.A O no hydrogen 2.762 N/A MET 345.A N GLN 372.A O no hydrogen 2.926 N/A LYS 346.A N LYS 349.A O no hydrogen 2.965 N/A LYS 346.A NZ ASP 347.A OD2 no hydrogen 2.580 N/A LYS 346.A NZ GLU 366.A O no hydrogen 3.012 N/A LYS 346.A NZ LYS 368.A O no hydrogen 3.001 N/A ASP 347.A N MET 370.A O no hydrogen 2.894 N/A LYS 349.A N LYS 346.A O no hydrogen 3.267 N/A ILE 351.A N TRP 344.A O no hydrogen 3.111 N/A HIS 353.A NE2 VAL 357.A O no hydrogen 2.900 N/A LEU 358.A N PHE 330.A O no hydrogen 2.783 N/A ILE 360.A N ALA 328.A O no hydrogen 2.809 N/A LYS 364.A N ASP 367.A OD2 no hydrogen 3.055 N/A LYS 368.A NZ PHE 88.A O no hydrogen 2.767 N/A GLY 369.A N LEU 388.A O no hydrogen 3.427 N/A MET 370.A N ASP 347.A OD1 no hydrogen 2.880 N/A TYR 371.A N ALA 386.A O no hydrogen 2.746 N/A TYR 371.A OH ASP 367.A O no hydrogen 2.402 N/A GLN 372.A N MET 345.A O no hydrogen 2.864 N/A GLN 372.A NE2 ILE 92.A O no hydrogen 2.670 N/A CYS 373.A N ALA 384.A O no hydrogen 3.088 N/A PHE 374.A N SER 343.A O no hydrogen 2.681 N/A VAL 375.A N ALA 382.A O no hydrogen 3.108 N/A ARG 376.A N THR 341.A O no hydrogen 3.232 N/A ARG 376.A NH1 ASP 95.A OD1 no hydrogen 2.787 N/A ASN 377.A N GLU 380.A O no hydrogen 2.650 N/A ASN 377.A ND2 PRO 338.A O no hydrogen 2.427 N/A SER 381.A OG ASN 12.A OD1 no hydrogen 2.727 N/A ALA 382.A N VAL 375.A O no hydrogen 2.836 N/A ALA 384.A N CYS 373.A O no hydrogen 3.211 N/A ALA 386.A N TYR 371.A O no hydrogen 2.875 N/A GLU 387.A N PRO 318.A O no hydrogen 3.076 N/A LEU 388.A N GLY 369.A O no hydrogen 2.992 N/A LYS 389.A N GLN 320.A O no hydrogen 3.093 N/A LYS 389.A NZ GLN 1.A O no hydrogen 2.912 N/A GLY 391.A N VAL 322.A O no hydrogen 3.046 N/A