Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4ui9_R.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG LYS 2.A O no hydrogen 3.248 N/A SER 10.A N THR 52.A O no hydrogen 3.381 N/A SER 10.A OG THR 52.A O no hydrogen 2.825 N/A ASN 19.A N ASN 15.A O no hydrogen 2.913 N/A PHE 20.A N TRP 16.A O no hydrogen 3.078 N/A HIS 21.A N SER 17.A O no hydrogen 3.065 N/A ARG 22.A N VAL 18.A O no hydrogen 3.146 N/A SER 31.A N GLY 27.A O no hydrogen 3.261 N/A ALA 32.A N LEU 28.A O no hydrogen 3.165 N/A LEU 33.A N ALA 29.A O no hydrogen 3.158 N/A LEU 34.A N TYR 30.A O no hydrogen 3.133 N/A LYS 35.A N SER 31.A O no hydrogen 3.205 N/A ASN 36.A N ALA 32.A O no hydrogen 3.340 N/A GLU 37.A N LEU 33.A O no hydrogen 3.179 N/A GLU 37.A N LEU 34.A O no hydrogen 3.040 N/A LEU 38.A N LEU 34.A O no hydrogen 3.151 N/A THR 52.A OG1 SER 54.A O no hydrogen 3.550 N/A SER 59.A OG TYR 58.A O no hydrogen 2.533 N/A SER 61.A OG SER 59.A O no hydrogen 2.610 N/A SER 64.A N SER 61.A O no hydrogen 3.166 N/A SER 64.A OG VAL 63.A O no hydrogen 2.492 N/A SER 64.A OG SER 67.A OG no hydrogen 2.792 N/A SER 67.A OG VAL 63.A O no hydrogen 2.126 N/A SER 67.A OG SER 64.A O no hydrogen 2.933 N/A SER 67.A OG SER 64.A OG no hydrogen 2.792 N/A GLN 68.A N SER 64.A O no hydrogen 2.900 N/A LYS 69.A N ASN 65.A O no hydrogen 3.329 N/A LEU 71.A N SER 67.A O no hydrogen 3.063 N/A ARG 72.A N GLN 68.A O no hydrogen 2.949 N/A SER 73.A N LYS 69.A O no hydrogen 3.427 N/A SER 74.A OG ILE 76.A O no hydrogen 3.136 N/A PHE 78.A N PHE 371.A O no hydrogen 2.713 N/A LEU 81.A N LEU 369.A O no hydrogen 2.866 N/A ALA 83.A N GLU 367.A O no hydrogen 2.780 N/A GLU 85.A N GLU 367.A OE2 no hydrogen 2.768 N/A LEU 86.A N ALA 83.A O no hydrogen 3.284 N/A GLN 87.A NE2 GLU 85.A O no hydrogen 3.356 N/A ASP 89.A N TYR 350.A OH no hydrogen 3.427 N/A TYR 91.A N ASP 89.A OD1 no hydrogen 3.092 N/A TYR 91.A OH ASN 235.A OD1 no hydrogen 2.825 N/A LEU 92.A N ASP 89.A O no hydrogen 3.259 N/A ASN 93.A N THR 135.A O no hydrogen 2.949 N/A ASN 93.A ND2 GLY 177.A O no hydrogen 2.513 N/A ASP 96.A N SER 104.A O no hydrogen 2.977 N/A TRP 97.A NE1 ASN 101.A OD1 no hydrogen 2.838 N/A SER 98.A N VAL 102.A O no hydrogen 2.819 N/A SER 98.A OG VAL 102.A O no hydrogen 3.472 N/A SER 99.A OG GLU 141.A O no hydrogen 2.655 N/A LEU 100.A N SER 98.A OG no hydrogen 3.073 N/A ASN 101.A N SER 98.A O no hydrogen 2.838 N/A VAL 102.A N SER 98.A OG no hydrogen 2.955 N/A LEU 103.A N TRP 114.A O no hydrogen 2.885 N/A SER 104.A N ASP 96.A O no hydrogen 2.811 N/A VAL 105.A N TYR 112.A O no hydrogen 2.933 N/A GLY 106.A N LEU 94.A O no hydrogen 3.001 N/A LEU 107.A N CYS 110.A O no hydrogen 2.704 N/A THR 109.A OG1 ASP 126.A OD1 no hydrogen 3.434 N/A CYS 110.A N LEU 107.A O no hydrogen 2.973 N/A CYS 110.A SG TYR 112.A OH no hydrogen 3.855 N/A VAL 111.A N CYS 125.A O no hydrogen 2.870 N/A TYR 112.A N VAL 105.A O no hydrogen 2.911 N/A LEU 113.A N THR 122.A O no hydrogen 2.888 N/A TRP 114.A N LEU 103.A O no hydrogen 2.855 N/A SER 115.A N GLN 120.A O no hydrogen 2.844 N/A SER 115.A OG THR 118.A OG1 no hydrogen 3.162 N/A ALA 116.A N ASN 101.A O no hydrogen 3.039 N/A THR 118.A OG1 SER 115.A OG no hydrogen 3.162 N/A SER 119.A N SER 115.A O no hydrogen 2.739 N/A THR 122.A N LEU 113.A O no hydrogen 2.936 N/A LEU 124.A N VAL 111.A O no hydrogen 2.677 N/A CYS 125.A N VAL 111.A O no hydrogen 3.096 N/A LEU 127.A N THR 109.A O no hydrogen 2.918 N/A VAL 129.A N ASP 132.A OD2 no hydrogen 3.438 N/A SER 133.A N GLU 130.A O no hydrogen 3.177 N/A VAL 134.A N GLY 108.A O no hydrogen 3.134 N/A THR 135.A N GLY 149.A O no hydrogen 2.856 N/A THR 135.A OG1 VAL 176.A O no hydrogen 2.067 N/A SER 136.A N GLY 149.A O no hydrogen 3.174 N/A SER 136.A OG VAL 176.A O no hydrogen 3.070 N/A VAL 137.A N ASN 93.A O no hydrogen 3.029 N/A GLY 138.A N ALA 147.A O no hydrogen 2.907 N/A TRP 139.A N ASP 96.A OD2 no hydrogen 2.600 N/A SER 140.A N LEU 145.A O no hydrogen 2.653 N/A SER 140.A OG LEU 145.A O no hydrogen 3.372 N/A GLY 143.A N SER 140.A O no hydrogen 2.798 N/A LEU 145.A N SER 140.A OG no hydrogen 3.053 N/A VAL 146.A N TRP 158.A O no hydrogen 2.933 N/A ALA 147.A N GLY 138.A O no hydrogen 2.875 N/A VAL 148.A N GLN 156.A O no hydrogen 2.849 N/A GLY 149.A N SER 136.A O no hydrogen 2.813 N/A THR 150.A N PHE 154.A O no hydrogen 2.967 N/A THR 150.A OG1 PHE 154.A O no hydrogen 2.833 N/A HIS 151.A N ASP 132.A O no hydrogen 2.967 N/A HIS 151.A N SER 133.A O no hydrogen 2.926 N/A GLY 153.A N THR 150.A O no hydrogen 3.011 N/A VAL 155.A N LEU 169.A O no hydrogen 2.937 N/A GLN 156.A N VAL 148.A O no hydrogen 2.899 N/A ILE 157.A N SER 167.A O no hydrogen 2.853 N/A TRP 158.A N VAL 146.A O no hydrogen 2.860 N/A ASP 159.A N LYS 164.A O no hydrogen 2.914 N/A ALA 160.A N ASN 144.A O no hydrogen 3.284 N/A ALA 161.A N ASP 159.A OD1 no hydrogen 3.194 N/A ALA 162.A N ASP 159.A OD1 no hydrogen 3.194 N/A LYS 164.A N ASP 159.A O no hydrogen 3.141 N/A LEU 166.A N ILE 157.A O no hydrogen 2.561 N/A SER 167.A N ILE 157.A O no hydrogen 3.071 N/A LEU 169.A N VAL 155.A O no hydrogen 2.846 N/A HIS 172.A NE2 SER 188.A OG no hydrogen 2.647 N/A VAL 176.A N THR 150.A O no hydrogen 3.141 N/A GLY 177.A N GLY 189.A O no hydrogen 2.994 N/A ALA 178.A N GLY 189.A O no hydrogen 3.330 N/A ALA 180.A N SER 187.A O no hydrogen 2.926 N/A TRP 181.A NE1 GLY 138.A O no hydrogen 3.046 N/A ASN 182.A N GLN 185.A O no hydrogen 2.546 N/A ASN 182.A ND2 HIS 227.A O no hydrogen 3.669 N/A GLN 185.A N ASN 182.A O no hydrogen 2.708 N/A LEU 186.A N ARG 198.A O no hydrogen 2.863 N/A SER 187.A N ALA 180.A O no hydrogen 2.741 N/A SER 188.A N LEU 196.A O no hydrogen 2.900 N/A SER 188.A OG HIS 172.A NE2 no hydrogen 2.647 N/A SER 188.A OG LEU 196.A O no hydrogen 3.512 N/A GLY 189.A N ALA 178.A O no hydrogen 2.941 N/A SER 190.A OG ALA 174.A O no hydrogen 3.342 N/A SER 190.A OG ARG 175.A O no hydrogen 3.104 N/A ARG 191.A N ARG 175.A O no hydrogen 2.873 N/A ARG 193.A N SER 190.A O no hydrogen 2.918 N/A ILE 195.A N ARG 210.A O no hydrogen 2.684 N/A LEU 196.A N SER 188.A O no hydrogen 2.929 N/A GLN 197.A N GLU 208.A O no hydrogen 3.015 N/A ARG 198.A N LEU 186.A O no hydrogen 2.895 N/A ARG 198.A NH2 GLU 170.A O no hydrogen 2.833 N/A ASP 199.A N LEU 205.A O no hydrogen 2.743 N/A ILE 200.A N GLU 184.A O no hydrogen 3.453 N/A ARG 201.A N ASP 199.A OD1 no hydrogen 2.978 N/A ARG 201.A NE ASP 199.A OD1 no hydrogen 2.707 N/A ARG 201.A NH2 ASP 199.A OD1 no hydrogen 3.570 N/A ARG 201.A NH2 ASP 199.A OD2 no hydrogen 2.440 N/A THR 202.A OG1 ASP 199.A O no hydrogen 2.947 N/A THR 202.A OG1 PRO 204.A O no hydrogen 2.612 N/A SER 207.A N GLN 197.A O no hydrogen 3.152 N/A ARG 210.A N ILE 195.A O no hydrogen 2.784 N/A CYS 219.A SG GLY 220.A O no hydrogen 3.317 N/A GLY 220.A N VAL 260.A O no hydrogen 3.240 N/A LYS 222.A N ALA 231.A O no hydrogen 2.854 N/A TRP 223.A NE1 SER 187.A OG no hydrogen 2.833 N/A SER 224.A N LEU 229.A O no hydrogen 2.892 N/A SER 224.A OG ASP 226.A OD1 no hydrogen 3.402 N/A HIS 227.A N SER 224.A O no hydrogen 2.784 N/A GLN 228.A N ASP 226.A OD1 no hydrogen 2.776 N/A LEU 230.A N TRP 242.A O no hydrogen 2.876 N/A ALA 231.A N LYS 222.A O no hydrogen 2.912 N/A SER 232.A N LEU 240.A O no hydrogen 2.923 N/A GLY 233.A N GLY 220.A O no hydrogen 2.908 N/A GLY 234.A N LYS 238.A O no hydrogen 3.092 N/A ASN 237.A N GLY 234.A O no hydrogen 3.184 N/A LYS 238.A N ASP 236.A OD1 no hydrogen 3.091 N/A LEU 239.A N TYR 253.A O no hydrogen 3.089 N/A LEU 240.A N SER 232.A O no hydrogen 2.892 N/A VAL 241.A N GLN 251.A O no hydrogen 2.879 N/A TRP 242.A N LEU 230.A O no hydrogen 2.899 N/A HIS 244.A N GLN 228.A O no hydrogen 2.778 N/A SER 246.A OG ASN 243.A O no hydrogen 3.350 N/A GLN 251.A N VAL 241.A O no hydrogen 3.002 N/A TYR 253.A N LEU 239.A O no hydrogen 2.942 N/A HIS 256.A ND1 ASP 281.A OD2 no hydrogen 2.668 N/A HIS 256.A NE2 SER 275.A OG no hydrogen 2.856 N/A LEU 257.A N ASP 281.A OD1 no hydrogen 2.991 N/A VAL 260.A N GLY 234.A O no hydrogen 3.075 N/A LYS 261.A NZ PHE 90.A O no hydrogen 2.751 N/A LYS 261.A NZ LEU 92.A O no hydrogen 2.720 N/A LYS 261.A NZ ASN 93.A OD1 no hydrogen 2.673 N/A ALA 264.A N ALA 274.A O no hydrogen 2.884 N/A TRP 265.A NE1 LYS 222.A O no hydrogen 2.950 N/A SER 266.A N LEU 272.A O no hydrogen 2.874 N/A GLN 269.A N SER 266.A OG no hydrogen 3.336 N/A LEU 272.A N GLN 269.A O no hydrogen 3.043 N/A LEU 273.A N TRP 287.A O no hydrogen 2.999 N/A ALA 274.A N ALA 264.A O no hydrogen 2.887 N/A SER 275.A N ARG 285.A O no hydrogen 2.907 N/A SER 275.A OG HIS 256.A NE2 no hydrogen 2.856 N/A SER 275.A OG ARG 285.A O no hydrogen 3.518 N/A GLY 276.A N ALA 262.A O no hydrogen 2.934 N/A GLY 277.A N CYS 283.A O no hydrogen 3.098 N/A GLY 278.A N ALA 259.A O no hydrogen 2.800 N/A ASP 281.A N GLY 278.A O no hydrogen 2.918 N/A ARG 282.A N GLY 278.A O no hydrogen 2.848 N/A ARG 282.A NE THR 279.A O no hydrogen 2.936 N/A CYS 283.A N ASP 281.A OD2 no hydrogen 3.060 N/A CYS 283.A SG ASP 281.A O no hydrogen 3.537 N/A ILE 284.A N ILE 298.A O no hydrogen 2.899 N/A ARG 285.A N SER 275.A O no hydrogen 2.798 N/A PHE 286.A N GLN 296.A O no hydrogen 2.953 N/A TRP 287.A N LEU 273.A O no hydrogen 2.838 N/A TRP 287.A NE1 SER 275.A OG no hydrogen 3.111 N/A ASN 288.A N GLN 293.A O no hydrogen 2.844 N/A THR 289.A N GLY 271.A O no hydrogen 2.716 N/A THR 289.A OG1 GLY 271.A O no hydrogen 3.120 N/A THR 291.A N ASN 288.A OD1 no hydrogen 2.578 N/A GLY 292.A N ASN 288.A O no hydrogen 2.712 N/A GLN 293.A N THR 291.A OG1 no hydrogen 3.157 N/A LEU 295.A N PHE 286.A O no hydrogen 3.008 N/A CYS 297.A N GLN 296.A OE1 no hydrogen 2.948 N/A ILE 298.A N ILE 284.A O no hydrogen 2.998 N/A THR 300.A N ARG 282.A O no hydrogen 2.873 N/A THR 300.A OG1 ARG 282.A O no hydrogen 2.621 N/A THR 300.A OG1 SER 302.A O no hydrogen 2.878 N/A GLY 301.A N ASP 299.A OD1 no hydrogen 3.061 N/A SER 302.A OG GLY 301.A O no hydrogen 2.929 N/A SER 302.A OG TYR 322.A O no hydrogen 3.539 N/A GLN 303.A N TYR 322.A O no hydrogen 2.826 N/A VAL 304.A N GLY 277.A O no hydrogen 3.029 N/A CYS 305.A N THR 319.A O no hydrogen 2.849 N/A ASN 306.A ND2 LEU 349.A O no hydrogen 2.995 N/A ALA 308.A N VAL 317.A O no hydrogen 2.703 N/A TRP 309.A NE1 ALA 264.A O no hydrogen 2.827 N/A SER 310.A N GLU 315.A O no hydrogen 3.064 N/A HIS 312.A NE2 ASP 356.A O no hydrogen 2.538 N/A LEU 316.A N TRP 330.A O no hydrogen 2.875 N/A VAL 317.A N ALA 308.A O no hydrogen 2.777 N/A SER 318.A N LEU 328.A O no hydrogen 2.912 N/A SER 318.A OG HIS 320.A NE2 no hydrogen 2.754 N/A THR 319.A N ASN 306.A O no hydrogen 3.115 N/A HIS 320.A N GLN 326.A O no hydrogen 2.886 N/A GLY 321.A N GLN 303.A O no hydrogen 2.770 N/A TYR 322.A N GLN 303.A OE1 no hydrogen 3.258 N/A GLN 324.A N SER 302.A OG no hydrogen 3.236 N/A GLN 324.A NE2 THR 300.A O no hydrogen 3.385 N/A ASN 325.A N GLY 321.A O no hydrogen 3.169 N/A ILE 327.A N LEU 341.A O no hydrogen 2.893 N/A LEU 328.A N SER 318.A O no hydrogen 2.867 N/A TRP 330.A N LEU 316.A O no hydrogen 2.909 N/A TRP 330.A NE1 SER 318.A OG no hydrogen 3.124 N/A TYR 332.A N ASN 314.A O no hydrogen 2.613 N/A THR 336.A OG1 GLN 337.A O no hydrogen 2.929 N/A LEU 341.A N ILE 327.A O no hydrogen 2.855 N/A HIS 344.A N ASN 325.A O no hydrogen 3.465 N/A HIS 344.A ND1 ASP 366.A OD1 no hydrogen 2.955 N/A HIS 344.A ND1 ASP 366.A OD2 no hydrogen 2.966 N/A HIS 344.A NE2 THR 362.A OG1 no hydrogen 2.831 N/A SER 345.A N ASP 366.A OD2 no hydrogen 2.980 N/A ARG 347.A NE GLN 303.A OE1 no hydrogen 3.332 N/A ARG 347.A NH1 ASP 88.A OD1 no hydrogen 2.985 N/A ARG 347.A NH2 GLN 303.A OE1 no hydrogen 3.132 N/A VAL 348.A N HIS 320.A O no hydrogen 2.986 N/A TYR 350.A N GLY 363.A O no hydrogen 3.289 N/A TYR 350.A OH GLN 87.A O no hydrogen 2.638 N/A TYR 350.A OH ASP 89.A O no hydrogen 3.211 N/A ALA 352.A N VAL 361.A O no hydrogen 2.892 N/A SER 354.A N ALA 359.A O no hydrogen 2.890 N/A SER 354.A OG ASP 356.A OD1 no hydrogen 2.609 N/A SER 354.A OG ALA 359.A O no hydrogen 3.406 N/A GLY 357.A N SER 354.A O no hydrogen 2.731 N/A GLU 358.A N ASP 356.A OD1 no hydrogen 2.954 N/A ALA 359.A N SER 354.A OG no hydrogen 3.230 N/A ILE 360.A N TRP 372.A O no hydrogen 2.901 N/A VAL 361.A N ALA 352.A O no hydrogen 2.858 N/A THR 362.A N ARG 370.A O no hydrogen 2.917 N/A THR 362.A OG1 HIS 344.A NE2 no hydrogen 2.831 N/A GLY 363.A N TYR 350.A O no hydrogen 2.970 N/A GLU 367.A N ALA 364.A O no hydrogen 2.854 N/A THR 368.A N ASP 366.A OD1 no hydrogen 3.106 N/A LEU 369.A N LEU 81.A O no hydrogen 2.884 N/A ARG 370.A N THR 362.A O no hydrogen 2.880 N/A PHE 371.A N LYS 79.A O no hydrogen 2.886 N/A TRP 372.A N ILE 360.A O no hydrogen 2.841 N/A TRP 372.A NE1 THR 362.A OG1 no hydrogen 2.920 N/A VAL 374.A N GLU 358.A O no hydrogen 2.925 N/A PHE 375.A N GLU 358.A O no hydrogen 3.369 N/A PHE 375.A N ASN 373.A OD1 no hydrogen 3.117 N/A SER 378.A OG THR 384.A OG1 no hydrogen 3.046 N/A THR 384.A OG1 SER 378.A OG no hydrogen 3.046 N/A THR 384.A OG1 ASN 381.A O no hydrogen 2.837 N/A ARG 385.A N LEU 382.A O no hydrogen 3.334 N/A