Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8ssn_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 4.A N LEU 26.A O no hydrogen 2.936 N/A VAL 5.A N THR 55.A O no hydrogen 2.869 N/A ALA 6.A N GLU 24.A O no hydrogen 3.085 N/A LEU 7.A N TYR 53.A O no hydrogen 2.736 N/A TYR 8.A N TYR 53.A O no hydrogen 3.353 N/A PHE 10.A N ILE 20.A O no hydrogen 2.933 N/A ALA 12.A N SER 19.A OG no hydrogen 2.931 N/A ASN 16.A N ASP 15.A OD1 no hydrogen 2.197 N/A LEU 18.A N TRP 48.A O no hydrogen 2.647 N/A ILE 20.A N PHE 10.A O no hydrogen 3.083 N/A THR 21.A N GLU 24.A OE1 no hydrogen 2.990 N/A THR 21.A OG1 GLU 24.A OE1 no hydrogen 3.036 N/A LYS 22.A N ASP 9.A OD1 no hydrogen 2.696 N/A GLY 23.A N ALA 6.A O no hydrogen 2.791 N/A GLU 24.A N THR 21.A O no hydrogen 2.961 N/A LEU 26.A N PHE 4.A O no hydrogen 2.868 N/A ARG 27.A N GLN 41.A O no hydrogen 2.922 N/A LEU 29.A N GLU 39.A O no hydrogen 2.869 N/A ASN 32.A N TRP 37.A O no hydrogen 3.051 N/A ASN 32.A ND2 ASN 34.A OD1 no hydrogen 2.597 N/A ASN 32.A ND2 PRO 168.A O no hydrogen 3.279 N/A GLU 36.A N ASN 34.A OD1 no hydrogen 2.735 N/A TRP 37.A N ASN 32.A OD1 no hydrogen 3.064 N/A CYS 38.A N VAL 49.A O no hydrogen 2.903 N/A CYS 38.A SG VAL 49.A O no hydrogen 3.621 N/A GLU 39.A N GLY 30.A O no hydrogen 2.928 N/A ALA 40.A N GLY 47.A O no hydrogen 2.852 N/A GLN 41.A N ARG 27.A O no hydrogen 2.877 N/A THR 42.A N GLY 45.A O no hydrogen 2.922 N/A THR 42.A OG1 GLY 45.A O no hydrogen 3.311 N/A GLY 47.A N ALA 40.A O no hydrogen 2.958 N/A TRP 48.A N ASN 16.A O no hydrogen 3.089 N/A VAL 49.A N CYS 38.A O no hydrogen 2.875 N/A SER 51.A N GLU 36.A O no hydrogen 2.886 N/A SER 51.A OG GLY 35.A O no hydrogen 2.620 N/A TYR 53.A N PRO 50.A O no hydrogen 3.260 N/A ILE 54.A N SER 51.A O no hydrogen 3.508 N/A THR 55.A N VAL 5.A O no hydrogen 2.930 N/A THR 55.A OG1 SER 59.A OG no hydrogen 3.051 N/A THR 55.A OG1 GLU 61.A OE1 no hydrogen 3.308 N/A VAL 57.A N LEU 3.A O no hydrogen 2.891 N/A SER 59.A N PRO 56.A O no hydrogen 3.059 N/A SER 59.A OG THR 55.A OG1 no hydrogen 3.051 N/A SER 59.A OG PRO 56.A O no hydrogen 2.360 N/A LYS 62.A N SER 59.A O no hydrogen 3.430 N/A LYS 62.A NZ VAL 57.A O no hydrogen 3.167 N/A HIS 63.A N LEU 60.A O no hydrogen 3.458 N/A HIS 67.A N VAL 89.A O no hydrogen 2.908 N/A HIS 67.A NE2 ALA 155.A O no hydrogen 2.668 N/A VAL 70.A N GLU 91.A O no hydrogen 3.306 N/A SER 71.A OG GLU 407.A OE1 no hydrogen 2.870 N/A SER 71.A OG GLU 407.A OE2 no hydrogen 2.817 N/A ARG 72.A NH2 PHE 410.A O no hydrogen 3.466 N/A ARG 72.A NH2 GLN 411.A O no hydrogen 2.729 N/A ASN 73.A N GLU 407.A OE2 no hydrogen 2.844 N/A ALA 75.A N SER 71.A O no hydrogen 2.799 N/A GLU 76.A N ARG 72.A O no hydrogen 2.920 N/A TYR 77.A N ASN 73.A O no hydrogen 2.871 N/A TYR 77.A OH HIS 301.A ND1 no hydrogen 2.706 N/A LEU 78.A N ALA 74.A O no hydrogen 2.923 N/A LEU 79.A N ALA 75.A O no hydrogen 2.949 N/A SER 80.A N TYR 77.A O no hydrogen 3.066 N/A SER 80.A OG TYR 77.A O no hydrogen 2.585 N/A GLY 82.A N LEU 79.A O no hydrogen 3.244 N/A ILE 83.A N SER 86.A OG no hydrogen 3.156 N/A ASN 84.A ND2 GLU 106.A OE2 no hydrogen 3.296 N/A GLY 85.A N ARG 104.A O no hydrogen 3.319 N/A SER 86.A N ILE 83.A O no hydrogen 3.004 N/A SER 86.A OG ILE 83.A O no hydrogen 3.268 N/A PHE 87.A N TYR 153.A O no hydrogen 2.921 N/A LEU 88.A N SER 102.A O no hydrogen 2.897 N/A VAL 89.A N TRP 65.A O no hydrogen 2.501 N/A ARG 90.A N SER 100.A O no hydrogen 2.900 N/A ARG 90.A NE SER 102.A OG no hydrogen 3.098 N/A ARG 90.A NH2 HIS 111.A ND1 no hydrogen 3.184 N/A GLU 91.A N GLY 68.A O no hydrogen 2.835 N/A SER 92.A N GLN 98.A O no hydrogen 2.730 N/A SER 92.A OG SER 95.A O no hydrogen 3.029 N/A SER 94.A OG SER 92.A OG no hydrogen 3.207 N/A SER 95.A N SER 92.A OG no hydrogen 3.115 N/A ARG 99.A NH2 GLU 91.A OE2 no hydrogen 2.771 N/A SER 100.A N ARG 90.A O no hydrogen 2.895 N/A SER 100.A OG TYR 112.A O no hydrogen 3.392 N/A ILE 101.A N TYR 112.A O no hydrogen 2.859 N/A SER 102.A N LEU 88.A O no hydrogen 2.902 N/A SER 102.A OG HIS 111.A ND1 no hydrogen 3.185 N/A LEU 103.A N TYR 110.A O no hydrogen 2.907 N/A ARG 104.A N SER 86.A O no hydrogen 2.742 N/A ARG 104.A NH1 LEU 79.A O no hydrogen 2.826 N/A ARG 104.A NH1 SER 80.A O no hydrogen 2.931 N/A TYR 105.A N ARG 108.A O no hydrogen 2.892 N/A GLU 106.A N ASN 84.A OD1 no hydrogen 2.923 N/A ARG 108.A N TYR 105.A O no hydrogen 2.914 N/A TYR 110.A N LEU 103.A O no hydrogen 2.873 N/A HIS 111.A ND1 SER 102.A OG no hydrogen 3.185 N/A HIS 111.A NE2 GLU 76.A OE2 no hydrogen 2.990 N/A TYR 112.A N ILE 101.A O no hydrogen 2.907 N/A ILE 114.A N ARG 99.A O no hydrogen 2.912 N/A ASN 115.A N TYR 123.A O no hydrogen 2.755 N/A ALA 117.A N LYS 121.A O no hydrogen 3.327 N/A GLY 120.A N ALA 117.A O no hydrogen 3.030 N/A TYR 123.A N ASN 115.A O no hydrogen 2.606 N/A SER 125.A OG ASP 145.A O no hydrogen 3.516 N/A SER 128.A N SER 125.A O no hydrogen 3.247 N/A SER 128.A OG ASP 145.A OD2 no hydrogen 3.200 N/A ARG 129.A NE SER 126.A O no hydrogen 2.612 N/A ARG 129.A NH2 SER 126.A O no hydrogen 3.191 N/A ARG 129.A NH2 SER 126.A OG no hydrogen 3.138 N/A PHE 130.A N LEU 122.A O no hydrogen 2.945 N/A GLU 135.A N THR 132.A OG1 no hydrogen 3.166 N/A LEU 136.A N THR 132.A O no hydrogen 3.329 N/A VAL 137.A N LEU 133.A O no hydrogen 2.911 N/A HIS 138.A N ALA 134.A O no hydrogen 2.889 N/A HIS 139.A N GLU 135.A O no hydrogen 2.907 N/A HIS 139.A NE2 ASP 145.A OD2 no hydrogen 2.360 N/A HIS 140.A N LEU 136.A O no hydrogen 2.928 N/A HIS 140.A ND1 ALA 144.A O no hydrogen 2.781 N/A SER 141.A N VAL 137.A O no hydrogen 2.846 N/A SER 141.A OG HIS 138.A O no hydrogen 2.792 N/A THR 142.A N HIS 139.A O no hydrogen 3.027 N/A THR 142.A OG1 HIS 138.A O no hydrogen 3.262 N/A VAL 143.A N HIS 139.A O no hydrogen 2.986 N/A LEU 147.A N ALA 144.A O no hydrogen 3.365 N/A ILE 148.A N TYR 112.A OH no hydrogen 3.233 N/A LEU 151.A N HIS 140.A O no hydrogen 3.067 N/A HIS 152.A N GLY 85.A O no hydrogen 2.920 N/A TYR 153.A N GLY 85.A O no hydrogen 2.958 N/A ALA 155.A N PHE 87.A O no hydrogen 2.807 N/A ASN 159.A ND2 GLU 299.A O no hydrogen 2.644 N/A LYS 160.A NZ ASP 9.A O no hydrogen 2.636 N/A GLY 165.A N GLN 226.A OE1 no hydrogen 2.837 N/A SER 167.A OG ASP 15.A OD2 no hydrogen 2.313 N/A SER 167.A OG ASN 169.A OD1 no hydrogen 3.413 N/A ASN 169.A N SER 167.A OG no hydrogen 3.228 N/A LYS 174.A N GLU 184.A O no hydrogen 2.883 N/A LYS 174.A NZ GLU 184.A OE1 no hydrogen 2.814 N/A TYR 183.A N VAL 196.A O no hydrogen 2.842 N/A GLU 184.A N HIS 175.A O no hydrogen 2.878 N/A GLY 185.A N VAL 194.A O no hydrogen 2.913 N/A VAL 186.A N THR 172.A O no hydrogen 2.933 N/A TRP 187.A N LEU 192.A O no hydrogen 2.909 N/A SER 191.A OG TYR 190.A O no hydrogen 2.752 N/A LEU 192.A N TRP 187.A O no hydrogen 2.989 N/A VAL 194.A N GLY 185.A O no hydrogen 2.884 N/A ALA 195.A N THR 241.A O no hydrogen 2.920 N/A VAL 196.A N TYR 183.A O no hydrogen 2.865 N/A LYS 197.A N ILE 239.A O no hydrogen 2.889 N/A THR 198.A N GLU 181.A O no hydrogen 2.811 N/A THR 198.A OG1 GLU 181.A O no hydrogen 3.428 N/A THR 198.A OG1 GLU 181.A OE1 no hydrogen 3.178 N/A THR 203.A OG1 SER 311.A OG no hydrogen 2.753 N/A LEU 210.A N GLU 207.A O no hydrogen 3.381 N/A LYS 211.A N GLU 207.A O no hydrogen 3.098 N/A GLU 212.A N GLU 208.A O no hydrogen 2.812 N/A ALA 214.A N LEU 210.A O no hydrogen 3.316 N/A MET 216.A N GLU 212.A O no hydrogen 2.952 N/A LYS 217.A N ALA 213.A O no hydrogen 2.567 N/A GLU 218.A N VAL 215.A O no hydrogen 3.137 N/A ILE 219.A N MET 216.A O no hydrogen 2.905 N/A LYS 220.A N TYR 279.A OH no hydrogen 3.121 N/A LYS 220.A NZ GLU 218.A OE1 no hydrogen 2.682 N/A ASN 223.A N HIS 221.A ND1 no hydrogen 2.979 N/A ASN 223.A ND2 GLN 272.A OE1 no hydrogen 3.408 N/A ASN 223.A ND2 VAL 303.A O no hydrogen 3.134 N/A LEU 224.A N HIS 221.A O no hydrogen 3.013 N/A VAL 225.A N VAL 305.A O no hydrogen 3.112 N/A GLN 226.A NE2 VAL 163.A O no hydrogen 2.824 N/A GLY 229.A N ILE 240.A O no hydrogen 2.934 N/A CYS 231.A N TYR 238.A O no hydrogen 2.899 N/A TYR 238.A N CYS 231.A O no hydrogen 2.893 N/A ILE 239.A N LYS 197.A O no hydrogen 2.896 N/A ILE 240.A N GLY 229.A O no hydrogen 2.882 N/A THR 241.A N ALA 195.A O no hydrogen 2.904 N/A THR 241.A OG1 GLU 242.A O no hydrogen 3.288 N/A GLU 242.A N GLN 226.A O no hydrogen 3.416 N/A TYR 246.A N VAL 297.A O no hydrogen 3.355 N/A TYR 246.A OH GLU 299.A OE1 no hydrogen 2.801 N/A LEU 249.A N CYS 295.A O no hydrogen 3.192 N/A LEU 250.A N ASN 248.A OD1 no hydrogen 2.634 N/A TYR 252.A N ASN 248.A O no hydrogen 2.927 N/A LEU 253.A N LEU 249.A O no hydrogen 2.835 N/A ARG 254.A N LEU 250.A O no hydrogen 2.948 N/A ARG 254.A NE GLY 351.A O no hydrogen 2.534 N/A ARG 254.A NH2 GLY 351.A O no hydrogen 2.825 N/A GLU 255.A N ASP 251.A O no hydrogen 3.173 N/A GLU 255.A N TYR 252.A O no hydrogen 3.128 N/A CYS 256.A SG LEU 253.A O no hydrogen 3.495 N/A GLN 259.A NE2 ASN 257.A OD1 no hydrogen 3.086 N/A VAL 261.A N ASN 257.A O no hydrogen 2.847 N/A LEU 266.A N ASN 262.A O no hydrogen 2.970 N/A LEU 267.A N ALA 263.A O no hydrogen 2.928 N/A TYR 268.A N VAL 264.A O no hydrogen 2.914 N/A MET 269.A N VAL 265.A O no hydrogen 2.966 N/A ALA 270.A N LEU 266.A O no hydrogen 2.920 N/A THR 271.A N LEU 267.A O no hydrogen 2.821 N/A THR 271.A OG1 LEU 267.A O no hydrogen 3.238 N/A GLN 272.A N TYR 268.A O no hydrogen 2.953 N/A GLN 272.A NE2 TYR 268.A O no hydrogen 3.372 N/A GLN 272.A NE2 HIS 301.A O no hydrogen 2.902 N/A ILE 273.A N MET 269.A O no hydrogen 2.924 N/A SER 274.A N ALA 270.A O no hydrogen 2.855 N/A SER 274.A OG THR 271.A O no hydrogen 3.131 N/A SER 275.A N THR 271.A O no hydrogen 2.889 N/A SER 275.A OG HIS 221.A NE2 no hydrogen 3.195 N/A ALA 276.A N GLN 272.A O no hydrogen 2.943 N/A MET 277.A N ILE 273.A O no hydrogen 2.901 N/A GLU 278.A N SER 274.A O no hydrogen 2.852 N/A TYR 279.A N SER 275.A O no hydrogen 2.923 N/A LEU 280.A N ALA 276.A O no hydrogen 2.939 N/A GLU 281.A N MET 277.A O no hydrogen 2.855 N/A LYS 282.A N GLU 278.A O no hydrogen 2.912 N/A LYS 283.A N TYR 279.A O no hydrogen 3.365 N/A ASN 284.A N GLU 281.A O no hydrogen 2.779 N/A PHE 285.A N LEU 280.A O no hydrogen 2.967 N/A HIS 287.A N ASP 336.A OD2 no hydrogen 2.451 N/A HIS 287.A NE2 ALA 306.A O no hydrogen 2.620 N/A ARG 288.A N ASP 336.A OD1 no hydrogen 2.865 N/A ASP 289.A N HIS 287.A ND1 no hydrogen 2.983 N/A ARG 293.A NH2 ASP 289.A OD1 no hydrogen 3.548 N/A ASN 294.A ND2 ASP 289.A O no hydrogen 2.816 N/A CYS 295.A N ALA 292.A O no hydrogen 3.017 N/A CYS 295.A SG ALA 291.A O no hydrogen 3.070 N/A LEU 296.A N LYS 304.A O no hydrogen 2.871 N/A VAL 297.A N GLY 247.A O no hydrogen 3.045 N/A GLY 298.A N LEU 302.A O no hydrogen 2.350 N/A HIS 301.A ND1 TYR 77.A OH no hydrogen 2.706 N/A LEU 302.A N GLU 299.A O no hydrogen 3.119 N/A VAL 303.A N GLN 272.A OE1 no hydrogen 3.267 N/A LYS 304.A N LEU 296.A O no hydrogen 2.931 N/A LYS 304.A NZ GLU 242.A OE1 no hydrogen 2.476 N/A VAL 305.A N ASN 223.A O no hydrogen 2.985 N/A ALA 306.A N ASN 294.A O no hydrogen 2.905 N/A GLY 309.A N HIS 287.A O no hydrogen 3.473 N/A SER 311.A OG THR 203.A OG1 no hydrogen 2.753 N/A SER 311.A OG LEU 310.A O no hydrogen 2.400 N/A ARG 312.A N LEU 310.A O no hydrogen 2.475 N/A MET 314.A N GLU 181.A OE2 no hydrogen 3.096 N/A THR 315.A OG1 LEU 313.A O no hydrogen 2.409 N/A LYS 319.A NZ PRO 354.A O no hydrogen 2.551 N/A TRP 320.A NE1 GLU 346.A OE2 no hydrogen 2.395 N/A THR 321.A N ILE 318.A O no hydrogen 3.358 N/A THR 321.A OG1 SER 325.A OG no hydrogen 2.394 N/A SER 325.A N ALA 322.A O no hydrogen 2.965 N/A SER 325.A OG THR 321.A OG1 no hydrogen 2.394 N/A SER 325.A OG ALA 322.A O no hydrogen 2.520 N/A SER 332.A OG SER 335.A OG no hydrogen 3.115 N/A SER 335.A N SER 332.A OG no hydrogen 3.164 N/A SER 335.A OG SER 332.A OG no hydrogen 3.115 N/A VAL 337.A N ILE 333.A O no hydrogen 2.715 N/A TRP 338.A N LYS 334.A O no hydrogen 2.930 N/A ALA 339.A N SER 335.A O no hydrogen 2.940 N/A PHE 340.A N ASP 336.A O no hydrogen 2.819 N/A GLY 341.A N VAL 337.A O no hydrogen 2.898 N/A VAL 342.A N TRP 338.A O no hydrogen 3.008 N/A LEU 343.A N ALA 339.A O no hydrogen 2.856 N/A LEU 344.A N PHE 340.A O no hydrogen 2.855 N/A TRP 345.A N GLY 341.A O no hydrogen 2.948 N/A GLU 346.A N VAL 342.A O no hydrogen 2.936 N/A ILE 347.A N LEU 343.A O no hydrogen 2.894 N/A ALA 348.A N LEU 344.A O no hydrogen 2.893 N/A THR 349.A N TRP 345.A O no hydrogen 2.919 N/A THR 349.A OG1 TRP 345.A O no hydrogen 2.765 N/A THR 349.A OG1 GLU 346.A O no hydrogen 2.911 N/A TYR 350.A N ILE 347.A O no hydrogen 3.169 N/A TYR 350.A OH VAL 261.A O no hydrogen 2.373 N/A GLY 351.A N GLU 346.A O no hydrogen 2.799 N/A SER 360.A OG ASP 358.A OD2 no hydrogen 2.918 N/A VAL 362.A N LEU 359.A O no hydrogen 2.940 N/A LEU 365.A N GLN 361.A O no hydrogen 3.057 N/A LEU 366.A N TYR 363.A O no hydrogen 2.837 N/A GLU 367.A N TYR 363.A O no hydrogen 3.153 N/A ARG 370.A NH2 ARG 386.A O no hydrogen 2.988 N/A CYS 377.A N PRO 374.A O no hydrogen 3.116 N/A CYS 377.A SG PRO 378.A O no hydrogen 3.540 N/A VAL 381.A N PRO 378.A O no hydrogen 2.859 N/A TYR 382.A N PRO 378.A O no hydrogen 3.171 N/A GLU 383.A N GLU 379.A O no hydrogen 2.848 N/A LEU 384.A N LYS 380.A O no hydrogen 2.932 N/A MET 385.A N VAL 381.A O no hydrogen 2.985 N/A ARG 386.A N TYR 382.A O no hydrogen 2.798 N/A ALA 387.A N GLU 383.A O no hydrogen 2.934 N/A CYS 388.A N LEU 384.A O no hydrogen 2.899 N/A CYS 388.A SG LEU 384.A O no hydrogen 3.150 N/A TRP 389.A N MET 385.A O no hydrogen 3.085 N/A TRP 389.A N ARG 386.A O no hydrogen 3.197 N/A TRP 389.A NE1 TRP 338.A O no hydrogen 3.096 N/A ASP 395.A N ASN 392.A O no hydrogen 3.143 N/A ARG 396.A N PRO 393.A O no hydrogen 3.214 N/A ARG 396.A NE GLN 390.A O no hydrogen 2.905 N/A ARG 396.A NH1 GLU 324.A OE2 no hydrogen 2.582 N/A ARG 396.A NH2 GLU 324.A OE1 no hydrogen 2.841 N/A ARG 396.A NH2 GLU 324.A OE2 no hydrogen 2.842 N/A ARG 396.A NH2 GLN 390.A O no hydrogen 2.438 N/A PHE 399.A N GLU 281.A OE1 no hydrogen 2.797 N/A GLU 401.A N SER 398.A OG no hydrogen 3.061 N/A ILE 402.A N SER 398.A O no hydrogen 2.669 N/A HIS 403.A N PHE 399.A O no hydrogen 2.891 N/A HIS 403.A ND1 GLU 278.A OE1 no hydrogen 2.941 N/A GLN 404.A N ALA 400.A O no hydrogen 2.910 N/A ALA 405.A N GLU 401.A O no hydrogen 2.890 N/A PHE 406.A N ILE 402.A O no hydrogen 2.877 N/A GLU 407.A N HIS 403.A O no hydrogen 2.951 N/A THR 408.A N GLN 404.A O no hydrogen 3.308 N/A THR 408.A N ALA 405.A O no hydrogen 2.952 N/A THR 408.A OG1 GLN 404.A O no hydrogen 2.809 N/A THR 408.A OG1 ALA 405.A O no hydrogen 3.284 N/A SER 413.A N PHE 410.A O no hydrogen 3.301 N/A GLU 418.A N SER 414.A O no hydrogen 2.767 N/A