Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 9auc_R.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 4.A N VAL 1.A O no hydrogen 3.107 N/A LYS 5.A NZ VAL 1.A O no hydrogen 3.252 N/A LYS 6.A NZ ASP 56.A OD1 no hydrogen 2.679 N/A MET 7.A N GLY 3.A O no hydrogen 2.930 N/A MET 8.A N ARG 4.A O no hydrogen 3.115 N/A MET 8.A N LYS 5.A O no hydrogen 3.121 N/A ASP 9.A N LYS 5.A O no hydrogen 3.197 N/A GLN 11.A N MET 7.A O no hydrogen 3.166 N/A TYR 12.A N MET 8.A O no hydrogen 3.174 N/A LYS 13.A N ASP 9.A O no hydrogen 3.380 N/A CYS 14.A N ALA 10.A O no hydrogen 3.073 N/A TYR 15.A N GLN 11.A O no hydrogen 3.426 N/A ASP 16.A N TYR 12.A O no hydrogen 3.436 N/A ARG 17.A N LYS 13.A O no hydrogen 3.088 N/A ARG 17.A NH1 ASP 42.A OD2 no hydrogen 3.367 N/A MET 18.A N CYS 14.A O no hydrogen 2.857 N/A GLN 19.A N TYR 15.A O no hydrogen 3.203 N/A GLN 20.A N ASP 16.A O no hydrogen 3.227 N/A LEU 21.A N ARG 17.A O no hydrogen 3.223 N/A CYS 31.A N THR 44.A O no hydrogen 3.106 N/A ARG 33.A NH2 PRO 22.A O no hydrogen 3.051 N/A ASP 36.A N LEU 39.A O no hydrogen 3.197 N/A TRP 38.A N ASP 36.A OD1 no hydrogen 2.775 N/A LEU 39.A N ASP 36.A OD1 no hydrogen 2.622 N/A CYS 40.A SG TRP 41.A O no hydrogen 3.538 N/A VAL 48.A N PRO 45.A O no hydrogen 3.285 N/A SER 50.A N LYS 69.A O no hydrogen 3.376 N/A GLN 52.A N VAL 67.A O no hydrogen 2.601 N/A GLN 52.A NE2 CYS 40.A O no hydrogen 3.229 N/A CYS 54.A SG PRO 55.A O no hydrogen 3.823 N/A TYR 57.A OH TRP 38.A O no hydrogen 3.045 N/A PHE 61.A N PHE 58.A O no hydrogen 3.192 N/A SER 64.A N ASP 62.A OD1 no hydrogen 3.488 N/A SER 64.A OG ASP 62.A OD1 no hydrogen 3.556 N/A SER 64.A OG ASP 62.A OD2 no hydrogen 3.103 N/A SER 64.A OG GLU 65.A OE1 no hydrogen 3.539 N/A GLU 65.A N ASP 62.A O no hydrogen 3.210 N/A VAL 67.A N GLN 52.A O no hydrogen 2.369 N/A THR 68.A OG1 SER 50.A O no hydrogen 3.217 N/A LYS 69.A NZ THR 86.A OG1 no hydrogen 3.199 N/A LYS 69.A NZ TRP 87.A O no hydrogen 2.991 N/A LYS 69.A NZ SER 88.A OG no hydrogen 2.889 N/A CYS 71.A SG THR 44.A OG1 no hydrogen 3.154 N/A LYS 74.A N ASP 72.A OD2 no hydrogen 3.434 N/A TRP 77.A NE1 ASN 32.A O no hydrogen 2.923 N/A PHE 78.A N TYR 70.A O no hydrogen 2.626 N/A HIS 80.A N ARG 85.A O no hydrogen 3.065 N/A GLU 82.A N HIS 80.A ND1 no hydrogen 3.442 N/A ARG 85.A NE THR 86.A O no hydrogen 3.448 N/A TRP 87.A N PHE 78.A O no hydrogen 3.483 N/A ASN 89.A N THR 68.A O no hydrogen 3.147 N/A TYR 90.A OH ASP 36.A OD1 no hydrogen 2.830 N/A THR 91.A N ASN 89.A OD1 no hydrogen 3.361 N/A THR 91.A OG1 ASN 89.A OD1 no hydrogen 3.341 N/A ASN 94.A N THR 91.A O no hydrogen 3.241 N/A THR 97.A OG1 ASP 60.A O no hydrogen 3.251 N/A THR 97.A OG1 CYS 93.A O no hydrogen 2.692 N/A LYS 100.A N PHE 96.A O no hydrogen 3.296 N/A LEU 101.A N THR 97.A O no hydrogen 3.192 N/A LYS 102.A N PRO 98.A O no hydrogen 3.249 N/A ASN 103.A N GLU 99.A O no hydrogen 2.966 N/A ALA 104.A N LYS 100.A O no hydrogen 2.958 N/A TYR 105.A N LEU 101.A O no hydrogen 3.110 N/A TYR 105.A N LYS 102.A O no hydrogen 3.156 N/A LEU 107.A N ASN 103.A O no hydrogen 3.153 N/A TYR 108.A N ALA 104.A O no hydrogen 2.739 N/A TYR 108.A OH LEU 161.A O no hydrogen 2.973 N/A TYR 109.A N TYR 105.A O no hydrogen 2.934 N/A LEU 110.A N VAL 106.A O no hydrogen 2.858 N/A ALA 111.A N LEU 107.A O no hydrogen 3.185 N/A ILE 112.A N TYR 108.A O no hydrogen 3.080 N/A VAL 113.A N TYR 109.A O no hydrogen 2.959 N/A GLY 114.A N LEU 110.A O no hydrogen 2.662 N/A HIS 115.A N ALA 111.A O no hydrogen 3.123 N/A HIS 115.A ND1 SER 154.A OG no hydrogen 2.960 N/A HIS 115.A NE2 HIS 340.A ND1 no hydrogen 3.089 N/A SER 116.A N ILE 112.A O no hydrogen 3.315 N/A SER 116.A OG ILE 112.A O no hydrogen 2.630 N/A LEU 117.A N VAL 113.A O no hydrogen 2.946 N/A SER 118.A N GLY 114.A O no hydrogen 3.249 N/A SER 118.A OG GLY 114.A O no hydrogen 2.680 N/A SER 118.A OG HIS 340.A O no hydrogen 3.250 N/A ILE 119.A N HIS 115.A O no hydrogen 3.026 N/A PHE 120.A N SER 116.A O no hydrogen 3.037 N/A THR 121.A N LEU 117.A O no hydrogen 3.227 N/A THR 121.A OG1 LEU 117.A O no hydrogen 3.067 N/A THR 121.A OG1 SER 118.A O no hydrogen 2.895 N/A LEU 122.A N SER 118.A O no hydrogen 2.660 N/A VAL 123.A N ILE 119.A O no hydrogen 3.012 N/A SER 125.A N THR 121.A O no hydrogen 2.799 N/A LEU 126.A N LEU 122.A O no hydrogen 2.629 N/A GLY 127.A N VAL 123.A O no hydrogen 2.908 N/A ILE 128.A N ILE 124.A O no hydrogen 3.193 N/A PHE 129.A N SER 125.A O no hydrogen 3.423 N/A VAL 130.A N LEU 126.A O no hydrogen 3.158 N/A PHE 131.A N GLY 127.A O no hydrogen 2.966 N/A PHE 132.A N ILE 128.A O no hydrogen 3.001 N/A GLY 136.A N ARG 133.A O no hydrogen 3.226 N/A CYS 137.A SG LEU 135.A O no hydrogen 3.652 N/A GLN 138.A NE2 TYR 202.A OH no hydrogen 3.496 N/A THR 141.A N CYS 137.A O no hydrogen 2.863 N/A THR 141.A OG1 CYS 137.A O no hydrogen 2.557 N/A LEU 142.A N GLN 138.A O no hydrogen 3.211 N/A HIS 143.A N ARG 139.A O no hydrogen 3.034 N/A HIS 143.A ND1 GLU 199.A OE2 no hydrogen 3.226 N/A LYS 144.A N VAL 140.A O no hydrogen 2.817 N/A ASN 145.A N THR 141.A O no hydrogen 3.357 N/A ASN 145.A ND2 THR 141.A O no hydrogen 2.355 N/A MET 146.A N LEU 142.A O no hydrogen 2.825 N/A PHE 147.A N HIS 143.A O no hydrogen 2.701 N/A LEU 148.A N LYS 144.A O no hydrogen 2.999 N/A THR 149.A N ASN 145.A O no hydrogen 3.272 N/A THR 149.A OG1 ASN 145.A O no hydrogen 3.566 N/A THR 149.A OG1 MET 146.A O no hydrogen 2.385 N/A TYR 150.A N MET 146.A O no hydrogen 3.402 N/A ILE 151.A N PHE 147.A O no hydrogen 3.143 N/A LEU 152.A N LEU 148.A O no hydrogen 3.047 N/A ASN 153.A N THR 149.A O no hydrogen 2.948 N/A SER 154.A N TYR 150.A O no hydrogen 2.957 N/A SER 154.A OG HIS 115.A ND1 no hydrogen 2.960 N/A SER 154.A OG TYR 150.A O no hydrogen 2.708 N/A MET 155.A N ILE 151.A O no hydrogen 2.990 N/A ILE 156.A N LEU 152.A O no hydrogen 3.265 N/A ILE 157.A N ASN 153.A O no hydrogen 3.109 N/A ILE 158.A N SER 154.A O no hydrogen 2.974 N/A ILE 159.A N MET 155.A O no hydrogen 3.118 N/A HIS 160.A N ILE 156.A O no hydrogen 2.772 N/A LEU 161.A N ILE 157.A O no hydrogen 2.957 N/A VAL 162.A N ILE 159.A O no hydrogen 3.277 N/A VAL 165.A N HIS 160.A O no hydrogen 3.218 N/A ARG 173.A N GLU 169.A O no hydrogen 3.401 N/A ASP 174.A N LEU 170.A O no hydrogen 3.294 N/A CYS 178.A N PRO 175.A O no hydrogen 3.254 N/A LYS 179.A N VAL 176.A O no hydrogen 2.839 N/A LYS 179.A NZ ASN 245.A OD1 no hydrogen 3.275 N/A ILE 180.A N VAL 176.A O no hydrogen 3.066 N/A LEU 181.A N SER 177.A O no hydrogen 3.308 N/A PHE 183.A N LYS 179.A O no hydrogen 2.805 N/A PHE 184.A N ILE 180.A O no hydrogen 3.037 N/A HIS 185.A N LEU 181.A O no hydrogen 2.876 N/A GLN 186.A N HIS 182.A O no hydrogen 3.189 N/A GLN 186.A NE2 HIS 236.A NE2 no hydrogen 3.253 N/A TYR 187.A N PHE 183.A O no hydrogen 3.154 N/A TYR 187.A OH TRP 226.A O no hydrogen 3.083 N/A MET 188.A N PHE 184.A O no hydrogen 3.052 N/A MET 189.A N HIS 185.A O no hydrogen 3.108 N/A ALA 190.A N GLN 186.A O no hydrogen 3.038 N/A CYS 191.A N TYR 187.A O no hydrogen 2.869 N/A CYS 191.A SG TYR 187.A O no hydrogen 3.223 N/A CYS 191.A SG GLY 225.A O no hydrogen 3.262 N/A ASN 192.A N MET 188.A O no hydrogen 2.886 N/A ASN 192.A ND2 THR 149.A OG1 no hydrogen 3.211 N/A TYR 193.A N MET 189.A O no hydrogen 3.084 N/A PHE 194.A N ALA 190.A O no hydrogen 2.676 N/A TRP 195.A N CYS 191.A O no hydrogen 2.986 N/A MET 196.A N TYR 193.A O no hydrogen 3.291 N/A CYS 198.A N PHE 194.A O no hydrogen 3.247 N/A CYS 198.A SG PHE 194.A O no hydrogen 3.509 N/A CYS 198.A SG TYR 221.A O no hydrogen 3.477 N/A GLU 199.A N TRP 195.A O no hydrogen 3.028 N/A GLY 200.A N MET 196.A O no hydrogen 2.987 N/A ILE 201.A N LEU 197.A O no hydrogen 2.722 N/A TYR 202.A N CYS 198.A O no hydrogen 3.044 N/A LEU 203.A N GLU 199.A O no hydrogen 3.140 N/A HIS 204.A N GLY 200.A O no hydrogen 2.829 N/A THR 205.A N ILE 201.A O no hydrogen 3.022 N/A THR 205.A OG1 ILE 201.A O no hydrogen 2.485 N/A LEU 206.A N TYR 202.A O no hydrogen 3.431 N/A ILE 207.A N LEU 203.A O no hydrogen 3.284 N/A VAL 208.A N HIS 204.A O no hydrogen 3.068 N/A VAL 209.A N HIS 204.A O no hydrogen 3.211 N/A ALA 210.A N THR 205.A O no hydrogen 2.510 N/A THR 213.A N VAL 211.A O no hydrogen 3.046 N/A GLN 216.A N GLN 138.A OE1 no hydrogen 2.867 N/A TYR 221.A N LEU 218.A O no hydrogen 3.225 N/A TYR 222.A N LEU 218.A O no hydrogen 3.102 N/A LEU 223.A N ARG 219.A O no hydrogen 3.053 N/A LEU 224.A N TRP 220.A O no hydrogen 3.101 N/A GLY 225.A N TYR 221.A O no hydrogen 2.934 N/A TRP 226.A N TYR 222.A O no hydrogen 2.928 N/A PHE 228.A N LEU 223.A O no hydrogen 2.586 N/A LEU 230.A N GLY 227.A O no hydrogen 3.262 N/A VAL 231.A N PHE 228.A O no hydrogen 2.914 N/A THR 233.A N PRO 229.A O no hydrogen 3.458 N/A THR 233.A OG1 PRO 229.A O no hydrogen 2.981 N/A THR 234.A N LEU 230.A O no hydrogen 3.064 N/A THR 234.A OG1 LEU 230.A O no hydrogen 2.610 N/A ILE 235.A N VAL 231.A O no hydrogen 3.221 N/A HIS 236.A N PRO 232.A O no hydrogen 3.140 N/A ALA 237.A N THR 233.A O no hydrogen 2.942 N/A ILE 238.A N THR 234.A O no hydrogen 3.013 N/A THR 239.A N ILE 235.A O no hydrogen 3.180 N/A THR 239.A OG1 ILE 235.A O no hydrogen 3.259 N/A THR 239.A OG1 HIS 236.A O no hydrogen 2.767 N/A ARG 240.A N HIS 236.A O no hydrogen 3.063 N/A ARG 240.A NE PHE 244.A O no hydrogen 2.750 N/A ALA 241.A N ALA 237.A O no hydrogen 3.219 N/A VAL 242.A N THR 239.A O no hydrogen 3.378 N/A TYR 243.A N THR 239.A O no hydrogen 2.953 N/A ASN 247.A ND2 VAL 171.A O no hydrogen 3.594 N/A TRP 249.A N ASP 246.A O no hydrogen 3.173 N/A LEU 250.A N ASN 247.A O no hydrogen 3.348 N/A GLU 253.A N SER 251.A OG no hydrogen 3.232 N/A LEU 256.A N THR 254.A OG1 no hydrogen 3.144 N/A TYR 258.A N HIS 255.A O no hydrogen 3.441 N/A ILE 259.A N LEU 256.A O no hydrogen 3.467 N/A HIS 261.A N LEU 257.A O no hydrogen 3.232 N/A GLY 262.A N TYR 258.A O no hydrogen 3.193 N/A VAL 264.A N ILE 260.A O no hydrogen 3.027 N/A MET 265.A N HIS 261.A O no hydrogen 2.771 N/A ALA 266.A N GLY 262.A O no hydrogen 3.061 N/A ALA 267.A N PRO 263.A O no hydrogen 3.085 N/A LEU 268.A N VAL 264.A O no hydrogen 3.064 N/A VAL 269.A N MET 265.A O no hydrogen 3.134 N/A ASN 271.A N ALA 267.A O no hydrogen 3.387 N/A ASN 271.A ND2 MET 196.A O no hydrogen 2.817 N/A ASN 271.A ND2 LEU 311.A O no hydrogen 3.071 N/A PHE 272.A N LEU 268.A O no hydrogen 3.072 N/A PHE 273.A N VAL 269.A O no hydrogen 2.918 N/A PHE 274.A N VAL 270.A O no hydrogen 2.863 N/A LEU 275.A N ASN 271.A O no hydrogen 2.883 N/A LEU 276.A N PHE 272.A O no hydrogen 3.203 N/A ASN 277.A N PHE 273.A O no hydrogen 3.333 N/A ILE 278.A N PHE 274.A O no hydrogen 2.995 N/A VAL 279.A N LEU 275.A O no hydrogen 3.021 N/A ARG 280.A N LEU 276.A O no hydrogen 3.129 N/A ARG 280.A NH1 ASN 277.A OD1 no hydrogen 2.625 N/A VAL 281.A N ASN 277.A O no hydrogen 3.171 N/A LEU 282.A N ILE 278.A O no hydrogen 3.001 N/A VAL 283.A N VAL 279.A O no hydrogen 2.917 N/A THR 284.A N ARG 280.A O no hydrogen 3.232 N/A THR 284.A OG1 ARG 280.A O no hydrogen 2.813 N/A LYS 285.A N VAL 281.A O no hydrogen 2.990 N/A MET 286.A N LEU 282.A O no hydrogen 3.233 N/A ARG 287.A N VAL 283.A O no hydrogen 3.095 N/A GLU 288.A N THR 284.A O no hydrogen 3.242 N/A THR 289.A OG1 LYS 285.A O no hydrogen 3.333 N/A THR 289.A OG1 MET 286.A O no hydrogen 2.889 N/A HIS 290.A N ARG 287.A O no hydrogen 3.079 N/A GLU 291.A N MET 286.A O no hydrogen 3.212 N/A MET 296.A N ALA 292.A O no hydrogen 2.819 N/A TYR 297.A N GLU 293.A O no hydrogen 3.186 N/A LEU 298.A N SER 294.A O no hydrogen 3.204 N/A LYS 299.A N HIS 295.A O no hydrogen 3.129 N/A ALA 300.A N MET 296.A O no hydrogen 3.173 N/A VAL 301.A N TYR 297.A O no hydrogen 2.987 N/A LYS 302.A N LEU 298.A O no hydrogen 3.243 N/A ALA 303.A N LYS 299.A O no hydrogen 3.112 N/A THR 304.A N ALA 300.A O no hydrogen 2.989 N/A THR 304.A OG1 ALA 300.A O no hydrogen 2.550 N/A MET 305.A N VAL 301.A O no hydrogen 3.019 N/A ILE 306.A N LYS 302.A O no hydrogen 3.234 N/A LEU 307.A N ALA 303.A O no hydrogen 3.392 N/A LEU 311.A N LEU 307.A O no hydrogen 3.113 N/A ILE 313.A N VAL 308.A O no hydrogen 3.147 N/A GLN 314.A N GLN 314.A OE1 no hydrogen 2.671 N/A VAL 316.A N ILE 313.A O no hydrogen 2.963 N/A VAL 317.A N ILE 313.A O no hydrogen 3.133 N/A PHE 318.A N GLN 314.A O no hydrogen 3.370 N/A ARG 321.A NE ASP 332.A OD1 no hydrogen 3.178 N/A ARG 321.A NE ASP 332.A OD2 no hydrogen 3.439 N/A ARG 321.A NH1 ASP 332.A OD2 no hydrogen 3.377 N/A MET 326.A N ASN 324.A OD1 no hydrogen 2.755 N/A LEU 327.A N ASN 324.A OD1 no hydrogen 3.090 N/A GLY 328.A N ASN 324.A O no hydrogen 2.753 N/A LYS 329.A N LYS 325.A O no hydrogen 3.105 N/A ILE 330.A N MET 326.A O no hydrogen 3.464 N/A TYR 331.A N LEU 327.A O no hydrogen 2.998 N/A TYR 331.A OH PHE 318.A O no hydrogen 2.831 N/A ASP 332.A N GLY 328.A O no hydrogen 2.995 N/A TYR 333.A N LYS 329.A O no hydrogen 2.981 N/A VAL 334.A N ILE 330.A O no hydrogen 3.057 N/A MET 335.A N TYR 331.A O no hydrogen 2.915 N/A HIS 336.A N ASP 332.A O no hydrogen 3.180 N/A HIS 336.A ND1 HIS 340.A NE2 no hydrogen 3.030 N/A SER 337.A N TYR 333.A O no hydrogen 3.331 N/A SER 337.A OG TYR 333.A O no hydrogen 2.666 N/A LEU 338.A N VAL 334.A O no hydrogen 2.921 N/A LEU 338.A N MET 335.A O no hydrogen 3.107 N/A ILE 339.A N MET 335.A O no hydrogen 2.815 N/A HIS 340.A N HIS 336.A O no hydrogen 3.172 N/A HIS 340.A NE2 HIS 336.A ND1 no hydrogen 3.030 N/A GLN 342.A N ILE 339.A O no hydrogen 3.347 N/A GLN 342.A NE2 PRO 309.A O no hydrogen 2.735 N/A PHE 345.A N PHE 341.A O no hydrogen 3.074 N/A VAL 346.A N GLN 342.A O no hydrogen 3.157 N/A ALA 347.A N GLY 343.A O no hydrogen 3.189 N/A THR 348.A N PHE 344.A O no hydrogen 3.129 N/A THR 348.A OG1 PHE 344.A O no hydrogen 2.684 N/A ILE 349.A N PHE 345.A O no hydrogen 2.923 N/A TYR 350.A N VAL 346.A O no hydrogen 3.083 N/A TYR 350.A OH ILE 306.A O no hydrogen 2.769 N/A CYS 351.A SG SER 125.A O no hydrogen 3.760 N/A CYS 351.A SG SER 125.A OG no hydrogen 3.286 N/A PHE 352.A N ALA 347.A O no hydrogen 3.178 N/A CYS 353.A N THR 348.A O no hydrogen 2.539 N/A CYS 353.A SG THR 348.A O no hydrogen 3.298 N/A GLU 356.A N GLU 356.A OE2 no hydrogen 3.142 N/A VAL 357.A N ASN 354.A OD1 no hydrogen 3.131 N/A GLN 358.A N ASN 354.A O no hydrogen 3.120 N/A GLN 358.A NE2 PHE 352.A O no hydrogen 2.723 N/A THR 359.A N ASN 355.A O no hydrogen 3.079 N/A THR 359.A OG1 ASN 355.A O no hydrogen 3.179 N/A THR 359.A OG1 GLU 356.A O no hydrogen 3.243 N/A THR 360.A OG1 GLU 356.A O no hydrogen 2.652 N/A VAL 361.A N VAL 357.A O no hydrogen 3.057 N/A LYS 362.A N GLN 358.A O no hydrogen 3.150 N/A LYS 362.A NZ GLN 358.A O no hydrogen 2.818 N/A GLN 364.A N THR 360.A O no hydrogen 3.379 N/A TRP 365.A N VAL 361.A O no hydrogen 2.893 N/A GLN 367.A N GLN 364.A O no hydrogen 3.142 N/A PHE 368.A N TRP 365.A O no hydrogen 3.383 N/A