Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8jis_R.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 1.A N GLU 5.A OE1 no hydrogen 3.504 N/A VAL 1.A N GLU 5.A OE2 no hydrogen 3.401 N/A SER 2.A OG GLU 5.A OE2 no hydrogen 2.909 N/A THR 6.A N SER 2.A O no hydrogen 2.947 N/A THR 6.A OG1 SER 2.A O no hydrogen 2.783 N/A THR 6.A OG1 GLU 5.A OE1 no hydrogen 3.048 N/A VAL 7.A N LEU 3.A O no hydrogen 2.906 N/A GLN 8.A N TRP 4.A O no hydrogen 2.894 N/A LYS 9.A N GLU 5.A O no hydrogen 2.872 N/A LYS 9.A NZ GLU 5.A OE1 no hydrogen 3.042 N/A LYS 9.A NZ TYR 59.A O no hydrogen 3.450 N/A TRP 10.A N THR 6.A O no hydrogen 2.865 N/A ARG 11.A N VAL 7.A O no hydrogen 2.926 N/A GLU 12.A N GLN 8.A O no hydrogen 3.074 N/A TYR 13.A N TRP 10.A O no hydrogen 2.932 N/A ARG 14.A N TRP 10.A O no hydrogen 3.105 N/A ARG 14.A N ARG 11.A O no hydrogen 3.097 N/A ARG 15.A N ARG 11.A O no hydrogen 3.267 N/A GLN 16.A N GLU 12.A O no hydrogen 2.939 N/A CYS 17.A N TYR 13.A O no hydrogen 2.899 N/A GLN 18.A N ARG 14.A O no hydrogen 2.813 N/A ARG 19.A N ARG 15.A O no hydrogen 2.982 N/A ARG 19.A N GLN 16.A O no hydrogen 3.121 N/A ARG 19.A NE GLN 16.A O no hydrogen 2.939 N/A SER 20.A N GLN 16.A O no hydrogen 3.014 N/A SER 20.A OG CYS 17.A O no hydrogen 2.943 N/A LEU 21.A N GLN 18.A O no hydrogen 3.154 N/A THR 22.A N ARG 19.A O no hydrogen 3.171 N/A THR 22.A OG1 GLN 18.A O no hydrogen 3.170 N/A THR 22.A OG1 ARG 19.A O no hydrogen 2.771 N/A GLU 23.A N ARG 19.A O no hydrogen 2.987 N/A ALA 28.A N ASP 45.A OD1 no hydrogen 3.128 N/A LEU 31.A N ASP 30.A OD1 no hydrogen 3.023 N/A CYS 33.A SG THR 76.A O no hydrogen 3.280 N/A ASN 34.A ND2 PRO 44.A O no hydrogen 2.916 N/A ARG 35.A NH1 LEU 80.A O no hydrogen 3.369 N/A THR 36.A OG1 PHE 37.A O no hydrogen 3.419 N/A CYS 42.A SG SER 20.A OG no hydrogen 3.381 N/A ASN 53.A ND2 VAL 71.A O no hydrogen 2.908 N/A CYS 56.A SG PRO 57.A O no hydrogen 3.971 N/A CYS 56.A SG VAL 66.A O no hydrogen 3.960 N/A TRP 58.A N TYR 13.A OH no hydrogen 3.219 N/A ALA 63.A N LEU 60.A O no hydrogen 3.226 N/A SER 64.A N PRO 61.A O no hydrogen 2.947 N/A SER 64.A OG LEU 60.A O no hydrogen 3.136 N/A SER 64.A OG PRO 61.A O no hydrogen 3.253 N/A HIS 70.A ND1 VAL 71.A O no hydrogen 3.277 N/A GLY 79.A N GLU 78.A OE2 no hydrogen 3.040 N/A TRP 81.A N GLN 83.A OE1 no hydrogen 3.088 N/A SER 87.A OG SER 87.A O no hydrogen 2.449 N/A SER 88.A N ASP 85.A O no hydrogen 3.103 N/A SER 88.A OG ASN 86.A O no hydrogen 3.325 N/A CYS 97.A SG GLY 69.A O no hydrogen 3.274 N/A PHE 106.A N GLU 102.A O no hydrogen 3.094 N/A LEU 107.A N GLN 103.A O no hydrogen 2.727 N/A TYR 108.A N LEU 104.A O no hydrogen 2.900 N/A ILE 109.A N LEU 105.A O no hydrogen 3.109 N/A ILE 110.A N PHE 106.A O no hydrogen 3.260 N/A TYR 111.A N LEU 107.A O no hydrogen 3.231 N/A TYR 111.A OH ASP 161.A OD1 no hydrogen 3.011 N/A TYR 111.A OH ASP 161.A OD2 no hydrogen 2.972 N/A THR 112.A N TYR 108.A O no hydrogen 3.147 N/A VAL 113.A N ILE 109.A O no hydrogen 3.167 N/A GLY 114.A N ILE 110.A O no hydrogen 3.335 N/A TYR 115.A N TYR 111.A O no hydrogen 2.826 N/A ALA 116.A N THR 112.A O no hydrogen 3.195 N/A LEU 117.A N VAL 113.A O no hydrogen 2.880 N/A SER 118.A N GLY 114.A O no hydrogen 2.587 N/A SER 118.A OG GLY 114.A O no hydrogen 2.890 N/A SER 118.A OG SER 355.A O no hydrogen 2.539 N/A PHE 119.A N TYR 115.A O no hydrogen 2.766 N/A SER 120.A N ALA 116.A O no hydrogen 3.110 N/A SER 120.A OG LEU 117.A O no hydrogen 3.303 N/A ALA 121.A N LEU 117.A O no hydrogen 3.191 N/A LEU 122.A N SER 118.A O no hydrogen 2.816 N/A VAL 123.A N PHE 119.A O no hydrogen 3.248 N/A ILE 124.A N SER 120.A O no hydrogen 3.470 N/A ALA 125.A N ALA 121.A O no hydrogen 2.661 N/A SER 126.A N LEU 122.A O no hydrogen 2.569 N/A ALA 127.A N VAL 123.A O no hydrogen 3.063 N/A ILE 128.A N ILE 124.A O no hydrogen 3.125 N/A LEU 129.A N ALA 125.A O no hydrogen 3.075 N/A LEU 130.A N SER 126.A O no hydrogen 3.031 N/A GLY 131.A N ALA 127.A O no hydrogen 2.689 N/A PHE 132.A N ILE 128.A O no hydrogen 3.374 N/A HIS 136.A N ARG 133.A O no hydrogen 3.351 N/A CYS 137.A SG LEU 135.A O no hydrogen 3.877 N/A ARG 139.A NH2 GLU 371.A OE2 no hydrogen 3.003 N/A TYR 141.A N CYS 137.A O no hydrogen 2.987 N/A ILE 142.A N THR 138.A O no hydrogen 3.156 N/A HIS 143.A N ARG 139.A O no hydrogen 3.111 N/A LEU 144.A N ASN 140.A O no hydrogen 2.752 N/A ASN 145.A N TYR 141.A O no hydrogen 3.039 N/A ASN 145.A ND2 TYR 141.A O no hydrogen 2.800 N/A LEU 146.A N ILE 142.A O no hydrogen 2.868 N/A PHE 147.A N HIS 143.A O no hydrogen 2.904 N/A ALA 148.A N LEU 144.A O no hydrogen 3.043 N/A SER 149.A N ASN 145.A O no hydrogen 3.100 N/A SER 149.A OG LEU 146.A O no hydrogen 2.597 N/A PHE 150.A N LEU 146.A O no hydrogen 3.078 N/A ILE 151.A N PHE 147.A O no hydrogen 2.799 N/A LEU 152.A N ALA 148.A O no hydrogen 2.747 N/A ARG 153.A N SER 149.A O no hydrogen 2.958 N/A ARG 153.A NE TYR 115.A OH no hydrogen 2.754 N/A ARG 153.A NH1 ASN 203.A OD1 no hydrogen 3.256 N/A ALA 154.A N PHE 150.A O no hydrogen 2.999 N/A LEU 155.A N ILE 151.A O no hydrogen 2.942 N/A SER 156.A N LEU 152.A O no hydrogen 2.908 N/A VAL 157.A N ARG 153.A O no hydrogen 3.020 N/A PHE 158.A N ALA 154.A O no hydrogen 3.232 N/A ILE 159.A N LEU 155.A O no hydrogen 3.158 N/A LYS 160.A N SER 156.A O no hydrogen 2.917 N/A LYS 160.A NZ ASP 161.A OD1 no hydrogen 3.005 N/A ASP 161.A N VAL 157.A O no hydrogen 3.079 N/A ASP 161.A N PHE 158.A O no hydrogen 3.249 N/A ALA 162.A N PHE 158.A O no hydrogen 3.014 N/A ALA 163.A N ILE 159.A O no hydrogen 2.834 N/A LEU 164.A N LYS 160.A O no hydrogen 2.925 N/A LYS 165.A N ASP 161.A O no hydrogen 2.988 N/A LYS 165.A NZ ASP 161.A O no hydrogen 3.060 N/A TRP 166.A N ALA 162.A O no hydrogen 2.713 N/A MET 167.A N ALA 163.A O no hydrogen 2.754 N/A MET 167.A N LEU 164.A O no hydrogen 3.300 N/A THR 170.A N LYS 165.A O no hydrogen 3.147 N/A THR 170.A OG1 LYS 165.A O no hydrogen 3.359 N/A ALA 172.A N TYR 168.A O no hydrogen 2.901 N/A GLN 173.A N SER 169.A O no hydrogen 3.143 N/A GLN 174.A N THR 170.A O no hydrogen 3.283 N/A HIS 175.A N ALA 172.A O no hydrogen 3.001 N/A ASP 178.A N GLN 176.A OE1 no hydrogen 2.723 N/A GLY 179.A N GLN 176.A OE1 no hydrogen 2.356 N/A SER 182.A N GLY 179.A O no hydrogen 2.933 N/A SER 182.A OG ASP 178.A O no hydrogen 2.847 N/A SER 182.A OG GLY 179.A O no hydrogen 3.381 N/A TYR 183.A N GLY 179.A O no hydrogen 2.959 N/A GLN 184.A N LEU 180.A O no hydrogen 2.902 N/A GLN 184.A NE2 MET 167.A O no hydrogen 3.508 N/A ASP 185.A N SER 182.A O no hydrogen 3.079 N/A SER 186.A N TYR 183.A O no hydrogen 3.233 N/A SER 186.A OG TYR 183.A O no hydrogen 3.118 N/A CYS 189.A N SER 186.A O no hydrogen 3.061 N/A CYS 189.A N SER 186.A OG no hydrogen 3.157 N/A ARG 190.A NE ASP 256.A OD1 no hydrogen 2.914 N/A ARG 190.A NH1 GLN 184.A O no hydrogen 2.886 N/A ARG 190.A NH1 SER 186.A O no hydrogen 3.176 N/A ARG 190.A NH2 GLN 184.A O no hydrogen 3.044 N/A LEU 191.A N LEU 187.A O no hydrogen 3.365 N/A VAL 192.A N CYS 189.A O no hydrogen 3.111 N/A LEU 194.A N ARG 190.A O no hydrogen 2.967 N/A LEU 195.A N LEU 191.A O no hydrogen 2.961 N/A MET 196.A N VAL 192.A O no hydrogen 3.378 N/A GLN 197.A N PHE 193.A O no hydrogen 3.282 N/A TYR 198.A N LEU 194.A O no hydrogen 3.252 N/A TYR 198.A OH TRP 237.A O no hydrogen 3.146 N/A CYS 199.A N LEU 195.A O no hydrogen 2.848 N/A CYS 199.A SG LEU 152.A O no hydrogen 3.617 N/A VAL 200.A N MET 196.A O no hydrogen 2.905 N/A ALA 201.A N GLN 197.A O no hydrogen 2.924 N/A ALA 202.A N TYR 198.A O no hydrogen 2.728 N/A ASN 203.A N CYS 199.A O no hydrogen 3.019 N/A ASN 203.A ND2 SER 149.A OG no hydrogen 3.300 N/A TYR 204.A N VAL 200.A O no hydrogen 3.078 N/A TYR 204.A OH GLU 327.A OE1 no hydrogen 2.861 N/A TYR 205.A N ALA 201.A O no hydrogen 2.976 N/A TRP 206.A N ALA 202.A O no hydrogen 2.817 N/A LEU 207.A N ASN 203.A O no hydrogen 3.156 N/A LEU 207.A N TYR 204.A O no hydrogen 3.225 N/A LEU 208.A N TYR 205.A O no hydrogen 3.046 N/A VAL 209.A N TYR 205.A O no hydrogen 2.875 N/A VAL 212.A N LEU 208.A O no hydrogen 3.313 N/A TYR 215.A N GLY 211.A O no hydrogen 3.279 N/A THR 216.A N VAL 212.A O no hydrogen 3.320 N/A THR 216.A OG1 VAL 212.A O no hydrogen 3.171 N/A THR 216.A OG1 TYR 213.A O no hydrogen 2.419 N/A THR 216.A OG1 TYR 232.A OH no hydrogen 3.262 N/A LEU 217.A N TYR 213.A O no hydrogen 3.044 N/A LEU 217.A N LEU 214.A O no hydrogen 3.248 N/A LEU 218.A N LEU 214.A O no hydrogen 3.378 N/A LEU 218.A N TYR 215.A O no hydrogen 3.113 N/A ILE 228.A N SER 224.A O no hydrogen 2.968 N/A PHE 229.A N GLU 225.A O no hydrogen 3.089 N/A ARG 230.A N GLN 226.A O no hydrogen 3.194 N/A LEU 231.A N TRP 227.A O no hydrogen 3.179 N/A TYR 232.A N ILE 228.A O no hydrogen 2.862 N/A TYR 232.A OH THR 216.A OG1 no hydrogen 3.262 N/A VAL 233.A N PHE 229.A O no hydrogen 2.875 N/A SER 234.A N ARG 230.A O no hydrogen 2.921 N/A ILE 235.A N LEU 231.A O no hydrogen 2.791 N/A GLY 236.A N TYR 232.A O no hydrogen 2.834 N/A TRP 237.A N VAL 233.A O no hydrogen 3.044 N/A TRP 237.A NE1 ASN 145.A OD1 no hydrogen 3.187 N/A GLY 238.A N SER 234.A O no hydrogen 2.752 N/A VAL 239.A N SER 234.A O no hydrogen 3.358 N/A LEU 242.A N VAL 239.A O no hydrogen 2.864 N/A PHE 243.A N PRO 240.A O no hydrogen 3.330 N/A VAL 244.A N PRO 240.A O no hydrogen 2.977 N/A TRP 247.A N PHE 243.A O no hydrogen 3.422 N/A GLY 248.A N VAL 244.A O no hydrogen 3.082 N/A ILE 249.A N VAL 245.A O no hydrogen 2.999 N/A VAL 250.A N PRO 246.A O no hydrogen 3.068 N/A LYS 251.A N TRP 247.A O no hydrogen 3.009 N/A LYS 251.A NZ GLU 255.A OE2 no hydrogen 3.191 N/A LYS 251.A NZ ARG 262.A O no hydrogen 3.360 N/A TYR 252.A N GLY 248.A O no hydrogen 2.889 N/A LEU 253.A N ILE 249.A O no hydrogen 2.991 N/A TYR 254.A N VAL 250.A O no hydrogen 2.780 N/A GLU 255.A N LYS 251.A O no hydrogen 2.881 N/A CYS 259.A SG TYR 183.A O no hydrogen 3.869 N/A CYS 259.A SG GLN 184.A O no hydrogen 4.006 N/A TRP 260.A NE1 ASP 256.A OD1 no hydrogen 2.806 N/A THR 261.A N GLY 258.A O no hydrogen 3.155 N/A THR 261.A OG1 GLY 258.A O no hydrogen 2.872 N/A ARG 262.A NH1 TYR 168.A OH no hydrogen 3.255 N/A SER 264.A OG GLU 257.A OE1 no hydrogen 3.107 N/A SER 264.A OG GLU 257.A OE2 no hydrogen 3.322 N/A ASN 265.A N GLU 255.A OE1 no hydrogen 3.176 N/A TRP 269.A N ASN 265.A O no hydrogen 3.323 N/A LEU 270.A N ASN 267.A O no hydrogen 3.137 N/A ILE 271.A N TYR 268.A O no hydrogen 3.291 N/A ARG 273.A N TRP 269.A O no hydrogen 3.291 N/A LEU 274.A N LEU 270.A O no hydrogen 2.961 N/A ILE 276.A N ILE 272.A O no hydrogen 3.325 N/A LEU 277.A N ARG 273.A O no hydrogen 2.943 N/A PHE 278.A N LEU 274.A O no hydrogen 2.914 N/A ALA 279.A N PRO 275.A O no hydrogen 3.033 N/A ILE 280.A N ILE 276.A O no hydrogen 3.006 N/A GLY 281.A N LEU 277.A O no hydrogen 2.878 N/A VAL 282.A N PHE 278.A O no hydrogen 3.073 N/A ASN 283.A N ALA 279.A O no hydrogen 3.173 N/A ASN 283.A ND2 LEU 207.A O no hydrogen 2.750 N/A ASN 283.A ND2 LEU 323.A O no hydrogen 2.634 N/A PHE 284.A N ILE 280.A O no hydrogen 3.031 N/A LEU 285.A N GLY 281.A O no hydrogen 3.165 N/A ILE 286.A N VAL 282.A O no hydrogen 3.026 N/A PHE 287.A N ASN 283.A O no hydrogen 2.843 N/A VAL 288.A N PHE 284.A O no hydrogen 2.964 N/A ARG 289.A N LEU 285.A O no hydrogen 3.013 N/A VAL 290.A N ILE 286.A O no hydrogen 2.896 N/A ILE 291.A N PHE 287.A O no hydrogen 3.165 N/A CYS 292.A N VAL 288.A O no hydrogen 2.875 N/A CYS 292.A SG VAL 288.A O no hydrogen 3.448 N/A ILE 293.A N ARG 289.A O no hydrogen 2.937 N/A VAL 294.A N VAL 290.A O no hydrogen 2.848 N/A VAL 295.A N ILE 291.A O no hydrogen 2.917 N/A SER 296.A N CYS 292.A O no hydrogen 3.074 N/A LYS 297.A N ILE 293.A O no hydrogen 3.008 N/A LEU 298.A N VAL 294.A O no hydrogen 3.054 N/A LYS 299.A N VAL 295.A O no hydrogen 3.011 N/A ASN 301.A N LEU 298.A O no hydrogen 3.097 N/A LEU 302.A N ALA 300.A O no hydrogen 2.710 N/A LYS 309.A N THR 306.A O no hydrogen 2.747 N/A ARG 311.A N ASP 307.A O no hydrogen 2.970 N/A ARG 311.A NE ARG 311.A O no hydrogen 3.242 N/A LEU 312.A N ILE 308.A O no hydrogen 2.708 N/A ALA 313.A N LYS 309.A O no hydrogen 2.904 N/A LYS 314.A N CYS 310.A O no hydrogen 2.866 N/A SER 315.A N ARG 311.A O no hydrogen 2.817 N/A SER 315.A N LEU 312.A O no hydrogen 3.217 N/A SER 315.A OG ARG 311.A O no hydrogen 3.539 N/A THR 316.A N LEU 312.A O no hydrogen 2.935 N/A THR 316.A OG1 LEU 312.A O no hydrogen 2.303 N/A LEU 317.A N ALA 313.A O no hydrogen 3.394 N/A THR 318.A OG1 LYS 314.A O no hydrogen 3.427 N/A THR 318.A OG1 SER 315.A O no hydrogen 3.062 N/A LEU 319.A N THR 316.A O no hydrogen 3.388 N/A LEU 323.A N ILE 320.A O no hydrogen 3.207 N/A THR 325.A N ILE 320.A O no hydrogen 3.463 N/A GLU 327.A N GLY 324.A O no hydrogen 3.374 N/A VAL 328.A N THR 325.A O no hydrogen 3.062 N/A ALA 331.A N VAL 328.A O no hydrogen 3.264 N/A ARG 339.A NH2 HIS 337.A O no hydrogen 2.939 N/A ARG 343.A N GLY 340.A O no hydrogen 3.231 N/A ARG 343.A NE ALA 338.A O no hydrogen 2.801 N/A ARG 343.A NH2 ALA 338.A O no hydrogen 3.477 N/A ILE 345.A N THR 341.A O no hydrogen 3.107 N/A LYS 346.A N LEU 342.A O no hydrogen 2.869 N/A LYS 346.A NZ PHE 330.A O no hydrogen 3.085 N/A LYS 346.A NZ MET 334.A O no hydrogen 2.933 N/A LYS 346.A NZ GLU 350.A OE1 no hydrogen 3.074 N/A LEU 347.A N ARG 343.A O no hydrogen 2.800 N/A PHE 348.A N PHE 344.A O no hydrogen 2.794 N/A THR 349.A N ILE 345.A O no hydrogen 3.215 N/A LEU 351.A N LEU 347.A O no hydrogen 2.913 N/A SER 352.A N PHE 348.A O no hydrogen 3.069 N/A SER 352.A OG PHE 348.A O no hydrogen 2.578 N/A PHE 353.A N THR 349.A O no hydrogen 3.111 N/A THR 354.A N GLU 350.A O no hydrogen 3.008 N/A THR 354.A OG1 GLU 350.A O no hydrogen 2.887 N/A SER 355.A N LEU 351.A O no hydrogen 3.076 N/A SER 355.A OG LEU 351.A O no hydrogen 2.925 N/A SER 355.A OG SER 352.A O no hydrogen 2.671 N/A PHE 356.A N SER 352.A O no hydrogen 3.034 N/A GLN 357.A N THR 354.A O no hydrogen 3.161 N/A GLN 357.A NE2 PRO 321.A O no hydrogen 2.731 N/A LEU 359.A N SER 118.A OG no hydrogen 2.949 N/A MET 360.A N PHE 356.A O no hydrogen 3.117 N/A VAL 361.A N GLN 357.A O no hydrogen 2.879 N/A ALA 362.A N GLY 358.A O no hydrogen 2.932 N/A ILE 363.A N LEU 359.A O no hydrogen 2.963 N/A LEU 364.A N MET 360.A O no hydrogen 2.879 N/A TYR 365.A N VAL 361.A O no hydrogen 3.101 N/A TYR 365.A OH THR 318.A O no hydrogen 2.603 N/A CYS 366.A SG ALA 125.A O no hydrogen 3.223 N/A PHE 367.A N ILE 363.A O no hydrogen 3.190 N/A VAL 368.A N ILE 363.A O no hydrogen 3.140 N/A GLN 373.A N ASN 369.A O no hydrogen 3.053 N/A LEU 374.A N ASN 370.A O no hydrogen 2.823 N/A GLU 375.A N GLU 371.A O no hydrogen 3.070 N/A PHE 376.A N VAL 372.A O no hydrogen 2.728 N/A ARG 377.A N GLN 373.A O no hydrogen 2.874 N/A LYS 378.A N LEU 374.A O no hydrogen 2.969 N/A LYS 378.A NZ GLU 375.A OE1 no hydrogen 3.275 N/A SER 379.A N GLU 375.A O no hydrogen 2.959 N/A TRP 380.A N PHE 376.A O no hydrogen 2.919 N/A GLU 381.A N ARG 377.A O no hydrogen 2.974 N/A ARG 382.A N LYS 378.A O no hydrogen 2.748 N/A TRP 383.A N SER 379.A O no hydrogen 3.048 N/A ARG 384.A N TRP 380.A O no hydrogen 2.885 N/A LEU 385.A N GLU 381.A O no hydrogen 3.259 N/A