Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2wxz_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 6.A N PHE 3.A O no hydrogen 2.712 N/A TYR 8.A N ARG 127.A O no hydrogen 3.153 N/A SER 9.A N THR 12.A OG1 no hydrogen 3.238 N/A SER 9.A OG THR 12.A OG1 no hydrogen 3.105 N/A THR 12.A OG1 SER 9.A O no hydrogen 3.009 N/A THR 12.A OG1 SER 9.A OG no hydrogen 3.105 N/A CYS 13.A N SER 9.A O no hydrogen 2.677 N/A ALA 14.A N LYS 10.A O no hydrogen 2.763 N/A PHE 22.A N LEU 164.A O no hydrogen 2.827 N/A ILE 27.A N SER 183.A O no hydrogen 2.987 N/A GLN 28.A N GLN 28.A OE1 no hydrogen 3.070 N/A ALA 29.A N PRO 26.A O no hydrogen 2.836 N/A THR 31.A OG1 ALA 29.A O no hydrogen 3.090 N/A VAL 34.A N VAL 204.A O no hydrogen 2.777 N/A LYS 37.A N ASP 35.A OD1 no hydrogen 3.223 N/A THR 38.A OG1 ASP 35.A OD2 no hydrogen 2.511 N/A LEU 39.A N ASP 35.A O no hydrogen 3.290 N/A ARG 40.A N GLU 36.A O no hydrogen 3.087 N/A ARG 40.A NE LEU 148.A O no hydrogen 2.870 N/A ASP 41.A N LYS 37.A O no hydrogen 3.048 N/A LYS 42.A N THR 38.A O no hydrogen 3.247 N/A LEU 43.A N LEU 39.A O no hydrogen 3.243 N/A VAL 44.A N ARG 40.A O no hydrogen 2.810 N/A LEU 45.A N ASP 41.A O no hydrogen 3.070 N/A ALA 46.A N LYS 42.A O no hydrogen 2.842 N/A THR 47.A N LEU 43.A O no hydrogen 3.093 N/A THR 47.A N VAL 44.A O no hydrogen 2.737 N/A THR 47.A OG1 VAL 44.A O no hydrogen 2.638 N/A GLU 48.A N VAL 44.A O no hydrogen 2.966 N/A LEU 50.A N THR 47.A O no hydrogen 3.017 N/A GLU 51.A N ASP 54.A OD1 no hydrogen 2.795 N/A ARG 55.A N GLU 51.A O no hydrogen 3.116 N/A ARG 55.A NH1 LEU 50.A O no hydrogen 2.932 N/A GLN 56.A N ALA 52.A O no hydrogen 2.978 N/A ARG 57.A N GLU 53.A O no hydrogen 2.802 N/A ALA 58.A N ASP 54.A O no hydrogen 3.026 N/A ALA 59.A N ARG 55.A O no hydrogen 2.997 N/A GLN 60.A N GLN 56.A O no hydrogen 3.220 N/A VAL 61.A N ARG 57.A O no hydrogen 3.159 N/A ALA 62.A N ALA 58.A O no hydrogen 3.078 N/A MET 63.A N ALA 59.A O no hydrogen 3.328 N/A ILE 64.A N GLN 60.A O no hydrogen 3.493 N/A ALA 65.A N VAL 61.A O no hydrogen 2.979 N/A ASN 66.A N ALA 62.A O no hydrogen 2.765 N/A ASN 66.A ND2 GLY 410.A O no hydrogen 2.980 N/A PHE 67.A N MET 63.A O no hydrogen 2.856 N/A VAL 68.A N ILE 64.A O no hydrogen 2.725 N/A GLY 69.A N ALA 65.A O no hydrogen 2.782 N/A PHE 70.A N ASN 66.A O no hydrogen 2.913 N/A ARG 71.A N PHE 67.A O no hydrogen 3.118 N/A MET 72.A N VAL 68.A O no hydrogen 2.778 N/A TYR 73.A N GLY 69.A O no hydrogen 2.918 N/A TYR 73.A OH GLU 303.A OE2 no hydrogen 2.651 N/A LYS 74.A N PHE 70.A O no hydrogen 3.044 N/A MET 75.A N ARG 71.A O no hydrogen 3.429 N/A LEU 76.A N MET 72.A O no hydrogen 2.847 N/A SER 77.A N TYR 73.A O no hydrogen 3.010 N/A SER 77.A OG TYR 73.A O no hydrogen 3.061 N/A ALA 79.A N MET 75.A O no hydrogen 3.133 N/A ARG 80.A N LEU 76.A O no hydrogen 3.389 N/A ALA 85.A N ARG 417.A O no hydrogen 3.015 N/A LEU 87.A N LEU 415.A O no hydrogen 2.929 N/A SER 88.A N TYR 336.A OH no hydrogen 3.423 N/A SER 88.A OG HIS 413.A O no hydrogen 2.942 N/A LEU 92.A N SER 88.A O no hydrogen 2.903 N/A PHE 93.A N PRO 89.A O no hydrogen 2.696 N/A GLY 94.A N PRO 90.A O no hydrogen 2.749 N/A THR 95.A N ALA 91.A O no hydrogen 3.151 N/A THR 95.A OG1 ALA 91.A O no hydrogen 2.581 N/A THR 95.A OG1 THR 226.A OG1 no hydrogen 2.870 N/A LEU 96.A N LEU 92.A O no hydrogen 3.466 N/A VAL 97.A N PHE 93.A O no hydrogen 3.002 N/A SER 98.A N GLY 94.A O no hydrogen 3.016 N/A SER 98.A OG GLY 94.A O no hydrogen 2.710 N/A PHE 99.A N THR 95.A O no hydrogen 3.399 N/A TYR 100.A N LEU 96.A O no hydrogen 2.848 N/A TYR 100.A OH LEU 128.A O no hydrogen 2.659 N/A LEU 101.A N VAL 97.A O no hydrogen 2.893 N/A GLY 102.A N PHE 99.A O no hydrogen 3.129 N/A SER 103.A N TYR 100.A O no hydrogen 3.245 N/A SER 103.A OG TYR 100.A O no hydrogen 3.106 N/A LEU 104.A N ASN 356.A O no hydrogen 3.172 N/A ALA 108.A N LEU 104.A O no hydrogen 2.662 N/A SER 109.A N ASP 105.A O no hydrogen 3.253 N/A SER 109.A OG ASP 105.A O no hydrogen 3.040 N/A SER 109.A OG PRO 106.A O no hydrogen 3.151 N/A LEU 111.A N THR 107.A O no hydrogen 2.818 N/A GLN 112.A N ALA 108.A O no hydrogen 3.432 N/A GLN 112.A NE2 SER 126.A O no hydrogen 2.789 N/A VAL 113.A N SER 109.A O no hydrogen 3.271 N/A LEU 114.A N GLN 110.A O no hydrogen 2.853 N/A LEU 115.A N LEU 111.A O no hydrogen 2.878 N/A GLY 116.A N VAL 113.A O no hydrogen 2.939 N/A VAL 117.A N GLN 112.A O no hydrogen 3.220 N/A LYS 120.A N SER 126.A OG no hydrogen 2.829 N/A ASP 123.A N LYS 120.A O no hydrogen 2.933 N/A THR 125.A N ASP 123.A OD1 no hydrogen 2.602 N/A SER 126.A OG LYS 120.A O no hydrogen 3.508 N/A ARG 127.A N CYS 124.A O no hydrogen 3.313 N/A ASP 129.A N LEU 6.A O no hydrogen 2.922 N/A HIS 131.A N ASP 129.A OD2 no hydrogen 3.075 N/A LYS 132.A N ASP 129.A OD2 no hydrogen 3.387 N/A LYS 132.A NZ TYR 7.A O no hydrogen 3.048 N/A LYS 132.A NZ SER 9.A OG no hydrogen 3.385 N/A VAL 133.A N ASP 129.A O no hydrogen 3.100 N/A LEU 134.A N GLY 130.A O no hydrogen 2.880 N/A THR 135.A N HIS 131.A O no hydrogen 3.031 N/A THR 135.A OG1 HIS 131.A O no hydrogen 2.794 N/A THR 135.A OG1 LYS 132.A O no hydrogen 2.841 N/A ALA 136.A N LYS 132.A O no hydrogen 2.827 N/A LEU 137.A N VAL 133.A O no hydrogen 2.742 N/A GLN 138.A N LEU 134.A O no hydrogen 2.708 N/A ALA 139.A N THR 135.A O no hydrogen 2.781 N/A VAL 140.A N ALA 136.A O no hydrogen 3.222 N/A GLN 141.A N LEU 137.A O no hydrogen 3.168 N/A GLN 141.A NE2 PHE 175.A O no hydrogen 3.249 N/A GLY 142.A N GLN 138.A O no hydrogen 3.038 N/A LEU 143.A N ALA 139.A O no hydrogen 3.031 N/A LEU 144.A N VAL 140.A O no hydrogen 3.379 N/A VAL 145.A N GLY 142.A O no hydrogen 2.984 N/A LEU 149.A N GLN 231.A O no hydrogen 3.031 N/A SER 151.A N HIS 229.A O no hydrogen 3.068 N/A SER 151.A OG GLU 36.A OE1 no hydrogen 2.722 N/A VAL 153.A N TYR 227.A O no hydrogen 2.993 N/A VAL 154.A N ALA 178.A O no hydrogen 2.862 N/A GLY 155.A N ASN 225.A O no hydrogen 2.783 N/A LEU 156.A N PHE 180.A O no hydrogen 2.884 N/A PHE 157.A N PHE 223.A O no hydrogen 3.160 N/A THR 158.A N ARG 182.A O no hydrogen 2.845 N/A THR 158.A OG1 ARG 182.A O no hydrogen 3.441 N/A ALA 159.A N THR 221.A O no hydrogen 2.903 N/A GLY 161.A N GLU 23.A OE2 no hydrogen 2.917 N/A LEU 162.A N ALA 159.A O no hydrogen 3.194 N/A ARG 163.A N ASP 362.A OD2 no hydrogen 3.075 N/A ARG 163.A NE THR 21.A OG1 no hydrogen 3.029 N/A LEU 164.A N PHE 22.A O no hydrogen 2.826 N/A LYS 165.A N MET 360.A O no hydrogen 3.002 N/A LYS 165.A NZ GLY 358.A O no hydrogen 3.088 N/A GLN 166.A N PRO 20.A O no hydrogen 3.012 N/A VAL 169.A N LYS 165.A O no hydrogen 3.344 N/A GLU 170.A N GLN 166.A O no hydrogen 3.103 N/A SER 171.A N PRO 167.A O no hydrogen 3.086 N/A SER 171.A OG PRO 167.A O no hydrogen 2.677 N/A SER 171.A OG PHE 168.A O no hydrogen 2.934 N/A LEU 172.A N VAL 169.A O no hydrogen 3.386 N/A GLY 173.A N GLU 170.A O no hydrogen 2.781 N/A THR 176.A OG1 THR 152.A O no hydrogen 2.661 N/A ALA 178.A N THR 176.A OG1 no hydrogen 2.885 N/A PHE 180.A N VAL 154.A O no hydrogen 2.870 N/A ARG 182.A N LEU 156.A O no hydrogen 2.890 N/A ARG 182.A NH1 PRO 181.A O no hydrogen 2.832 N/A ARG 182.A NH2 THR 31.A OG1 no hydrogen 2.999 N/A SER 183.A N VAL 25.A O no hydrogen 2.980 N/A SER 183.A OG PRO 24.A O no hydrogen 3.052 N/A LEU 184.A N THR 158.A O no hydrogen 2.988 N/A LEU 192.A N ASP 189.A OD2 no hydrogen 2.920 N/A ALA 193.A N ASP 189.A O no hydrogen 3.108 N/A ALA 194.A N PRO 190.A O no hydrogen 2.785 N/A GLN 195.A N VAL 191.A O no hydrogen 2.967 N/A LYS 196.A N LEU 192.A O no hydrogen 3.154 N/A ILE 197.A N ALA 193.A O no hydrogen 3.019 N/A ASN 198.A N ALA 194.A O no hydrogen 2.987 N/A ASN 198.A ND2 ALA 194.A O no hydrogen 2.963 N/A ARG 199.A N GLN 195.A O no hydrogen 2.876 N/A PHE 200.A N LYS 196.A O no hydrogen 3.054 N/A VAL 201.A N ILE 197.A O no hydrogen 2.986 N/A GLN 202.A N ASN 198.A O no hydrogen 2.951 N/A ALA 203.A N ARG 199.A O no hydrogen 3.255 N/A VAL 204.A N PHE 200.A O no hydrogen 3.096 N/A THR 205.A N VAL 201.A O no hydrogen 2.920 N/A THR 205.A OG1 VAL 201.A O no hydrogen 2.762 N/A GLY 206.A N GLN 202.A O no hydrogen 3.017 N/A TRP 207.A N THR 205.A OG1 no hydrogen 2.854 N/A TRP 207.A NE1 GLU 36.A OE2 no hydrogen 2.758 N/A GLY 215.A N LEU 213.A O no hydrogen 2.604 N/A SER 217.A OG ASP 219.A OD2 no hydrogen 2.624 N/A SER 217.A OG SER 220.A OG no hydrogen 3.036 N/A THR 218.A OG1 THR 218.A O no hydrogen 2.666 N/A ASP 219.A N SER 217.A OG no hydrogen 3.023 N/A SER 220.A OG SER 217.A OG no hydrogen 3.036 N/A THR 221.A N ARG 366.A O no hydrogen 3.005 N/A THR 221.A OG1 ARG 366.A O no hydrogen 3.557 N/A PHE 223.A N PHE 157.A O no hydrogen 2.801 N/A PHE 224.A N GLU 369.A O no hydrogen 3.082 N/A ASN 225.A N GLY 155.A O no hydrogen 3.045 N/A ASN 225.A ND2 TYR 227.A OH no hydrogen 3.116 N/A THR 226.A N LEU 371.A O no hydrogen 2.813 N/A THR 226.A OG1 THR 95.A OG1 no hydrogen 2.870 N/A TYR 227.A N VAL 153.A O no hydrogen 2.769 N/A VAL 228.A N SER 373.A O no hydrogen 2.846 N/A HIS 229.A N SER 151.A O no hydrogen 2.682 N/A HIS 229.A ND1 GLU 36.A OE1 no hydrogen 2.939 N/A HIS 229.A NE2 GLU 377.A OE1 no hydrogen 2.853 N/A GLN 231.A N LEU 149.A O no hydrogen 2.822 N/A GLN 231.A NE2 GLN 379.A OE1 no hydrogen 3.093 N/A GLY 232.A N GLU 377.A O no hydrogen 2.642 N/A MET 234.A N GLN 379.A O no hydrogen 3.006 N/A PHE 237.A N MET 234.A O no hydrogen 3.447 N/A SER 238.A N SER 260.A O no hydrogen 2.845 N/A LEU 240.A N MET 258.A O no hydrogen 3.140 N/A HIS 244.A N VAL 256.A O no hydrogen 2.889 N/A PHE 246.A N VAL 254.A O no hydrogen 2.720 N/A TRP 247.A N SER 397.A O no hydrogen 2.875 N/A ASP 249.A N THR 252.A O no hydrogen 2.910 N/A ASN 250.A N ASP 249.A OD1 no hydrogen 2.702 N/A THR 252.A N ASP 249.A O no hydrogen 2.855 N/A VAL 254.A N PHE 246.A O no hydrogen 3.096 N/A VAL 256.A N HIS 244.A O no hydrogen 2.851 N/A LEU 259.A N LEU 327.A O no hydrogen 2.898 N/A SER 260.A N SER 238.A O no hydrogen 2.950 N/A SER 260.A OG LEU 325.A O no hydrogen 3.179 N/A SER 260.A OG THR 326.A OG1 no hydrogen 3.103 N/A GLY 261.A N LEU 325.A O no hydrogen 3.074 N/A GLY 263.A N ILE 323.A O no hydrogen 3.172 N/A PHE 265.A N ARG 321.A O no hydrogen 3.269 N/A GLN 266.A N ARG 279.A O no hydrogen 3.297 N/A GLN 266.A NE2 ASN 317.A OD1 no hydrogen 2.736 N/A GLN 266.A NE2 PRO 318.A O no hydrogen 2.686 N/A HIS 267.A ND1 THR 278.A OG1 no hydrogen 2.885 N/A TRP 268.A N VAL 277.A O no hydrogen 3.196 N/A ASP 270.A N PHE 275.A O no hydrogen 2.662 N/A ASN 273.A N ASP 270.A OD2 no hydrogen 2.906 N/A PHE 275.A N ASP 270.A O no hydrogen 3.304 N/A SER 276.A N GLN 292.A O no hydrogen 3.087 N/A SER 276.A OG GLN 292.A O no hydrogen 3.512 N/A VAL 277.A N TRP 268.A O no hydrogen 2.874 N/A THR 278.A N LEU 290.A O no hydrogen 2.674 N/A THR 278.A OG1 HIS 267.A ND1 no hydrogen 2.885 N/A ARG 279.A N GLN 266.A O no hydrogen 2.713 N/A VAL 280.A N LEU 288.A O no hydrogen 2.936 N/A LEU 282.A N VAL 286.A O no hydrogen 2.971 N/A GLY 283.A N VAL 286.A O no hydrogen 3.308 N/A SER 285.A OG GLU 406.A OE2 no hydrogen 3.501 N/A THR 287.A N TYR 405.A O no hydrogen 2.875 N/A LEU 288.A N VAL 280.A O no hydrogen 2.720 N/A LEU 289.A N ALA 403.A O no hydrogen 2.769 N/A LEU 290.A N THR 278.A O no hydrogen 2.818 N/A ILE 291.A N LEU 401.A O no hydrogen 2.935 N/A GLN 292.A N SER 276.A O no hydrogen 3.045 N/A GLN 294.A N ASN 274.A O no hydrogen 3.289 N/A CYS 295.A SG SER 297.A OG no hydrogen 3.365 N/A CYS 295.A SG ASP 298.A OD1 no hydrogen 3.442 N/A ASP 298.A N CYS 295.A O no hydrogen 3.494 N/A ARG 301.A NE ASP 298.A OD2 no hydrogen 3.371 N/A ARG 301.A NH2 ASN 273.A O no hydrogen 3.039 N/A ARG 301.A NH2 ASP 298.A OD2 no hydrogen 3.212 N/A VAL 302.A N ASP 298.A O no hydrogen 3.155 N/A GLU 303.A N LEU 299.A O no hydrogen 3.011 N/A VAL 304.A N ASP 300.A O no hydrogen 3.187 N/A LEU 305.A N ARG 301.A O no hydrogen 3.196 N/A VAL 306.A N VAL 302.A O no hydrogen 2.789 N/A PHE 307.A N GLU 303.A O no hydrogen 2.991 N/A ILE 315.A N LEU 312.A O no hydrogen 3.338 N/A ARG 321.A N PHE 265.A O no hydrogen 3.116 N/A ILE 323.A N GLY 263.A O no hydrogen 2.977 N/A LEU 325.A N GLY 261.A O no hydrogen 3.124 N/A THR 326.A N VAL 394.A O no hydrogen 3.009 N/A THR 326.A OG1 SER 260.A OG no hydrogen 3.103 N/A LEU 327.A N LEU 259.A O no hydrogen 3.137 N/A GLN 329.A N PRO 257.A O no hydrogen 3.004 N/A LEU 330.A N LEU 378.A O no hydrogen 3.322 N/A ILE 332.A N LEU 376.A O no hydrogen 2.880 N/A ARG 333.A NE LYS 208.A O no hydrogen 2.727 N/A ARG 333.A NH2 LYS 208.A O no hydrogen 3.528 N/A GLY 334.A N ILE 374.A O no hydrogen 3.214 N/A SER 335.A OG SER 373.A OG no hydrogen 3.188 N/A TYR 336.A N ASN 372.A O no hydrogen 3.252 N/A LEU 338.A N VAL 370.A O no hydrogen 2.944 N/A GLN 339.A N ASN 337.A OD1 no hydrogen 2.999 N/A GLN 339.A NE2 LEU 351.A O no hydrogen 2.941 N/A ASP 340.A N ASN 337.A O no hydrogen 2.991 N/A LEU 342.A N LEU 338.A O no hydrogen 3.057 N/A ALA 343.A N GLN 339.A O no hydrogen 3.118 N/A GLN 344.A N ASP 340.A O no hydrogen 3.097 N/A ALA 345.A N LEU 341.A O no hydrogen 3.169 N/A LYS 346.A N ALA 343.A O no hydrogen 3.046 N/A LEU 347.A N LEU 342.A O no hydrogen 2.756 N/A LEU 350.A N LEU 347.A O no hydrogen 3.168 N/A ASN 356.A N THR 107.A OG1 no hydrogen 2.986 N/A LEU 357.A N ASN 364.A OD1 no hydrogen 3.125 N/A LYS 359.A N GLY 102.A O no hydrogen 3.327 N/A MET 360.A N LEU 357.A O no hydrogen 3.370 N/A ASP 362.A N ARG 163.A O no hydrogen 3.354 N/A ASN 364.A ND2 ALA 355.A O no hydrogen 3.474 N/A ARG 366.A N THR 221.A OG1 no hydrogen 3.145 N/A ARG 366.A NH1 ASP 219.A OD1 no hydrogen 3.169 N/A GLY 368.A N LEU 222.A O no hydrogen 2.718 N/A VAL 370.A N ASN 337.A OD1 no hydrogen 2.893 N/A ASN 372.A N TYR 336.A O no hydrogen 3.099 N/A ASN 372.A ND2 LEU 371.A O no hydrogen 2.656 N/A SER 373.A N THR 226.A O no hydrogen 2.927 N/A SER 373.A OG SER 335.A OG no hydrogen 3.188 N/A ILE 374.A N GLY 334.A O no hydrogen 2.939 N/A LEU 375.A N VAL 228.A O no hydrogen 2.918 N/A LEU 376.A N ILE 332.A O no hydrogen 2.795 N/A GLU 377.A N PHE 230.A O no hydrogen 3.026 N/A LEU 378.A N LEU 330.A O no hydrogen 3.235 N/A GLN 379.A N GLY 232.A O no hydrogen 3.060 N/A GLY 381.A N MET 234.A O no hydrogen 3.226 N/A GLN 385.A N GLN 384.A OE1 no hydrogen 3.238 N/A LEU 396.A N THR 326.A O no hydrogen 2.831 N/A PHE 400.A N VAL 418.A O no hydrogen 3.238 N/A LEU 401.A N ILE 291.A O no hydrogen 2.819 N/A PHE 402.A N GLY 416.A O no hydrogen 2.970 N/A ALA 403.A N LEU 289.A O no hydrogen 3.010 N/A ILE 404.A N PHE 414.A O no hydrogen 2.684 N/A TYR 405.A N THR 287.A O no hydrogen 2.964 N/A GLU 406.A N ALA 411.A O no hydrogen 3.016 N/A ARG 407.A NE SER 285.A O no hydrogen 3.245 N/A ASP 408.A N GLU 406.A OE2 no hydrogen 2.923 N/A SER 409.A N GLU 406.A OE1 no hydrogen 2.920 N/A SER 409.A OG GLU 406.A OE1 no hydrogen 2.540 N/A GLY 410.A N GLU 406.A O no hydrogen 2.878 N/A ALA 411.A N SER 409.A OG no hydrogen 3.176 N/A LEU 412.A N ASN 66.A OD1 no hydrogen 2.906 N/A HIS 413.A N ILE 404.A O no hydrogen 2.938 N/A LEU 415.A N LEU 87.A O no hydrogen 3.086 N/A GLY 416.A N PHE 402.A O no hydrogen 2.929 N/A ARG 417.A N ALA 85.A O no hydrogen 2.955 N/A ARG 417.A NH1 GLU 303.A OE2 no hydrogen 3.241 N/A VAL 418.A N PHE 400.A O no hydrogen 2.902 N/A