Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8d44_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 4.A N ALA 1.A O no hydrogen 3.440 N/A LYS 12.A N THR 8.A O no hydrogen 2.976 N/A LYS 12.A NZ GLN 9.A OE1 no hydrogen 3.079 N/A LYS 13.A N GLN 9.A O no hydrogen 2.910 N/A LYS 13.A NZ GLU 17.A OE2 no hydrogen 2.511 N/A GLU 14.A N GLU 10.A O no hydrogen 2.912 N/A LEU 15.A N GLN 11.A O no hydrogen 2.947 N/A SER 16.A N LYS 12.A O no hydrogen 2.951 N/A SER 16.A OG LYS 12.A O no hydrogen 2.672 N/A SER 16.A OG LYS 13.A O no hydrogen 2.549 N/A GLU 17.A N LYS 13.A O no hydrogen 2.943 N/A ILE 18.A N GLU 14.A O no hydrogen 2.977 N/A ALA 19.A N LEU 15.A O no hydrogen 2.940 N/A GLN 20.A N SER 16.A O no hydrogen 2.915 N/A SER 21.A N GLU 17.A O no hydrogen 2.871 N/A SER 21.A OG GLU 17.A O no hydrogen 3.321 N/A SER 21.A OG ILE 18.A O no hydrogen 2.968 N/A ILE 22.A N ILE 18.A O no hydrogen 3.029 N/A VAL 23.A N GLN 20.A O no hydrogen 3.036 N/A LYS 27.A NZ SER 21.A O no hydrogen 3.140 N/A GLY 28.A N SER 72.A O no hydrogen 3.136 N/A ILE 29.A N PHE 299.A O no hydrogen 2.690 N/A LEU 30.A N GLY 75.A O no hydrogen 2.934 N/A ALA 31.A N TYR 301.A O no hydrogen 2.838 N/A GLU 34.A N GLU 34.A OE1 no hydrogen 2.824 N/A SER 35.A OG THR 38.A OG1 no hydrogen 2.536 N/A THR 38.A OG1 SER 35.A OG no hydrogen 2.536 N/A MET 39.A N SER 35.A O no hydrogen 2.597 N/A GLY 40.A N VAL 36.A O no hydrogen 2.913 N/A ASN 41.A N GLY 37.A O no hydrogen 2.894 N/A ARG 42.A N THR 38.A O no hydrogen 2.950 N/A LEU 43.A N MET 39.A O no hydrogen 2.862 N/A GLN 44.A N GLY 40.A O no hydrogen 2.895 N/A ILE 46.A N LEU 43.A O no hydrogen 3.194 N/A LYS 47.A N GLN 44.A O no hydrogen 3.436 N/A GLU 49.A N GLU 49.A OE1 no hydrogen 2.771 N/A ASN 54.A ND2 GLU 49.A O no hydrogen 2.595 N/A ARG 55.A N THR 51.A O no hydrogen 3.181 N/A ARG 55.A NE GLU 81.A OE2 no hydrogen 3.459 N/A ARG 55.A NH1 ASN 50.A OD1 no hydrogen 3.454 N/A ARG 56.A N GLU 52.A O no hydrogen 2.905 N/A ARG 56.A NE GLU 53.A OE2 no hydrogen 3.345 N/A ARG 56.A NH1 GLU 60.A OE1 no hydrogen 2.614 N/A ARG 56.A NH1 LYS 86.A O no hydrogen 2.931 N/A ARG 56.A NH2 GLU 53.A OE2 no hydrogen 3.135 N/A GLN 57.A N GLU 53.A O no hydrogen 2.879 N/A PHE 58.A N ASN 54.A O no hydrogen 2.952 N/A ARG 59.A N ARG 55.A O no hydrogen 3.261 N/A ARG 59.A NH2 GLU 34.A O no hydrogen 2.745 N/A GLU 60.A N ARG 56.A O no hydrogen 2.872 N/A ILE 61.A N GLN 57.A O no hydrogen 2.950 N/A LEU 62.A N PHE 58.A O no hydrogen 2.914 N/A PHE 63.A N ARG 59.A O no hydrogen 2.897 N/A SER 64.A OG ASP 87.A OD1 no hydrogen 3.513 N/A ILE 69.A N ASP 66.A O no hydrogen 3.033 N/A ASN 70.A ND2 LYS 100.A O no hydrogen 3.211 N/A GLN 71.A N SER 68.A O no hydrogen 2.916 N/A SER 72.A N ILE 69.A O no hydrogen 3.088 N/A SER 72.A OG ALA 331.A O no hydrogen 2.588 N/A ILE 73.A N ILE 69.A O no hydrogen 2.777 N/A GLY 74.A N GLY 28.A O no hydrogen 2.842 N/A GLY 75.A N GLY 28.A O no hydrogen 3.356 N/A VAL 76.A N VAL 103.A O no hydrogen 2.917 N/A ILE 77.A N LEU 30.A O no hydrogen 2.985 N/A LEU 78.A N GLY 105.A O no hydrogen 2.855 N/A HIS 80.A ND1 TYR 137.A OH no hydrogen 2.473 N/A THR 82.A OG1 GLU 81.A OE2 no hydrogen 2.988 N/A LEU 83.A N PHE 79.A O no hydrogen 3.050 N/A TYR 84.A OH ASP 140.A OD2 no hydrogen 2.439 N/A GLN 85.A N THR 82.A O no hydrogen 3.299 N/A ASP 87.A N LYS 91.A O no hydrogen 3.217 N/A SER 88.A OG GLU 60.A OE1 no hydrogen 3.252 N/A SER 88.A OG GLU 60.A OE2 no hydrogen 3.388 N/A PHE 93.A N GLN 85.A O no hydrogen 3.312 N/A ILE 96.A N LEU 92.A O no hydrogen 2.889 N/A LEU 97.A N PHE 93.A O no hydrogen 2.934 N/A LYS 98.A N ARG 94.A O no hydrogen 2.884 N/A LYS 98.A NZ GLY 141.A O no hydrogen 3.099 N/A GLU 99.A N ASN 95.A O no hydrogen 2.946 N/A LYS 100.A N ILE 96.A O no hydrogen 3.332 N/A LYS 100.A NZ PHE 63.A O no hydrogen 2.998 N/A LYS 100.A NZ VAL 65.A O no hydrogen 2.365 N/A GLY 101.A N LYS 98.A O no hydrogen 2.996 N/A ILE 102.A N LEU 97.A O no hydrogen 3.011 N/A VAL 103.A N GLY 74.A O no hydrogen 2.914 N/A GLY 105.A N VAL 76.A O no hydrogen 2.908 N/A ILE 106.A N PHE 144.A O no hydrogen 2.880 N/A LYS 107.A N LEU 78.A O no hydrogen 2.983 N/A LEU 108.A N LYS 146.A O no hydrogen 2.993 N/A GLN 110.A N GLN 125.A O no hydrogen 2.647 N/A GLY 111.A N GLN 125.A O no hydrogen 3.025 N/A ALA 113.A N THR 123.A O no hydrogen 2.872 N/A LEU 115.A N GLU 121.A O no hydrogen 3.038 N/A THR 118.A OG1 LEU 115.A O no hydrogen 2.244 N/A THR 118.A OG1 GLU 121.A O no hydrogen 3.286 N/A ASN 119.A ND2 ASP 155.A O no hydrogen 3.007 N/A LYS 120.A N THR 118.A O no hydrogen 2.860 N/A THR 123.A N ALA 113.A O no hydrogen 2.921 N/A GLN 125.A N GLY 111.A O no hydrogen 2.816 N/A GLN 125.A NE2 GLY 112.A O no hydrogen 2.980 N/A LEU 130.A N LEU 127.A O no hydrogen 3.199 N/A SER 131.A OG ASN 180.A OD1 no hydrogen 3.467 N/A ARG 133.A N GLY 129.A O no hydrogen 3.355 N/A CYS 134.A N LEU 130.A O no hydrogen 2.882 N/A CYS 134.A SG LEU 130.A O no hydrogen 3.402 N/A ALA 135.A N SER 131.A O no hydrogen 2.915 N/A GLN 136.A N GLU 132.A O no hydrogen 2.934 N/A TYR 137.A N ARG 133.A O no hydrogen 2.893 N/A TYR 137.A OH HIS 80.A ND1 no hydrogen 2.473 N/A LYS 138.A N CYS 134.A O no hydrogen 2.891 N/A LYS 138.A NZ GLU 14.A OE2 no hydrogen 2.660 N/A LYS 138.A NZ ASP 143.A OD1 no hydrogen 3.255 N/A LYS 139.A N ALA 135.A O no hydrogen 2.949 N/A LYS 139.A NZ GLN 136.A OE1 no hydrogen 3.402 N/A ASP 140.A N TYR 137.A O no hydrogen 2.864 N/A VAL 142.A N TYR 137.A O no hydrogen 2.999 N/A ASP 143.A N VAL 104.A O no hydrogen 2.689 N/A PHE 144.A N VAL 104.A O no hydrogen 2.980 N/A GLY 145.A N VAL 183.A O no hydrogen 2.909 N/A LYS 146.A N ILE 106.A O no hydrogen 2.912 N/A LYS 146.A NZ GLU 187.A OE1 no hydrogen 3.457 N/A TRP 147.A N ILE 185.A O no hydrogen 3.007 N/A ARG 148.A N ASP 109.A OD2 no hydrogen 3.471 N/A ARG 148.A NE GLU 189.A OE1 no hydrogen 2.701 N/A ARG 148.A NH2 GLU 189.A OE1 no hydrogen 2.669 N/A ALA 149.A N GLU 187.A O no hydrogen 2.877 N/A LEU 151.A N GLU 189.A O no hydrogen 2.896 N/A ILE 153.A N ILE 191.A O no hydrogen 2.881 N/A ALA 154.A N CYS 157.A O no hydrogen 3.374 N/A CYS 157.A N ALA 154.A O no hydrogen 3.149 N/A CYS 157.A SG ASN 119.A O no hydrogen 3.464 N/A CYS 157.A SG GLU 121.A OE2 no hydrogen 3.271 N/A CYS 157.A SG ASP 155.A O no hydrogen 3.450 N/A SER 159.A N GLU 121.A OE2 no hydrogen 2.882 N/A SER 159.A OG GLU 121.A OE1 no hydrogen 2.581 N/A ALA 162.A N SER 159.A OG no hydrogen 3.318 N/A ILE 163.A N SER 159.A O no hydrogen 3.046 N/A GLN 164.A N SER 160.A O no hydrogen 2.923 N/A GLU 165.A N LEU 161.A O no hydrogen 2.891 N/A ASN 166.A N ALA 162.A O no hydrogen 2.929 N/A ASN 166.A ND2 THR 122.A O no hydrogen 3.371 N/A ASN 166.A ND2 ALA 162.A O no hydrogen 2.936 N/A ALA 167.A N ILE 163.A O no hydrogen 2.931 N/A ASN 168.A N GLN 164.A O no hydrogen 2.923 N/A ASN 168.A ND2 HIS 219.A NE2 no hydrogen 3.160 N/A ALA 169.A N GLU 165.A O no hydrogen 2.893 N/A LEU 170.A N ASN 166.A O no hydrogen 2.935 N/A ALA 171.A N ALA 167.A O no hydrogen 2.929 N/A ARG 172.A N ASN 168.A O no hydrogen 2.884 N/A TYR 173.A N ALA 169.A O no hydrogen 2.914 N/A TYR 173.A OH ILE 185.A O no hydrogen 3.126 N/A ALA 174.A N LEU 170.A O no hydrogen 2.917 N/A SER 175.A N ALA 171.A O no hydrogen 2.917 N/A SER 175.A OG HIS 219.A O no hydrogen 3.447 N/A ILE 176.A N ARG 172.A O no hydrogen 2.980 N/A CYS 177.A N TYR 173.A O no hydrogen 2.916 N/A GLN 178.A N ALA 174.A O no hydrogen 2.919 N/A GLN 178.A NE2 TYR 222.A O no hydrogen 2.483 N/A GLN 178.A NE2 GLY 225.A O no hydrogen 3.237 N/A GLN 179.A N SER 175.A O no hydrogen 2.922 N/A GLN 179.A NE2 ALA 6.A O no hydrogen 2.384 N/A ASN 180.A N ILE 176.A O no hydrogen 2.987 N/A GLY 181.A N GLN 178.A O no hydrogen 3.321 N/A LEU 182.A N CYS 177.A O no hydrogen 2.780 N/A VAL 183.A N ASP 143.A O no hydrogen 3.095 N/A ILE 185.A N GLY 145.A O no hydrogen 2.853 N/A ILE 185.A N TYR 173.A OH no hydrogen 2.676 N/A VAL 186.A N LEU 227.A O no hydrogen 3.022 N/A GLU 187.A N TRP 147.A O no hydrogen 2.937 N/A GLU 189.A N ALA 149.A O no hydrogen 2.907 N/A VAL 190.A N ASN 231.A OD1 no hydrogen 3.497 N/A ILE 191.A N LEU 151.A O no hydrogen 2.886 N/A ASP 193.A N ILE 153.A O no hydrogen 2.919 N/A HIS 196.A ND1 ASP 197.A O no hydrogen 2.707 N/A LEU 198.A N TYR 243.A OH no hydrogen 3.377 N/A CYS 201.A N ASP 197.A O no hydrogen 3.048 N/A CYS 201.A SG THR 234.A O no hydrogen 3.924 N/A GLN 202.A N LEU 198.A O no hydrogen 2.898 N/A GLN 202.A NE2 GLU 206.A OE2 no hydrogen 2.617 N/A TYR 203.A N GLU 199.A O no hydrogen 2.917 N/A VAL 204.A N HIS 200.A O no hydrogen 2.908 N/A THR 205.A N CYS 201.A O no hydrogen 2.887 N/A THR 205.A OG1 CYS 201.A O no hydrogen 2.655 N/A GLU 206.A N GLN 202.A O no hydrogen 2.919 N/A LYS 207.A N TYR 203.A O no hydrogen 2.954 N/A LYS 207.A NZ TYR 203.A O no hydrogen 3.305 N/A VAL 208.A N VAL 204.A O no hydrogen 2.880 N/A LEU 209.A N THR 205.A O no hydrogen 2.876 N/A ALA 210.A N GLU 206.A O no hydrogen 2.911 N/A ALA 211.A N LYS 207.A O no hydrogen 2.983 N/A VAL 212.A N VAL 208.A O no hydrogen 2.834 N/A TYR 213.A N LEU 209.A O no hydrogen 2.931 N/A LYS 214.A N ALA 210.A O no hydrogen 2.921 N/A LYS 214.A NZ ASP 218.A OD1 no hydrogen 3.108 N/A ALA 215.A N ALA 211.A O no hydrogen 2.907 N/A LEU 216.A N VAL 212.A O no hydrogen 2.875 N/A ASN 217.A N TYR 213.A O no hydrogen 2.918 N/A ASP 218.A N LYS 214.A O no hydrogen 2.909 N/A HIS 219.A N ALA 215.A O no hydrogen 3.027 N/A HIS 220.A N ASN 217.A O no hydrogen 3.216 N/A VAL 221.A N LEU 216.A O no hydrogen 3.072 N/A TYR 222.A N GLN 178.A OE1 no hydrogen 2.685 N/A GLY 225.A N TYR 222.A O no hydrogen 3.288 N/A THR 226.A OG1 PRO 184.A O no hydrogen 2.681 N/A THR 226.A OG1 LEU 227.A O no hydrogen 3.365 N/A LEU 227.A N PRO 184.A O no hydrogen 2.877 N/A LYS 229.A N VAL 186.A O no hydrogen 2.624 N/A LYS 229.A NZ GLU 187.A OE1 no hydrogen 2.918 N/A VAL 233.A N THR 252.A OG1 no hydrogen 3.075 N/A THR 234.A OG1 MET 232.A O no hydrogen 3.390 N/A CYS 239.A N GLY 236.A O no hydrogen 3.031 N/A CYS 239.A SG LYS 241.A O no hydrogen 3.289 N/A GLN 247.A N THR 244.A OG1 no hydrogen 3.340 N/A VAL 248.A N THR 244.A O no hydrogen 3.012 N/A ALA 249.A N PRO 245.A O no hydrogen 2.899 N/A MET 250.A N GLU 246.A O no hydrogen 2.879 N/A ALA 251.A N GLN 247.A O no hydrogen 2.936 N/A THR 252.A N VAL 248.A O no hydrogen 2.872 N/A THR 252.A OG1 VAL 248.A O no hydrogen 2.678 N/A VAL 253.A N ALA 249.A O no hydrogen 2.937 N/A THR 254.A N MET 250.A O no hydrogen 2.913 N/A THR 254.A OG1 MET 250.A O no hydrogen 2.338 N/A ALA 255.A N ALA 251.A O no hydrogen 2.889 N/A LEU 256.A N THR 252.A O no hydrogen 2.907 N/A HIS 257.A N VAL 253.A O no hydrogen 2.924 N/A HIS 257.A ND1 THR 254.A O no hydrogen 2.825 N/A ARG 258.A NH1 GLU 206.A OE1 no hydrogen 3.265 N/A THR 259.A N LEU 256.A O no hydrogen 3.195 N/A THR 259.A OG1 ALA 255.A O no hydrogen 2.776 N/A VAL 260.A N LEU 256.A O no hydrogen 2.777 N/A ILE 267.A N LYS 296.A O no hydrogen 3.214 N/A CYS 268.A N LEU 228.A O no hydrogen 2.970 N/A CYS 268.A SG SER 298.A OG no hydrogen 2.944 N/A PHE 269.A N SER 298.A O no hydrogen 3.004 N/A LEU 270.A N PRO 230.A O no hydrogen 3.301 N/A ASP 278.A N SER 275.A OG no hydrogen 3.170 N/A ALA 279.A N SER 275.A O no hydrogen 2.789 N/A THR 280.A N GLU 276.A O no hydrogen 2.929 N/A THR 280.A OG1 GLU 276.A O no hydrogen 2.809 N/A THR 280.A OG1 ASN 334.A OD1 no hydrogen 2.938 N/A LEU 281.A N GLU 277.A O no hydrogen 2.915 N/A ASN 282.A N ASP 278.A O no hydrogen 2.871 N/A ASN 282.A ND2 ASP 278.A O no hydrogen 2.876 N/A LEU 283.A N ALA 279.A O no hydrogen 2.933 N/A ASN 284.A N THR 280.A O no hydrogen 2.938 N/A ALA 285.A N LEU 281.A O no hydrogen 2.915 N/A ILE 286.A N ASN 282.A O no hydrogen 2.872 N/A ASN 287.A N LEU 283.A O no hydrogen 2.943 N/A ASN 287.A ND2 LEU 283.A O no hydrogen 3.031 N/A LEU 288.A N ALA 285.A O no hydrogen 3.230 N/A CYS 289.A N ILE 286.A O no hydrogen 3.219 N/A LYS 293.A NZ CYS 289.A O no hydrogen 2.402 N/A LYS 293.A NZ LEU 291.A O no hydrogen 2.882 N/A TRP 295.A NE1 PRO 261.A O no hydrogen 2.765 N/A LYS 296.A N PRO 265.A O no hydrogen 3.160 N/A SER 298.A N ILE 267.A O no hydrogen 2.757 N/A SER 298.A OG LYS 296.A O no hydrogen 3.462 N/A SER 300.A N PHE 269.A O no hydrogen 2.617 N/A TYR 301.A N ILE 29.A O no hydrogen 3.029 N/A TYR 301.A OH ALA 279.A O no hydrogen 3.201 N/A LEU 305.A N GLY 302.A O no hydrogen 3.047 N/A GLN 306.A N ARG 303.A O no hydrogen 2.996 N/A GLN 306.A NE2 GLU 34.A OE2 no hydrogen 3.209 N/A ALA 311.A N ALA 307.A O no hydrogen 3.188 N/A ALA 312.A N SER 308.A O no hydrogen 2.888 N/A TRP 313.A N ALA 309.A O no hydrogen 2.906 N/A GLY 314.A N LEU 310.A O no hydrogen 3.114 N/A LYS 316.A N TRP 313.A O no hydrogen 3.394 N/A THR 323.A OG1 ASN 319.A O no hydrogen 3.115 N/A GLN 324.A N LYS 320.A O no hydrogen 2.846 N/A GLN 324.A NE2 SER 64.A O no hydrogen 3.493 N/A GLU 325.A N GLU 321.A O no hydrogen 2.888 N/A ALA 326.A N ALA 322.A O no hydrogen 2.902 N/A PHE 327.A N THR 323.A O no hydrogen 2.939 N/A MET 328.A N GLN 324.A O no hydrogen 2.903 N/A LYS 329.A N GLU 325.A O no hydrogen 2.847 N/A ARG 330.A N ALA 326.A O no hydrogen 2.971 N/A ALA 331.A N PHE 327.A O no hydrogen 2.921 N/A MET 332.A N MET 328.A O no hydrogen 2.878 N/A ALA 333.A N LYS 329.A O no hydrogen 2.885 N/A ASN 334.A N ARG 330.A O no hydrogen 2.960 N/A CYS 335.A N ALA 331.A O no hydrogen 2.901 N/A CYS 335.A SG GLY 26.A O no hydrogen 3.871 N/A CYS 335.A SG GLN 71.A O no hydrogen 3.418 N/A GLN 336.A N MET 332.A O no hydrogen 2.878 N/A ALA 337.A N ALA 333.A O no hydrogen 2.875 N/A ALA 338.A N CYS 335.A O no hydrogen 3.241 N/A GLN 341.A N GLN 336.A O no hydrogen 3.190 N/A