Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8g4d_D.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 6.A N ILE 2.A O no hydrogen 2.948 N/A ILE 7.A N LYS 3.A O no hydrogen 2.854 N/A GLU 8.A N ALA 4.A O no hydrogen 2.962 N/A ARG 9.A N PHE 5.A O no hydrogen 2.816 N/A ALA 14.A N ARG 10.A O no hydrogen 2.946 N/A ALA 15.A N SER 11.A O no hydrogen 2.874 N/A PHE 16.A N TRP 12.A O no hydrogen 2.918 N/A LEU 17.A N ILE 13.A O no hydrogen 2.966 N/A PHE 18.A N ALA 14.A O no hydrogen 2.898 N/A GLN 19.A N ALA 15.A O no hydrogen 2.896 N/A GLN 20.A N PHE 16.A O no hydrogen 3.003 N/A ALA 21.A N LEU 17.A O no hydrogen 2.905 N/A LEU 22.A N PHE 18.A O no hydrogen 2.889 N/A MET 23.A N GLN 19.A O no hydrogen 2.997 N/A LEU 24.A N GLN 20.A O no hydrogen 2.915 N/A PHE 25.A N ALA 21.A O no hydrogen 2.895 N/A ILE 26.A N LEU 22.A O no hydrogen 2.972 N/A ALA 27.A N MET 23.A O no hydrogen 2.921 N/A PHE 28.A N LEU 24.A O no hydrogen 2.886 N/A VAL 29.A N PHE 25.A O no hydrogen 2.954 N/A ASP 30.A N ILE 26.A O no hydrogen 3.024 N/A LEU 39.A N PHE 35.A O no hydrogen 2.940 N/A TYR 40.A N GLY 36.A O no hydrogen 2.946 N/A MET 41.A N ASN 37.A O no hydrogen 2.964 N/A VAL 42.A N VAL 38.A O no hydrogen 2.889 N/A TYR 43.A N LEU 39.A O no hydrogen 3.003 N/A LEU 44.A N TYR 40.A O no hydrogen 2.998 N/A CYS 45.A N MET 41.A O no hydrogen 2.869 N/A CYS 45.A SG MET 41.A O no hydrogen 3.464 N/A ILE 46.A N VAL 42.A O no hydrogen 2.951 N/A LEU 47.A N TYR 43.A O no hydrogen 3.037 N/A PHE 48.A N LEU 44.A O no hydrogen 2.922 N/A PHE 49.A N CYS 45.A O no hydrogen 2.858 N/A ILE 50.A N ILE 46.A O no hydrogen 3.085 N/A LEU 53.A N PHE 49.A O no hydrogen 2.986 N/A TRP 54.A N ILE 50.A O no hydrogen 2.994 N/A PHE 55.A N ILE 51.A O no hydrogen 2.988 N/A ARG 56.A N PHE 52.A O no hydrogen 3.013 N/A TYR 57.A N LEU 53.A O no hydrogen 2.946 N/A ARG 58.A N TRP 54.A O no hydrogen 2.935 N/A LYS 59.A N PHE 55.A O no hydrogen 3.051 N/A GLU 60.A N ARG 56.A O no hydrogen 3.007 N/A THR 61.A N TYR 57.A O no hydrogen 2.917 N/A THR 61.A OG1 TYR 57.A O no hydrogen 2.914 N/A ALA 62.A N ARG 58.A O no hydrogen 2.951 N/A PHE 63.A N LYS 59.A O no hydrogen 3.116 N/A TYR 64.A N GLU 60.A O no hydrogen 3.055 N/A LYS 65.A N THR 61.A O no hydrogen 2.965 N/A LYS 65.A N ALA 62.A O no hydrogen 3.226 N/A SER 66.A N ALA 62.A O no hydrogen 3.256 N/A SER 66.A N PHE 63.A O no hydrogen 3.044 N/A SER 66.A OG PHE 63.A O no hydrogen 2.897 N/A SER 66.A OG ALA 78.A O no hydrogen 3.399 N/A LEU 67.A N PHE 63.A O no hydrogen 3.293 N/A LYS 68.A N TYR 64.A O no hydrogen 3.177 N/A LYS 68.A NZ GLU 71.A OE1 no hydrogen 3.039 N/A THR 69.A N LYS 65.A O no hydrogen 2.927 N/A THR 69.A OG1 LYS 65.A O no hydrogen 3.479 N/A THR 69.A OG1 SER 66.A O no hydrogen 2.782 N/A TRP 70.A N SER 66.A O no hydrogen 2.868 N/A GLU 71.A N LEU 67.A O no hydrogen 2.641 N/A ASN 72.A N THR 69.A O no hydrogen 3.100 N/A ASN 73.A ND2 ASP 75.A O no hydrogen 2.920 N/A ALA 88.A N THR 84.A O no hydrogen 3.335 N/A MET 89.A N PRO 85.A O no hydrogen 2.892 N/A VAL 90.A N PHE 86.A O no hydrogen 2.991 N/A GLU 91.A N GLU 87.A O no hydrogen 2.945 N/A ARG 92.A N ALA 88.A O no hydrogen 2.896 N/A SER 93.A N MET 89.A O no hydrogen 2.936 N/A ILE 94.A N VAL 90.A O no hydrogen 3.003 N/A ALA 95.A N GLU 91.A O no hydrogen 2.963 N/A GLY 96.A N ARG 92.A O no hydrogen 2.938 N/A GLN 97.A N SER 93.A O no hydrogen 2.993 N/A THR 98.A N ILE 94.A O no hydrogen 3.007 N/A THR 98.A OG1 ILE 94.A O no hydrogen 3.172 N/A GLU 99.A N ALA 95.A O no hydrogen 2.959 N/A HIS 100.A N GLY 96.A O no hydrogen 2.962 N/A LEU 101.A N GLN 97.A O no hydrogen 2.998 N/A LYS 102.A N THR 98.A O no hydrogen 2.981 N/A GLN 103.A N GLU 99.A O no hydrogen 2.947 N/A THR 104.A N HIS 100.A O no hydrogen 2.990 N/A ALA 105.A N LEU 101.A O no hydrogen 3.009 N/A ALA 106.A N LYS 102.A O no hydrogen 3.010 N/A ARG 107.A N GLN 103.A O no hydrogen 2.949 N/A ARG 107.A NH2 HIS 108.A ND1 no hydrogen 2.989 N/A HIS 108.A N THR 104.A O no hydrogen 2.983 N/A ARG 109.A N ALA 105.A O no hydrogen 3.049 N/A LEU 110.A N ALA 106.A O no hydrogen 2.961 N/A ALA 111.A N ARG 107.A O no hydrogen 2.970 N/A LEU 112.A N HIS 108.A O no hydrogen 3.002 N/A GLU 113.A N ARG 109.A O no hydrogen 3.013 N/A ASN 114.A N LEU 110.A O no hydrogen 2.954 N/A GLU 115.A N ALA 111.A O no hydrogen 2.975 N/A LYS 116.A N LEU 112.A O no hydrogen 2.995 N/A LYS 116.A NZ ASP 117.A OD1 no hydrogen 3.299 N/A ASP 117.A N GLU 113.A O no hydrogen 2.986 N/A GLU 118.A N ASN 114.A O no hydrogen 2.961 N/A LEU 119.A N GLU 115.A O no hydrogen 2.963 N/A MET 120.A N LYS 116.A O no hydrogen 2.977 N/A ALA 121.A N ASP 117.A O no hydrogen 3.004 N/A TRP 122.A N GLU 118.A O no hydrogen 2.973 N/A ILE 123.A N LEU 119.A O no hydrogen 2.887 N/A HIS 124.A N MET 120.A O no hydrogen 3.046 N/A GLU 125.A N ALA 121.A O no hydrogen 3.062 N/A VAL 126.A N TRP 122.A O no hydrogen 2.892 N/A LYS 127.A N ILE 123.A O no hydrogen 2.867 N/A THR 128.A N HIS 124.A O no hydrogen 3.135 N/A THR 128.A OG1 HIS 124.A O no hydrogen 3.164 N/A LEU 130.A N LYS 127.A O no hydrogen 2.932 N/A THR 131.A N LYS 127.A O no hydrogen 3.336 N/A THR 131.A OG1 THR 128.A O no hydrogen 2.236 N/A ALA 132.A N THR 128.A O no hydrogen 3.061 N/A MET 133.A N PRO 129.A O no hydrogen 2.836 N/A HIS 134.A N LEU 130.A O no hydrogen 2.932 N/A LEU 135.A N THR 131.A O no hydrogen 2.978 N/A ILE 136.A N ALA 132.A O no hydrogen 2.934 N/A ILE 137.A N MET 133.A O no hydrogen 2.873 N/A ASP 138.A N HIS 134.A O no hydrogen 3.006 N/A ARG 139.A N ILE 137.A O no hydrogen 2.779 N/A LYS 146.A NZ MET 140.A O no hydrogen 2.644 N/A SER 147.A N LYS 143.A O no hydrogen 2.883 N/A GLN 148.A N ALA 144.A O no hydrogen 2.970 N/A LEU 149.A N LEU 145.A O no hydrogen 2.910 N/A SER 150.A N LYS 146.A O no hydrogen 2.848 N/A SER 150.A OG LYS 146.A O no hydrogen 2.811 N/A TYR 151.A N SER 147.A O no hydrogen 2.935 N/A GLU 152.A N GLN 148.A O no hydrogen 2.974 N/A TRP 153.A N LEU 149.A O no hydrogen 2.876 N/A LEU 154.A N SER 150.A O no hydrogen 2.852 N/A ARG 155.A N TYR 151.A O no hydrogen 2.975 N/A ILE 156.A N GLU 152.A O no hydrogen 2.966 N/A HIS 157.A N TRP 153.A O no hydrogen 2.858 N/A LEU 158.A N LEU 154.A O no hydrogen 2.899 N/A LEU 159.A N ARG 155.A O no hydrogen 2.950 N/A LEU 160.A N ILE 156.A O no hydrogen 2.899 N/A ASP 161.A N HIS 157.A O no hydrogen 2.910 N/A GLN 162.A N LEU 158.A O no hydrogen 2.910 N/A GLN 163.A N LEU 159.A O no hydrogen 2.955 N/A LEU 164.A N LEU 160.A O no hydrogen 2.903 N/A HIS 165.A N ASP 161.A O no hydrogen 3.025 N/A GLN 166.A N GLN 162.A O no hydrogen 2.958 N/A LYS 167.A N GLN 163.A O no hydrogen 2.846 N/A ARG 168.A N LEU 164.A O no hydrogen 2.946 N/A ILE 169.A N HIS 165.A O no hydrogen 2.958 N/A SER 170.A N LYS 167.A O no hydrogen 3.482 N/A PHE 171.A N ARG 168.A O no hydrogen 3.111 N/A GLU 173.A N GLU 173.A OE1 no hydrogen 2.498 N/A ASN 174.A N PHE 171.A O no hydrogen 2.974 N/A ASP 175.A N ILE 172.A O no hydrogen 2.828 N/A GLN 182.A NE2 LYS 212.A O no hydrogen 2.731 N/A GLN 184.A N GLN 182.A OE1 no hydrogen 3.229 N/A ILE 187.A N LEU 183.A O no hydrogen 2.827 N/A PHE 188.A N GLN 184.A O no hydrogen 2.949 N/A LYS 189.A N PRO 185.A O no hydrogen 2.893 N/A GLU 190.A N LEU 186.A O no hydrogen 2.881 N/A ILE 191.A N ILE 187.A O no hydrogen 2.900 N/A LYS 192.A N PHE 188.A O no hydrogen 2.856 N/A ASP 193.A N LYS 189.A O no hydrogen 2.902 N/A GLN 195.A N LYS 192.A O no hydrogen 2.955 N/A CYS 198.A N LEU 194.A O no hydrogen 2.637 N/A CYS 198.A SG LEU 194.A O no hydrogen 3.241 N/A ILE 199.A N GLN 195.A O no hydrogen 2.869 N/A GLN 200.A N SER 196.A O no hydrogen 2.909 N/A LYS 201.A N TRP 197.A O no hydrogen 2.886 N/A GLY 202.A N CYS 198.A O no hydrogen 3.024 N/A ASP 206.A N ILE 241.A O no hydrogen 2.643 N/A GLN 208.A NE2 ASP 206.A OD2 no hydrogen 2.492 N/A ALA 211.A N SER 245.A O no hydrogen 2.606 N/A ALA 211.A N SER 245.A OG no hydrogen 2.741 N/A LYS 219.A NZ ASP 175.A OD2 no hydrogen 3.300 N/A TRP 220.A N ASP 217.A OD2 no hydrogen 2.787 N/A LEU 221.A N ASP 217.A O no hydrogen 2.266 N/A ALA 222.A N ALA 218.A O no hydrogen 2.901 N/A PHE 223.A N LYS 219.A O no hydrogen 2.857 N/A ILE 224.A N TRP 220.A O no hydrogen 2.914 N/A ILE 225.A N LEU 221.A O no hydrogen 2.951 N/A ARG 226.A N ALA 222.A O no hydrogen 2.919 N/A ARG 226.A NH1 ASP 161.A OD2 no hydrogen 2.864 N/A ARG 226.A NH2 PHE 223.A O no hydrogen 3.253 N/A GLN 227.A N PHE 223.A O no hydrogen 2.833 N/A LEU 228.A N ILE 224.A O no hydrogen 3.012 N/A LEU 229.A N ILE 225.A O no hydrogen 2.917 N/A THR 230.A N ARG 226.A O no hydrogen 2.775 N/A THR 230.A OG1 ARG 226.A O no hydrogen 2.382 N/A ASN 231.A N GLN 227.A O no hydrogen 2.917 N/A ALA 232.A N LEU 228.A O no hydrogen 2.933 N/A VAL 233.A N LEU 229.A O no hydrogen 2.873 N/A LYS 234.A N THR 230.A O no hydrogen 2.854 N/A LYS 234.A NZ SER 287.A OG no hydrogen 2.436 N/A TYR 235.A N ASN 231.A O no hydrogen 2.905 N/A TYR 235.A N ALA 232.A O no hydrogen 2.981 N/A SER 236.A N ALA 232.A O no hydrogen 2.355 N/A SER 236.A OG ASP 258.A OD2 no hydrogen 2.259 N/A ILE 243.A N ASP 206.A O no hydrogen 2.484 N/A LYS 244.A NZ GLU 242.A OE1 no hydrogen 3.313 N/A SER 245.A OG ALA 211.A O no hydrogen 2.315 N/A SER 245.A OG SER 245.A O no hydrogen 2.666 N/A GLN 247.A NE2 GLY 249.A O no hydrogen 2.990 N/A GLN 247.A NE2 GLU 250.A O no hydrogen 3.351 N/A LYS 248.A NZ GLU 309.A OE2 no hydrogen 2.896 N/A LEU 254.A N LEU 320.A O no hydrogen 3.439 N/A GLN 255.A NE2 GLU 309.A OE1 no hydrogen 2.480 N/A VAL 256.A N LEU 254.A O no hydrogen 2.622 N/A LYS 257.A N GLU 242.A O no hydrogen 2.666 N/A ASP 258.A N THR 316.A O no hydrogen 3.471 N/A CYS 259.A N SER 239.A OG no hydrogen 3.293 N/A CYS 259.A SG GLU 240.A O no hydrogen 3.116 N/A CYS 259.A SG GLU 242.A OE2 no hydrogen 3.722 N/A ARG 261.A NE TYR 235.A O no hydrogen 3.212 N/A ILE 263.A N SER 310.A OG no hydrogen 3.190 N/A LYS 266.A N ASP 264.A OD1 no hydrogen 2.912 N/A ASP 267.A N ASP 264.A O no hydrogen 2.928 N/A VAL 268.A N PRO 265.A O no hydrogen 3.522 N/A ARG 270.A N ASP 267.A O no hydrogen 3.266 N/A ASP 273.A N ARG 270.A O no hydrogen 3.068 N/A PHE 276.A N GLY 289.A O no hydrogen 3.195 N/A ASP 281.A N SER 278.A O no hydrogen 3.138 N/A HIS 283.A N ASP 281.A OD1 no hydrogen 3.466 N/A ASP 284.A N ASP 281.A O no hydrogen 2.862 N/A GLN 285.A N HIS 282.A O no hydrogen 3.263 N/A SER 287.A N ASP 284.A O no hydrogen 3.250 N/A SER 287.A OG ASP 284.A O no hydrogen 3.268 N/A THR 288.A OG1 GLN 163.A OE1 no hydrogen 2.679 N/A LEU 294.A N MET 290.A O no hydrogen 2.213 N/A ALA 295.A N GLY 291.A O no hydrogen 2.896 N/A LYS 296.A N LEU 292.A O no hydrogen 2.900 N/A LYS 297.A N TYR 293.A O no hydrogen 2.910 N/A ALA 298.A N LEU 294.A O no hydrogen 2.855 N/A ALA 300.A N LYS 297.A O no hydrogen 3.291 N/A ILE 304.A N ALA 299.A O no hydrogen 3.015 N/A SER 310.A OG ILE 263.A O no hydrogen 2.999 N/A SER 310.A OG THR 316.A OG1 no hydrogen 2.378 N/A GLY 313.A N ARG 261.A O no hydrogen 3.065 N/A THR 316.A OG1 SER 310.A OG no hydrogen 2.378 N/A PHE 318.A N VAL 256.A O no hydrogen 2.290 N/A THR 319.A OG1 GLN 255.A OE1 no hydrogen 3.177 N/A THR 319.A OG1 VAL 317.A O no hydrogen 3.165 N/A LEU 320.A N PHE 318.A O no hydrogen 2.845 N/A THR 321.A N HIS 305.A O no hydrogen 2.816 N/A THR 321.A OG1 GLN 251.A OE1 no hydrogen 2.736 N/A THR 321.A OG1 HIS 305.A O no hydrogen 2.514 N/A THR 321.A OG1 THR 321.A O no hydrogen 2.470 N/A PHE 322.A N LEU 320.A O no hydrogen 2.757 N/A PHE 328.A N ILE 324.A O no hydrogen 3.061 N/A GLU 329.A N ASN 326.A O no hydrogen 3.155 N/A HIS 330.A N GLN 327.A O no hydrogen 3.169 N/A ILE 332.A N PHE 328.A O no hydrogen 2.919 N/A SER 333.A N GLU 329.A O no hydrogen 3.078 N/A SER 333.A OG HIS 330.A O no hydrogen 2.582 N/A VAL 334.A N HIS 330.A O no hydrogen 3.294 N/A