Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3v8k_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N SER 4.A OG no hydrogen 3.397 N/A VAL 7.A N TYR 3.A O no hydrogen 3.201 N/A LEU 8.A N SER 4.A O no hydrogen 2.973 N/A GLN 9.A N GLN 5.A O no hydrogen 2.819 N/A GLN 9.A NE2 GLN 73.A OE1 no hydrogen 3.181 N/A LEU 10.A N ASP 6.A O no hydrogen 3.137 N/A LEU 11.A N VAL 7.A O no hydrogen 2.936 N/A TYR 12.A N LEU 8.A O no hydrogen 3.078 N/A TYR 12.A N GLN 9.A O no hydrogen 2.974 N/A LYS 13.A N GLN 9.A O no hydrogen 2.883 N/A ASN 14.A ND2 LEU 10.A O no hydrogen 2.803 N/A LYS 15.A N TYR 12.A O no hydrogen 3.402 N/A ASN 17.A N ASN 14.A O no hydrogen 2.799 N/A TYR 18.A OH ASP 50.A OD2 no hydrogen 2.540 N/A ILE 19.A N HIS 57.A O no hydrogen 3.028 N/A GLN 22.A NE2 GLU 26.A OE2 no hydrogen 2.653 N/A SER 23.A N SER 20.A OG no hydrogen 2.904 N/A ILE 24.A N SER 20.A O no hydrogen 3.085 N/A ALA 25.A N GLY 21.A O no hydrogen 2.822 N/A GLU 26.A N GLN 22.A O no hydrogen 3.060 N/A SER 27.A N SER 23.A O no hydrogen 3.353 N/A LEU 28.A N ILE 24.A O no hydrogen 3.068 N/A ILE 30.A N ALA 25.A O no hydrogen 3.141 N/A ALA 34.A N SER 31.A O no hydrogen 2.892 N/A VAL 35.A N SER 31.A O no hydrogen 3.180 N/A VAL 38.A N ALA 34.A O no hydrogen 3.064 N/A ILE 39.A N VAL 35.A O no hydrogen 3.075 N/A ASP 40.A N LYS 36.A O no hydrogen 2.759 N/A GLN 41.A N LYS 37.A O no hydrogen 2.886 N/A LEU 42.A N VAL 38.A O no hydrogen 3.092 N/A LYS 43.A N ILE 39.A O no hydrogen 3.053 N/A LYS 43.A NZ SER 51.A OG no hydrogen 3.080 N/A LEU 44.A N ASP 40.A O no hydrogen 3.272 N/A GLU 45.A N GLN 41.A O no hydrogen 2.797 N/A GLY 46.A N LYS 43.A O no hydrogen 2.595 N/A CYS 47.A N LEU 42.A O no hydrogen 2.926 N/A LYS 48.A N GLN 61.A O no hydrogen 2.838 N/A ASP 50.A N LEU 58.A O no hydrogen 2.945 N/A SER 51.A OG HIS 57.A ND1 no hydrogen 2.747 N/A VAL 52.A N GLY 56.A O no hydrogen 2.941 N/A LYS 55.A N VAL 52.A O no hydrogen 3.324 N/A GLY 56.A N VAL 52.A O no hydrogen 2.804 N/A HIS 57.A N ILE 19.A O no hydrogen 2.802 N/A HIS 57.A ND1 SER 51.A OG no hydrogen 2.747 N/A LEU 58.A N ASP 50.A O no hydrogen 2.933 N/A GLN 60.A N LYS 48.A O no hydrogen 2.679 N/A GLN 61.A N LYS 48.A O no hydrogen 3.176 N/A TRP 66.A N ASP 113.A OD1 no hydrogen 3.353 N/A TRP 66.A N ASP 113.A OD2 no hydrogen 3.467 N/A TYR 67.A OH GLU 45.A OE1 no hydrogen 2.695 N/A ILE 71.A N TYR 67.A O no hydrogen 3.047 N/A ASP 72.A N GLN 68.A O no hydrogen 2.840 N/A ASP 72.A N GLY 69.A O no hydrogen 3.230 N/A GLN 73.A N ILE 70.A O no hydrogen 2.881 N/A TYR 74.A OH TYR 241.A O no hydrogen 2.983 N/A THR 75.A N ILE 71.A O no hydrogen 3.336 N/A THR 75.A OG1 ASP 72.A O no hydrogen 3.003 N/A LYS 76.A N ASP 72.A O no hydrogen 3.039 N/A SER 77.A N GLN 73.A O no hydrogen 3.148 N/A SER 77.A OG GLN 73.A O no hydrogen 3.407 N/A SER 77.A OG TYR 74.A O no hydrogen 3.495 N/A LEU 80.A N SER 78.A OG no hydrogen 2.940 N/A PHE 81.A N SER 78.A OG no hydrogen 2.715 N/A ASP 82.A N SER 107.A O no hydrogen 2.820 N/A GLU 85.A N PHE 109.A O no hydrogen 2.956 N/A TYR 87.A N LEU 111.A O no hydrogen 3.080 N/A TYR 87.A OH GLU 85.A OE2 no hydrogen 3.040 N/A SER 89.A OG GLU 114.A OE1 no hydrogen 2.896 N/A ILE 90.A N GLU 114.A O no hydrogen 3.192 N/A SER 92.A N ASP 91.A OD1 no hydrogen 2.775 N/A SER 92.A OG GLN 115.A OE1 no hydrogen 3.447 N/A THR 93.A N GLN 115.A OE1 no hydrogen 2.811 N/A THR 93.A OG1 GLN 115.A OE1 no hydrogen 3.399 N/A THR 93.A OG1 SER 137.A OG no hydrogen 2.757 N/A GLN 94.A N SER 92.A OG no hydrogen 3.050 N/A ALA 96.A N SER 92.A O no hydrogen 2.929 N/A ALA 97.A N THR 93.A O no hydrogen 3.097 N/A LYS 98.A N GLN 94.A O no hydrogen 2.784 N/A LYS 98.A NZ GLU 193.A OE1 no hydrogen 3.022 N/A LYS 99.A N LEU 95.A O no hydrogen 3.005 N/A SER 100.A N ALA 96.A O no hydrogen 2.883 N/A SER 100.A OG GLU 85.A OE1 no hydrogen 3.284 N/A SER 100.A OG GLU 85.A OE2 no hydrogen 3.458 N/A VAL 102.A N LYS 99.A O no hydrogen 3.447 N/A SER 107.A N ASP 82.A OD2 no hydrogen 3.322 N/A PHE 108.A N VAL 139.A O no hydrogen 3.276 N/A ILE 110.A N SER 137.A O no hydrogen 2.997 N/A LEU 111.A N GLU 85.A O no hydrogen 2.895 N/A SER 112.A N TRP 135.A O no hydrogen 3.114 N/A SER 112.A OG GLU 114.A O no hydrogen 2.730 N/A ASP 113.A N TYR 87.A O no hydrogen 3.243 N/A GLU 114.A N SER 112.A OG no hydrogen 3.427 N/A GLN 115.A N SER 128.A O no hydrogen 3.196 N/A THR 116.A N ILE 90.A O no hydrogen 3.001 N/A THR 116.A OG1 ILE 90.A O no hydrogen 3.547 N/A LYS 117.A N ASP 91.A O no hydrogen 2.758 N/A ARG 119.A NH1 GLY 118.A O no hydrogen 3.340 N/A GLY 120.A N ARG 124.A O no hydrogen 2.775 N/A ARG 121.A NH2 ALA 318.A O no hydrogen 2.698 N/A ASN 123.A N GLY 120.A O no hydrogen 3.211 N/A ARG 124.A N ARG 121.A O no hydrogen 2.990 N/A TRP 126.A N GLY 118.A O no hydrogen 2.940 N/A SER 128.A OG TRP 126.A O no hydrogen 2.905 N/A GLN 132.A N SER 129.A O no hydrogen 3.429 N/A LEU 134.A N ILE 210.A O no hydrogen 2.954 N/A MET 136.A N ILE 208.A O no hydrogen 3.035 N/A SER 137.A N ILE 110.A O no hydrogen 3.223 N/A SER 137.A OG THR 93.A OG1 no hydrogen 2.757 N/A VAL 138.A N CYS 206.A O no hydrogen 2.800 N/A VAL 139.A N PHE 108.A O no hydrogen 2.698 N/A LEU 140.A N ILE 204.A O no hydrogen 3.137 N/A ARG 141.A NE SER 106.A O no hydrogen 2.771 N/A ARG 141.A NH1 GLU 202.A O no hydrogen 2.876 N/A ARG 141.A NH2 LEU 101.A O no hydrogen 3.276 N/A ARG 141.A NH2 SER 106.A O no hydrogen 3.164 N/A MET 148.A N ALA 145.A O no hydrogen 3.197 N/A ILE 149.A N PHE 146.A O no hydrogen 3.318 N/A SER 150.A OG SER 147.A O no hydrogen 3.265 N/A LYS 151.A NZ ASP 300.A O no hydrogen 3.462 N/A ASN 153.A N ILE 149.A O no hydrogen 3.279 N/A ASN 153.A ND2 ASN 178.A OD1 no hydrogen 3.480 N/A LEU 154.A N SER 150.A O no hydrogen 3.442 N/A PHE 155.A N LYS 151.A O no hydrogen 3.096 N/A ILE 156.A N PHE 152.A O no hydrogen 2.989 N/A ALA 157.A N ASN 153.A O no hydrogen 3.257 N/A LEU 158.A N PHE 155.A O no hydrogen 2.819 N/A GLY 159.A N PHE 155.A O no hydrogen 3.345 N/A ILE 160.A N ILE 156.A O no hydrogen 2.843 N/A ARG 161.A N ALA 157.A O no hydrogen 2.941 N/A ARG 161.A NH1 GLN 165.A OE1 no hydrogen 3.286 N/A ARG 161.A NH1 VAL 172.A O no hydrogen 2.723 N/A ASP 162.A N LEU 158.A O no hydrogen 2.950 N/A ALA 163.A N GLY 159.A O no hydrogen 3.067 N/A ILE 164.A N ILE 160.A O no hydrogen 3.314 N/A GLN 165.A N ARG 161.A O no hydrogen 2.657 N/A GLN 165.A NE2 GLN 165.A O no hydrogen 2.837 N/A GLN 165.A NE2 ASP 170.A O no hydrogen 3.387 N/A HIS 166.A N ASP 162.A O no hydrogen 2.956 N/A PHE 167.A N ILE 164.A O no hydrogen 3.008 N/A SER 168.A N GLN 165.A O no hydrogen 2.639 N/A SER 168.A OG ASP 170.A O no hydrogen 2.846 N/A SER 168.A OG HIS 233.A O no hydrogen 3.497 N/A GLN 169.A N HIS 233.A O no hydrogen 3.065 N/A GLN 169.A NE2 ASP 234.A OD1 no hydrogen 3.204 N/A VAL 172.A N GLN 165.A OE1 no hydrogen 3.094 N/A LYS 173.A N TYR 181.A O no hydrogen 2.791 N/A LYS 173.A NZ ALA 272.A O no hydrogen 2.695 N/A VAL 174.A N ALA 273.A O no hydrogen 2.806 N/A LYS 175.A N ASP 179.A O no hydrogen 2.786 N/A LYS 175.A NZ TYR 181.A OH no hydrogen 3.513 N/A LYS 175.A NZ ILE 320.A O no hydrogen 2.609 N/A ASP 179.A N LYS 175.A O no hydrogen 3.100 N/A ILE 180.A N CYS 188.A O no hydrogen 2.767 N/A TYR 181.A N LYS 173.A O no hydrogen 2.756 N/A ILE 182.A N GLY 185.A O no hydrogen 2.933 N/A GLY 185.A N ILE 182.A O no hydrogen 3.035 N/A LYS 186.A N ARG 226.A O no hydrogen 2.851 N/A LYS 186.A NZ ASP 179.A OD1 no hydrogen 2.455 N/A VAL 187.A N ILE 180.A O no hydrogen 2.868 N/A CYS 188.A N ILE 180.A O no hydrogen 3.208 N/A CYS 188.A SG GLY 209.A O no hydrogen 3.308 N/A GLY 189.A N GLY 209.A O no hydrogen 3.106 N/A PHE 190.A N ASN 178.A O no hydrogen 3.032 N/A LEU 191.A N GLY 207.A O no hydrogen 2.952 N/A THR 192.A OG1 ASN 153.A OD1 no hydrogen 2.803 N/A GLU 193.A N ILE 205.A O no hydrogen 3.182 N/A VAL 195.A N ALA 203.A O no hydrogen 3.203 N/A ASN 197.A N GLY 200.A O no hydrogen 3.178 N/A ASP 199.A N ASN 197.A OD1 no hydrogen 3.236 N/A ILE 201.A N VAL 144.A O no hydrogen 3.101 N/A GLU 202.A N VAL 195.A O no hydrogen 2.786 N/A ALA 203.A N VAL 195.A O no hydrogen 2.954 N/A ILE 204.A N LEU 140.A O no hydrogen 3.051 N/A ILE 205.A N GLU 193.A O no hydrogen 2.706 N/A CYS 206.A N VAL 138.A O no hydrogen 2.954 N/A CYS 206.A SG LEU 191.A O no hydrogen 4.004 N/A GLY 207.A N LEU 191.A O no hydrogen 2.836 N/A ILE 208.A N MET 136.A O no hydrogen 2.614 N/A GLY 209.A N GLY 189.A O no hydrogen 3.132 N/A ILE 210.A N LEU 134.A O no hydrogen 3.082 N/A ASN 211.A N VAL 187.A O no hydrogen 2.809 N/A LEU 212.A N GLN 132.A O no hydrogen 2.806 N/A THR 213.A N GLN 132.A O no hydrogen 2.787 N/A THR 213.A OG1 GLY 131.A O no hydrogen 3.265 N/A THR 213.A OG1 GLN 132.A O no hydrogen 3.544 N/A GLN 215.A N ASN 218.A OD1 no hydrogen 2.806 N/A ASN 218.A N GLN 215.A O no hydrogen 2.809 N/A PHE 219.A N LEU 216.A O no hydrogen 3.349 N/A ARG 224.A NE LEU 216.A O no hydrogen 3.240 N/A ARG 226.A N ILE 223.A O no hydrogen 2.640 N/A THR 228.A N LYS 186.A O no hydrogen 3.381 N/A THR 228.A OG1 HIS 233.A NE2 no hydrogen 3.123 N/A SER 229.A OG GLN 214.A O no hydrogen 2.952 N/A ILE 230.A N ASN 211.A O no hydrogen 3.023 N/A GLN 231.A N LEU 212.A O no hydrogen 2.916 N/A GLN 231.A NE2 GLN 231.A O no hydrogen 2.992 N/A GLN 231.A NE2 ASN 236.A O no hydrogen 3.326 N/A LEU 232.A N SER 229.A OG no hydrogen 3.188 N/A HIS 233.A N ILE 230.A O no hydrogen 2.710 N/A HIS 233.A ND1 ASP 170.A OD1 no hydrogen 3.132 N/A HIS 233.A NE2 THR 228.A OG1 no hydrogen 3.123 N/A ASP 234.A N GLN 231.A O no hydrogen 3.183 N/A LYS 235.A N GLN 169.A OE1 no hydrogen 2.907 N/A LYS 237.A NZ LEU 238.A O no hydrogen 3.475 N/A LEU 238.A N GLN 231.A OE1 no hydrogen 2.819 N/A ARG 240.A NH1 ASP 113.A OD1 no hydrogen 2.718 N/A TYR 241.A OH ILE 65.A O no hydrogen 2.475 N/A GLN 242.A N ASP 239.A O no hydrogen 3.031 N/A PHE 243.A N ASP 239.A O no hydrogen 2.952 N/A LEU 244.A N ARG 240.A O no hydrogen 3.073 N/A ARG 246.A N GLN 242.A O no hydrogen 3.312 N/A LEU 247.A N PHE 243.A O no hydrogen 2.729 N/A LEU 248.A N LEU 244.A O no hydrogen 2.731 N/A GLN 249.A N GLU 245.A O no hydrogen 3.183 N/A GLU 250.A N ARG 246.A O no hydrogen 2.775 N/A GLU 250.A N LEU 247.A O no hydrogen 3.159 N/A ILE 251.A N LEU 247.A O no hydrogen 2.810 N/A GLU 252.A N LEU 248.A O no hydrogen 3.047 N/A LYS 253.A N GLN 249.A O no hydrogen 3.242 N/A LYS 253.A NZ GLU 250.A OE2 no hydrogen 3.215 N/A ARG 254.A N GLU 250.A O no hydrogen 2.841 N/A ARG 254.A NE GLN 257.A OE1 no hydrogen 2.998 N/A ARG 254.A NH1 ASP 162.A OD2 no hydrogen 2.905 N/A ARG 254.A NH2 GLU 269.A OE2 no hydrogen 2.829 N/A TYR 255.A N ILE 251.A O no hydrogen 2.920 N/A ASN 256.A N GLU 252.A O no hydrogen 3.024 N/A ASN 256.A ND2 GLU 252.A O no hydrogen 3.657 N/A GLN 257.A N LYS 253.A O no hydrogen 3.030 N/A PHE 258.A N ARG 254.A O no hydrogen 3.042 N/A LEU 259.A N TYR 255.A O no hydrogen 2.876 N/A THR 260.A N ASN 256.A O no hydrogen 3.013 N/A THR 260.A N GLN 257.A O no hydrogen 3.011 N/A THR 260.A OG1 ASN 256.A O no hydrogen 2.831 N/A LEU 261.A N GLN 257.A O no hydrogen 2.786 N/A GLU 265.A N PRO 262.A O no hydrogen 3.253 N/A ARG 267.A N PHE 263.A O no hydrogen 2.838 N/A ARG 267.A NE LEU 297.A O no hydrogen 2.749 N/A ARG 267.A NH1 LEU 297.A O no hydrogen 3.543 N/A TYR 270.A N ILE 266.A O no hydrogen 3.111 N/A ILE 271.A N ARG 267.A O no hydrogen 3.135 N/A ALA 272.A N GLU 268.A O no hydrogen 3.387 N/A ALA 273.A N GLU 269.A O no hydrogen 3.085 N/A SER 274.A N ILE 271.A O no hydrogen 2.849 N/A SER 274.A OG VAL 174.A O no hydrogen 2.916 N/A ARG 279.A NH1 ASN 275.A O no hydrogen 2.970 N/A LEU 281.A N GLY 292.A O no hydrogen 2.815 N/A PHE 283.A N PHE 290.A O no hydrogen 2.879 N/A THR 284.A N ASP 319.A O no hydrogen 3.318 N/A GLU 285.A N LYS 288.A O no hydrogen 2.860 N/A LYS 288.A N GLU 285.A O no hydrogen 2.965 N/A PHE 290.A N PHE 283.A O no hydrogen 2.988 N/A LYS 291.A N GLU 308.A OE2 no hydrogen 3.134 N/A GLN 293.A N ARG 306.A O no hydrogen 2.878 N/A ILE 295.A N ILE 304.A O no hydrogen 3.095 N/A ASP 296.A N ILE 304.A O no hydrogen 3.388 N/A ASP 298.A N TYR 302.A O no hydrogen 3.083 N/A ASP 300.A N ASP 298.A OD1 no hydrogen 3.360 N/A GLY 301.A N ASP 298.A O no hydrogen 3.112 N/A LEU 303.A N LEU 315.A O no hydrogen 2.710 N/A ILE 304.A N ASP 296.A O no hydrogen 2.749 N/A VAL 305.A N HIS 313.A O no hydrogen 2.903 N/A ARG 306.A N GLN 293.A O no hydrogen 2.874 N/A ASP 307.A N GLU 311.A O no hydrogen 3.121 N/A GLU 308.A N LYS 291.A O no hydrogen 3.299 N/A GLY 310.A N ASP 307.A O no hydrogen 2.839 N/A HIS 313.A N VAL 305.A O no hydrogen 2.891 N/A ARG 314.A NE ASP 298.A OD2 no hydrogen 2.798 N/A ARG 314.A NH2 ASP 298.A OD2 no hydrogen 2.668 N/A LEU 315.A N LEU 303.A O no hydrogen 2.808 N/A ASP 321.A N LEU 282.A O no hydrogen 3.186 N/A