Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2bks_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N LEU 168.A O no hydrogen 3.214 N/A VAL 3.A N ILE 166.A O no hydrogen 2.697 N/A LEU 5.A N GLY 164.A O no hydrogen 2.954 N/A THR 6.A N TYR 14.A O no hydrogen 2.711 N/A TYR 8.A N GLN 12.A O no hydrogen 2.930 N/A THR 11.A N TYR 8.A O no hydrogen 2.975 N/A GLN 12.A N TYR 8.A O no hydrogen 3.138 N/A GLN 12.A NE2 LEU 114.A O no hydrogen 3.089 N/A TYR 13.A OH ASN 7.A OD1 no hydrogen 3.111 N/A TYR 13.A OH ASN 156.A O no hydrogen 2.854 N/A TYR 14.A N THR 6.A O no hydrogen 3.105 N/A TYR 14.A OH GLU 116.A OE1 no hydrogen 2.480 N/A GLY 15.A N VAL 28.A O no hydrogen 2.904 N/A ILE 17.A N PHE 26.A O no hydrogen 3.109 N/A GLY 18.A N THR 91.A O no hydrogen 2.947 N/A ILE 19.A N GLN 24.A O no hydrogen 2.873 N/A GLY 20.A N ILE 89.A O no hydrogen 3.002 N/A THR 21.A N SER 62.A OG no hydrogen 3.185 N/A THR 21.A OG1 SER 64.A OG no hydrogen 2.674 N/A GLN 24.A N ILE 19.A O no hydrogen 2.801 N/A PHE 26.A N ILE 17.A O no hydrogen 3.045 N/A LYS 27.A N ASP 118.A OD1 no hydrogen 2.854 N/A VAL 28.A N GLY 15.A O no hydrogen 2.840 N/A VAL 29.A N GLY 119.A O no hydrogen 3.155 N/A ASP 31.A N VAL 121.A O no hydrogen 3.095 N/A THR 32.A N THR 217.A OG1 no hydrogen 2.863 N/A THR 32.A OG1 VAL 215.A O no hydrogen 2.616 N/A GLY 33.A N ASP 31.A OD2 no hydrogen 2.583 N/A SER 34.A N ASP 31.A O no hydrogen 3.395 N/A SER 34.A OG ASP 31.A OD1 no hydrogen 2.581 N/A SER 35.A OG PHE 125.A O no hydrogen 2.523 N/A ASN 36.A ND2 ILE 130.A O no hydrogen 3.010 N/A TRP 38.A N VAL 120.A O no hydrogen 2.910 N/A TRP 38.A NE1 TYR 76.A OH no hydrogen 2.823 N/A VAL 39.A N GLY 102.A O no hydrogen 3.182 N/A SER 41.A N VAL 104.A O no hydrogen 2.849 N/A SER 41.A OG GLU 103.A OE2 no hydrogen 2.825 N/A SER 42.A N PHE 57.A O no hydrogen 2.741 N/A SER 42.A OG PHE 57.A O no hydrogen 3.252 N/A LYS 43.A N SER 41.A OG no hydrogen 2.855 N/A CYS 44.A N SER 41.A O no hydrogen 2.926 N/A CYS 44.A SG SER 45.A O no hydrogen 3.580 N/A CYS 44.A SG THR 105.A O no hydrogen 3.364 N/A ARG 46.A NE CYS 44.A O no hydrogen 2.996 N/A ARG 46.A NH2 SER 42.A O no hydrogen 2.793 N/A LEU 47.A N SER 45.A OG no hydrogen 3.104 N/A TYR 48.A N SER 45.A O no hydrogen 2.940 N/A CYS 51.A N TYR 48.A O no hydrogen 2.885 N/A TYR 53.A N THR 49.A O no hydrogen 3.024 N/A TYR 53.A N ALA 50.A O no hydrogen 3.245 N/A HIS 54.A ND1 ALA 50.A O no hydrogen 2.796 N/A HIS 54.A NE2 ALA 115.A O no hydrogen 2.878 N/A LYS 55.A N ASP 118.A OD2 no hydrogen 3.032 N/A LYS 55.A NZ THR 25.A O no hydrogen 2.847 N/A PHE 57.A N PRO 40.A O no hydrogen 2.731 N/A SER 60.A N ASP 58.A OD1 no hydrogen 3.052 N/A SER 60.A OG ASP 58.A OD1 no hydrogen 2.549 N/A ASP 61.A N ASP 58.A O no hydrogen 3.157 N/A SER 62.A N ALA 59.A O no hydrogen 3.105 N/A SER 62.A OG ASP 88.A OD1 no hydrogen 2.662 N/A SER 63.A N THR 21.A O no hydrogen 3.064 N/A SER 63.A OG THR 21.A O no hydrogen 3.568 N/A SER 64.A N SER 62.A OG no hydrogen 3.372 N/A SER 64.A OG THR 21.A OG1 no hydrogen 2.674 N/A SER 64.A OG SER 62.A OG no hydrogen 3.275 N/A SER 64.A OG ASP 88.A OD2 no hydrogen 2.570 N/A LYS 66.A N GLN 87.A O no hydrogen 2.829 N/A GLY 69.A N LEU 85.A O no hydrogen 2.986 N/A THR 70.A N ASN 68.A OD1 no hydrogen 2.983 N/A THR 70.A OG1 ASN 68.A OD1 no hydrogen 2.838 N/A LEU 72.A N GLY 83.A O no hydrogen 2.870 N/A THR 73.A OG1 SER 82.A OG no hydrogen 2.882 N/A LEU 74.A N VAL 81.A O no hydrogen 2.730 N/A TYR 76.A N GLY 79.A O no hydrogen 2.776 N/A VAL 81.A N LEU 74.A O no hydrogen 2.990 N/A SER 82.A N GLU 106.A O no hydrogen 3.228 N/A SER 82.A OG LEU 72.A O no hydrogen 3.250 N/A SER 82.A OG THR 73.A OG1 no hydrogen 2.882 N/A GLY 83.A N LEU 72.A O no hydrogen 2.860 N/A PHE 84.A N GLU 103.A O no hydrogen 2.980 N/A LEU 85.A N THR 70.A O no hydrogen 2.760 N/A SER 86.A N PHE 101.A O no hydrogen 2.834 N/A SER 86.A OG GLU 103.A OE1 no hydrogen 2.659 N/A GLN 87.A N LYS 66.A O no hydrogen 3.015 N/A ASP 88.A N GLN 99.A O no hydrogen 3.145 N/A ILE 89.A N ASP 88.A OD2 no hydrogen 2.529 N/A ILE 90.A N VAL 97.A O no hydrogen 2.737 N/A THR 91.A N GLY 18.A O no hydrogen 2.621 N/A VAL 92.A N ILE 95.A O no hydrogen 2.897 N/A ILE 95.A N VAL 92.A O no hydrogen 2.901 N/A VAL 97.A N ILE 90.A O no hydrogen 3.068 N/A GLN 99.A N ASP 88.A O no hydrogen 2.899 N/A PHE 101.A N SER 86.A O no hydrogen 2.714 N/A GLY 102.A N VAL 37.A O no hydrogen 2.720 N/A GLU 103.A N PHE 84.A O no hydrogen 2.688 N/A VAL 104.A N VAL 39.A O no hydrogen 2.995 N/A THR 105.A N SER 82.A O no hydrogen 2.922 N/A GLU 106.A N SER 82.A O no hydrogen 3.099 N/A PHE 112.A N PRO 108.A O no hydrogen 3.151 N/A MET 113.A N ALA 109.A O no hydrogen 2.667 N/A LEU 114.A N PRO 111.A O no hydrogen 2.953 N/A ALA 115.A N PHE 112.A O no hydrogen 3.094 N/A GLU 116.A N GLN 12.A OE1 no hydrogen 2.701 N/A ASP 118.A N LYS 27.A O no hydrogen 2.779 N/A GLY 119.A N LYS 27.A O no hydrogen 3.001 N/A VAL 120.A N TRP 38.A O no hydrogen 2.994 N/A VAL 121.A N VAL 29.A O no hydrogen 2.907 N/A GLY 122.A N ASN 36.A O no hydrogen 2.823 N/A MET 123.A N ASP 31.A O no hydrogen 2.792 N/A GLY 124.A N SER 34.A O no hydrogen 2.769 N/A GLU 127.A N GLU 127.A OE1 no hydrogen 2.506 N/A GLN 128.A N PHE 125.A O no hydrogen 3.129 N/A ALA 129.A N ILE 126.A O no hydrogen 3.043 N/A ILE 130.A N ASN 36.A OD1 no hydrogen 2.794 N/A ASP 138.A N PRO 135.A O no hydrogen 2.998 N/A ASN 139.A N PRO 135.A O no hydrogen 3.223 N/A ILE 140.A N ILE 136.A O no hydrogen 3.130 N/A ILE 141.A N PHE 137.A O no hydrogen 3.048 N/A SER 142.A N ASP 138.A O no hydrogen 2.997 N/A SER 142.A OG ASP 138.A O no hydrogen 3.035 N/A GLN 143.A N ILE 140.A O no hydrogen 3.008 N/A GLY 144.A N ILE 141.A O no hydrogen 2.843 N/A LYS 147.A NZ VAL 145.A O no hydrogen 3.224 N/A PHE 151.A N PHE 317.A O no hydrogen 3.013 N/A SER 152.A N VAL 167.A O no hydrogen 2.923 N/A SER 152.A OG GLY 170.A O no hydrogen 2.634 N/A SER 152.A OG SER 171.A OG no hydrogen 2.595 N/A PHE 153.A N THR 315.A O no hydrogen 2.781 N/A TYR 154.A N GLN 165.A O no hydrogen 2.852 N/A TYR 155.A OH THR 217.A O no hydrogen 2.751 N/A ASN 156.A N GLY 163.A O no hydrogen 3.064 N/A GLU 160.A N SER 159.A OG no hydrogen 2.417 N/A GLN 165.A N TYR 154.A O no hydrogen 2.703 N/A GLN 165.A NE2 ASP 172.A OD1 no hydrogen 3.237 N/A ILE 166.A N VAL 3.A O no hydrogen 3.051 N/A VAL 167.A N SER 152.A O no hydrogen 2.908 N/A LEU 168.A N SER 1.A O no hydrogen 2.606 N/A GLY 169.A N VAL 150.A O no hydrogen 2.804 N/A SER 171.A OG SER 152.A OG no hydrogen 2.595 N/A SER 171.A OG GLU 316.A OE2 no hydrogen 3.065 N/A ASP 172.A N TYR 314.A OH no hydrogen 2.849 N/A GLN 174.A N ASP 172.A OD2 no hydrogen 3.044 N/A HIS 175.A N ASP 172.A O no hydrogen 2.909 N/A GLU 177.A N LEU 328.A O no hydrogen 2.939 N/A HIS 181.A N PHE 326.A O no hydrogen 3.055 N/A TYR 182.A OH GLU 316.A OE1 no hydrogen 3.042 N/A ILE 183.A N ILE 324.A O no hydrogen 2.881 N/A LEU 185.A N ASN 322.A O no hydrogen 2.820 N/A ILE 186.A N GLN 192.A O no hydrogen 3.222 N/A LYS 187.A NZ THR 188.A O no hydrogen 2.724 N/A TRP 191.A NE1 MET 123.A O no hydrogen 3.034 N/A GLN 192.A N VAL 190.A O no hydrogen 2.677 N/A ILE 193.A N ALA 213.A O no hydrogen 2.717 N/A MET 195.A N CYS 211.A O no hydrogen 2.852 N/A LYS 196.A N HIS 261.A O no hydrogen 2.950 N/A VAL 198.A N LEU 206.A O no hydrogen 3.187 N/A SER 199.A N SER 259.A O no hydrogen 3.007 N/A GLY 201.A N ASP 257.A O no hydrogen 2.883 N/A SER 203.A OG VAL 200.A O no hydrogen 3.285 N/A SER 203.A OG SER 203.A O no hydrogen 2.647 N/A LEU 205.A N SER 203.A O no hydrogen 2.499 N/A CYS 207.A SG MET 195.A O no hydrogen 3.383 N/A CYS 207.A SG CYS 207.A O no hydrogen 2.791 N/A GLY 210.A N CYS 207.A O no hydrogen 3.216 N/A CYS 211.A N MET 195.A O no hydrogen 3.032 N/A CYS 211.A SG MET 195.A O no hydrogen 3.787 N/A ALA 213.A N ILE 193.A O no hydrogen 2.763 N/A LEU 214.A N TRP 303.A O no hydrogen 2.880 N/A VAL 215.A N TRP 191.A O no hydrogen 2.966 N/A ASP 216.A N LEU 305.A O no hydrogen 3.034 N/A THR 217.A N THR 32.A OG1 no hydrogen 2.945 N/A THR 217.A OG1 PHE 30.A O no hydrogen 2.597 N/A GLY 218.A N ASP 216.A OD2 no hydrogen 3.099 N/A ALA 219.A N ASP 216.A O no hydrogen 3.179 N/A SER 220.A OG THR 11.A O no hydrogen 2.664 N/A ILE 222.A N ALA 289.A O no hydrogen 3.270 N/A SER 223.A N ALA 304.A O no hydrogen 2.734 N/A GLY 224.A N HIS 291.A O no hydrogen 3.256 N/A SER 225.A OG SER 228.A OG no hydrogen 2.976 N/A THR 226.A N ASP 294.A OD2 no hydrogen 2.991 N/A THR 226.A OG1 ASP 294.A OD1 no hydrogen 2.629 N/A SER 228.A N SER 225.A OG no hydrogen 3.234 N/A SER 228.A OG SER 225.A OG no hydrogen 2.976 N/A ILE 229.A N SER 225.A O no hydrogen 2.942 N/A GLU 230.A N THR 226.A O no hydrogen 3.057 N/A LYS 231.A N SER 227.A O no hydrogen 3.329 N/A LEU 232.A N SER 228.A O no hydrogen 2.978 N/A MET 233.A N ILE 229.A O no hydrogen 2.757 N/A GLU 234.A N GLU 230.A O no hydrogen 2.878 N/A ALA 235.A N LYS 231.A O no hydrogen 3.023 N/A LEU 236.A N MET 233.A O no hydrogen 2.769 N/A GLY 237.A N MET 233.A O no hydrogen 2.884 N/A GLY 237.A N GLU 234.A O no hydrogen 3.175 N/A ALA 238.A N MET 233.A O no hydrogen 3.227 N/A LYS 239.A N VAL 246.A O no hydrogen 2.877 N/A ARG 241.A N ASP 244.A O no hydrogen 2.794 N/A ARG 241.A NH1 ASP 244.A OD1 no hydrogen 2.963 N/A ARG 241.A NH1 ASP 244.A OD2 no hydrogen 3.356 N/A TYR 245.A OH GLU 230.A OE1 no hydrogen 2.816 N/A VAL 246.A N LYS 239.A O no hydrogen 2.897 N/A VAL 247.A N CYS 286.A O no hydrogen 3.016 N/A LYS 248.A N GLU 251.A OE2 no hydrogen 3.377 N/A LYS 248.A NZ ASN 250.A OD1 no hydrogen 2.912 N/A LYS 248.A NZ SER 282.A O no hydrogen 2.909 N/A CYS 249.A N LYS 284.A O no hydrogen 3.013 N/A CYS 249.A SG SER 279.A OG no hydrogen 3.779 N/A ASN 250.A N SER 281.A O no hydrogen 3.276 N/A GLU 251.A N LYS 248.A O no hydrogen 2.849 N/A GLY 252.A N CYS 249.A O no hydrogen 2.789 N/A THR 254.A N GLU 251.A O no hydrogen 3.214 N/A THR 254.A OG1 GLU 251.A O no hydrogen 2.797 N/A LEU 255.A N GLY 252.A O no hydrogen 3.128 N/A ILE 258.A N LEU 269.A O no hydrogen 2.913 N/A SER 259.A N SER 199.A O no hydrogen 2.769 N/A SER 259.A OG THR 268.A OG1 no hydrogen 2.895 N/A PHE 260.A N TYR 267.A O no hydrogen 2.718 N/A HIS 261.A N GLY 197.A O no hydrogen 2.829 N/A LEU 262.A N LYS 265.A O no hydrogen 2.874 N/A LYS 265.A N LEU 262.A O no hydrogen 3.053 N/A TYR 267.A N PHE 260.A O no hydrogen 2.944 N/A THR 268.A OG1 SER 259.A OG no hydrogen 2.895 N/A LEU 269.A N ILE 258.A O no hydrogen 2.726 N/A THR 270.A N ASP 273.A OD1 no hydrogen 2.751 N/A SER 271.A OG GLY 252.A O no hydrogen 3.146 N/A ASP 273.A N THR 270.A O no hydrogen 2.848 N/A TYR 274.A N SER 271.A O no hydrogen 3.109 N/A TYR 274.A OH PRO 256.A O no hydrogen 2.809 N/A VAL 275.A N SER 271.A O no hydrogen 2.914 N/A PHE 276.A N THR 287.A O no hydrogen 2.943 N/A SER 281.A N SER 279.A OG no hydrogen 3.328 N/A LYS 283.A N SER 281.A OG no hydrogen 2.780 N/A CYS 286.A N VAL 247.A O no hydrogen 2.834 N/A CYS 286.A SG PHE 276.A O no hydrogen 3.565 N/A CYS 286.A SG SER 279.A O no hydrogen 3.968 N/A THR 287.A OG1 ASP 244.A OD1 no hydrogen 3.354 N/A LEU 288.A N TYR 245.A O no hydrogen 3.140 N/A ALA 289.A N TYR 274.A O no hydrogen 2.554 N/A HIS 291.A N ILE 222.A O no hydrogen 2.947 N/A MET 293.A N GLY 224.A O no hydrogen 2.814 N/A GLY 300.A N PRO 296.A O no hydrogen 3.045 N/A THR 302.A OG1 GLN 192.A OE1 no hydrogen 3.059 N/A THR 302.A OG1 TRP 303.A O no hydrogen 2.875 N/A TRP 303.A N LEU 212.A O no hydrogen 2.905 N/A ALA 304.A N SER 223.A O no hydrogen 2.706 N/A LEU 305.A N LEU 214.A O no hydrogen 2.790 N/A ALA 307.A N ALA 219.A O no hydrogen 2.826 N/A THR 308.A OG1 SER 220.A O no hydrogen 3.297 N/A THR 308.A OG1 ALA 289.A O no hydrogen 2.914 N/A PHE 309.A N GLY 306.A O no hydrogen 2.933 N/A ILE 310.A N GLY 306.A O no hydrogen 2.932 N/A ARG 311.A N ALA 307.A O no hydrogen 2.814 N/A ARG 311.A NH1 ASP 10.A O no hydrogen 2.942 N/A ARG 311.A NH1 TYR 13.A OH no hydrogen 3.105 N/A LYS 312.A N PHE 309.A O no hydrogen 3.025 N/A PHE 313.A N PHE 309.A O no hydrogen 3.025 N/A THR 315.A N PHE 153.A O no hydrogen 3.197 N/A THR 315.A OG1 PHE 313.A O no hydrogen 2.939 N/A GLU 316.A N GLY 325.A O no hydrogen 2.980 N/A PHE 317.A N PHE 151.A O no hydrogen 2.745 N/A ASP 318.A N ARG 323.A O no hydrogen 2.985 N/A ARG 319.A N ASP 149.A O no hydrogen 2.839 N/A ARG 319.A NH1 ASP 138.A OD1 no hydrogen 2.944 N/A ARG 319.A NH2 ASP 138.A OD1 no hydrogen 2.726 N/A ARG 320.A N ASP 149.A O no hydrogen 3.372 N/A ASN 321.A N ASP 318.A OD2 no hydrogen 3.021 N/A ARG 323.A N ASP 318.A O no hydrogen 3.247 N/A ARG 323.A NH1 ASP 318.A OD1 no hydrogen 3.378 N/A ILE 324.A N ILE 183.A O no hydrogen 2.956 N/A GLY 325.A N GLU 316.A O no hydrogen 2.933 N/A PHE 326.A N HIS 181.A O no hydrogen 3.175 N/A ALA 327.A N TYR 314.A O no hydrogen 3.176 N/A ALA 329.A N LYS 312.A O no hydrogen 2.978 N/A ARG 330.A N HIS 175.A O no hydrogen 2.767 N/A