Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4dib_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 4.A N GLU 27.A O no hydrogen 2.606 N/A ALA 5.A N VAL 91.A O no hydrogen 2.951 N/A ILE 6.A N ALA 30.A O no hydrogen 3.268 N/A ASN 7.A N ILE 93.A O no hydrogen 2.763 N/A ASN 7.A ND2 GLU 94.A OE2 no hydrogen 3.486 N/A GLY 8.A N ASN 32.A O no hydrogen 2.790 N/A ARG 11.A NH1 ASP 47.A OD1 no hydrogen 3.557 N/A ARG 11.A NH1 ASP 47.A OD2 no hydrogen 2.570 N/A ARG 11.A NH2 ASP 47.A OD1 no hydrogen 3.449 N/A ARG 14.A N GLY 10.A O no hydrogen 3.060 N/A ARG 14.A NH2 LEU 43.A O no hydrogen 3.392 N/A MET 15.A N ARG 11.A O no hydrogen 2.942 N/A VAL 16.A N ILE 12.A O no hydrogen 2.712 N/A PHE 17.A N GLY 13.A O no hydrogen 2.728 N/A ARG 18.A N ARG 14.A O no hydrogen 3.003 N/A ARG 18.A NH1 GLY 51.A O no hydrogen 2.969 N/A GLN 19.A N MET 15.A O no hydrogen 3.238 N/A GLN 19.A N VAL 16.A O no hydrogen 3.189 N/A ALA 20.A N VAL 16.A O no hydrogen 2.666 N/A ILE 21.A N PHE 17.A O no hydrogen 2.978 N/A LYS 22.A N GLN 19.A O no hydrogen 3.392 N/A GLU 23.A N ALA 20.A O no hydrogen 2.704 N/A GLU 27.A N THR 2.A O no hydrogen 3.140 N/A VAL 29.A N VAL 4.A O no hydrogen 3.052 N/A ILE 31.A N ARG 72.A O no hydrogen 2.901 N/A ASN 32.A N ILE 6.A O no hydrogen 2.993 N/A ASN 32.A ND2 ASN 7.A OD1 no hydrogen 3.008 N/A ASN 32.A ND2 ASN 76.A O no hydrogen 3.001 N/A ALA 33.A N LEU 74.A O no hydrogen 3.051 N/A SER 37.A OG PHE 60.A O no hydrogen 2.739 N/A THR 39.A N PRO 36.A O no hydrogen 2.770 N/A LEU 40.A N PRO 36.A O no hydrogen 3.321 N/A ALA 41.A N SER 37.A O no hydrogen 2.932 N/A HIS 42.A N GLU 38.A O no hydrogen 3.235 N/A LEU 43.A N THR 39.A O no hydrogen 2.729 N/A ILE 44.A N LEU 40.A O no hydrogen 2.883 N/A LYS 45.A N ALA 41.A O no hydrogen 3.050 N/A TYR 46.A N HIS 42.A O no hydrogen 3.090 N/A ASP 47.A N GLY 51.A O no hydrogen 2.787 N/A HIS 50.A N ASP 47.A OD1 no hydrogen 2.893 N/A PHE 53.A N LYS 45.A O no hydrogen 2.847 N/A GLU 58.A N LEU 65.A O no hydrogen 2.931 N/A PHE 60.A N HIS 63.A O no hydrogen 2.905 N/A LEU 64.A N ILE 71.A O no hydrogen 2.834 N/A LEU 65.A N GLU 58.A O no hydrogen 3.062 N/A VAL 66.A N LYS 69.A O no hydrogen 2.988 N/A ASP 67.A N THR 56.A O no hydrogen 2.951 N/A LYS 69.A N VAL 66.A O no hydrogen 2.840 N/A LYS 69.A NZ ILE 21.A O no hydrogen 3.107 N/A ILE 71.A N LEU 64.A O no hydrogen 2.926 N/A ARG 72.A N VAL 29.A O no hydrogen 3.067 N/A LEU 73.A N ASP 62.A O no hydrogen 2.991 N/A LEU 74.A N ILE 31.A O no hydrogen 2.896 N/A ASN 76.A N ASN 32.A OD1 no hydrogen 2.923 N/A ASN 76.A ND2 GLU 81.A OE1 no hydrogen 3.003 N/A ASP 78.A N ASN 76.A OD1 no hydrogen 2.829 N/A GLU 81.A N ASP 78.A O no hydrogen 2.718 N/A LEU 82.A N PRO 79.A O no hydrogen 3.175 N/A TRP 84.A N LEU 82.A O no hydrogen 2.909 N/A TRP 84.A NE1 HIS 108.A ND1 no hydrogen 3.272 N/A THR 85.A OG1 ALA 111.A O no hydrogen 3.020 N/A LEU 87.A N PRO 83.A O no hydrogen 3.263 N/A GLY 88.A N THR 85.A O no hydrogen 3.201 N/A VAL 89.A N TRP 84.A O no hydrogen 2.900 N/A GLU 90.A N ARG 3.A O no hydrogen 3.040 N/A VAL 92.A N LYS 115.A O no hydrogen 2.907 N/A ILE 93.A N ALA 5.A O no hydrogen 2.654 N/A GLU 94.A N ILE 117.A O no hydrogen 2.806 N/A ALA 95.A N ASN 7.A O no hydrogen 2.713 N/A THR 96.A N GLU 94.A OE2 no hydrogen 2.727 N/A THR 96.A OG1 GLU 94.A OE2 no hydrogen 2.378 N/A LYS 98.A N THR 96.A OG1 no hydrogen 3.290 N/A LYS 102.A N LYS 123.A O no hydrogen 3.131 N/A LYS 102.A NZ ASP 126.A OD1 no hydrogen 3.121 N/A ALA 105.A N SER 101.A O no hydrogen 3.043 N/A ILE 106.A N LYS 102.A O no hydrogen 3.249 N/A LEU 107.A N LYS 104.A O no hydrogen 3.275 N/A HIS 108.A NE2 GLU 94.A OE1 no hydrogen 2.886 N/A VAL 109.A N ILE 106.A O no hydrogen 2.656 N/A GLU 110.A N ILE 106.A O no hydrogen 3.064 N/A ALA 111.A N LEU 107.A O no hydrogen 2.688 N/A GLY 112.A N VAL 109.A O no hydrogen 2.877 N/A ALA 113.A N HIS 108.A O no hydrogen 2.965 N/A LYS 115.A N GLU 90.A O no hydrogen 2.984 N/A LYS 115.A NZ ILE 140.A O no hydrogen 2.965 N/A LYS 115.A NZ HIS 143.A O no hydrogen 2.333 N/A LYS 115.A NZ THR 144.A OG1 no hydrogen 3.148 N/A VAL 116.A N THR 144.A O no hydrogen 3.119 N/A ILE 117.A N VAL 92.A O no hydrogen 2.948 N/A LEU 118.A N ILE 146.A O no hydrogen 2.788 N/A THR 119.A N GLU 94.A O no hydrogen 3.322 N/A THR 119.A OG1 GLU 94.A O no hydrogen 3.101 N/A LYS 123.A N ASN 100.A O no hydrogen 3.100 N/A GLU 125.A N GLU 125.A OE2 no hydrogen 2.731 N/A ASP 126.A N VAL 145.A O no hydrogen 3.136 N/A THR 128.A OG1 GLU 125.A OE1 no hydrogen 2.815 N/A ILE 129.A N SER 147.A O no hydrogen 2.729 N/A VAL 130.A N ASN 134.A OD1 no hydrogen 2.659 N/A VAL 133.A N VAL 130.A O no hydrogen 3.010 N/A ASN 134.A N VAL 130.A O no hydrogen 3.203 N/A ASN 134.A ND2 THR 128.A O no hydrogen 2.595 N/A GLN 137.A N ASN 134.A O no hydrogen 3.073 N/A LEU 138.A N GLU 135.A O no hydrogen 2.968 N/A THR 141.A OG1 ASP 139.A OD2 no hydrogen 3.153 N/A LYS 142.A N ASP 139.A O no hydrogen 3.235 N/A LYS 142.A N ASP 139.A OD2 no hydrogen 2.933 N/A HIS 143.A N ASP 139.A O no hydrogen 2.870 N/A THR 144.A N ASP 126.A OD2 no hydrogen 2.391 N/A VAL 145.A N ASP 126.A OD2 no hydrogen 2.993 N/A ILE 146.A N VAL 116.A O no hydrogen 2.929 N/A SER 147.A N VAL 127.A O no hydrogen 2.745 N/A SER 147.A OG ALA 120.A O no hydrogen 2.896 N/A ASN 148.A N LEU 118.A O no hydrogen 3.169 N/A ALA 149.A N SER 147.A OG no hydrogen 3.089 N/A SER 150.A OG THR 153.A OG1 no hydrogen 2.891 N/A CYS 151.A SG ASN 301.A O no hydrogen 3.658 N/A THR 152.A OG1 TYR 299.A OH no hydrogen 3.043 N/A THR 153.A N SER 150.A OG no hydrogen 3.184 N/A THR 153.A OG1 SER 150.A OG no hydrogen 2.891 N/A ASN 154.A N SER 150.A O no hydrogen 3.178 N/A ASN 154.A ND2 ASN 148.A O no hydrogen 2.934 N/A ASN 154.A ND2 SER 150.A O no hydrogen 2.691 N/A CYS 155.A N CYS 151.A O no hydrogen 3.001 N/A CYS 155.A SG ALA 297.A O no hydrogen 3.854 N/A LEU 156.A N THR 152.A O no hydrogen 2.744 N/A ALA 157.A N THR 153.A O no hydrogen 2.961 N/A VAL 160.A N LEU 156.A O no hydrogen 2.803 N/A LYS 161.A N ALA 157.A O no hydrogen 2.853 N/A LYS 161.A NZ GLU 165.A OE2 no hydrogen 3.018 N/A VAL 162.A N PRO 158.A O no hydrogen 2.998 N/A LEU 163.A N VAL 159.A O no hydrogen 3.147 N/A ASP 164.A N VAL 160.A O no hydrogen 3.253 N/A GLU 165.A N LYS 161.A O no hydrogen 3.110 N/A GLN 166.A N VAL 162.A O no hydrogen 3.338 N/A PHE 167.A N LEU 163.A O no hydrogen 2.866 N/A GLY 168.A N ASP 164.A O no hydrogen 3.051 N/A ILE 169.A N ASP 164.A OD2 no hydrogen 3.226 N/A GLU 170.A N ASP 233.A O no hydrogen 2.730 N/A ASN 171.A N ASP 233.A O no hydrogen 3.433 N/A GLY 172.A N LYS 212.A O no hydrogen 2.970 N/A LEU 173.A N VAL 231.A O no hydrogen 2.784 N/A THR 175.A N ASP 229.A O no hydrogen 2.816 N/A THR 176.A N MET 216.A O no hydrogen 3.052 N/A VAL 177.A N LEU 227.A O no hydrogen 2.881 N/A HIS 178.A N LEU 218.A O no hydrogen 2.947 N/A ALA 179.A N SER 226.A OG no hydrogen 2.984 N/A ARG 183.A NE THR 194.A OG1 no hydrogen 2.716 N/A ARG 183.A NH2 THR 195.A O no hydrogen 3.109 N/A ARG 185.A N ARG 182.A O no hydrogen 3.062 N/A CYS 187.A SG ARG 185.A O no hydrogen 3.356 N/A ILE 192.A N ARG 219.A O no hydrogen 2.897 N/A THR 194.A N ALA 217.A O no hydrogen 2.933 N/A THR 194.A OG1 THR 195.A O no hydrogen 3.434 N/A ALA 201.A N GLY 197.A O no hydrogen 3.044 N/A LEU 202.A N ALA 199.A O no hydrogen 3.271 N/A ALA 203.A N LYS 200.A O no hydrogen 2.515 N/A LYS 204.A N ALA 201.A O no hydrogen 2.882 N/A LEU 206.A N LEU 202.A O no hydrogen 2.686 N/A LEU 209.A N LEU 206.A O no hydrogen 3.255 N/A ASN 210.A N PRO 207.A O no hydrogen 2.940 N/A LYS 212.A N LEU 209.A O no hydrogen 3.096 N/A MET 216.A N MET 174.A O no hydrogen 3.255 N/A ALA 217.A N THR 194.A O no hydrogen 2.838 N/A LEU 218.A N THR 176.A O no hydrogen 2.729 N/A ARG 219.A N ILE 192.A O no hydrogen 2.874 N/A VAL 220.A N HIS 178.A O no hydrogen 2.936 N/A THR 222.A N VAL 220.A O no hydrogen 2.904 N/A ASN 224.A ND2 ASN 272.A OD1 no hydrogen 3.681 N/A SER 226.A N TYR 299.A O no hydrogen 2.896 N/A SER 226.A OG VAL 177.A O no hydrogen 3.489 N/A SER 226.A OG ASN 301.A OD1 no hydrogen 2.849 N/A LEU 227.A N VAL 177.A O no hydrogen 2.918 N/A VAL 228.A N ALA 297.A O no hydrogen 2.830 N/A ASP 229.A N THR 175.A O no hydrogen 2.511 N/A LEU 230.A N VAL 295.A O no hydrogen 2.896 N/A VAL 231.A N LEU 173.A O no hydrogen 2.857 N/A VAL 232.A N VAL 293.A O no hydrogen 2.821 N/A ASP 233.A N ASN 171.A O no hydrogen 2.663 N/A VAL 234.A N ARG 291.A O no hydrogen 3.327 N/A LYS 235.A N PHE 167.A O no hydrogen 3.042 N/A LYS 235.A N GLY 168.A O no hydrogen 3.145 N/A ARG 236.A NH2 GLN 166.A O no hydrogen 2.564 N/A VAL 238.A N ASP 290.A O no hydrogen 2.853 N/A ALA 242.A N THR 239.A OG1 no hydrogen 2.908 N/A ILE 243.A N THR 239.A O no hydrogen 3.179 N/A ASN 244.A N VAL 240.A O no hydrogen 3.240 N/A ASN 244.A ND2 GLY 282.A O no hydrogen 3.293 N/A ASP 245.A N GLU 241.A O no hydrogen 3.067 N/A ASP 245.A N ALA 242.A O no hydrogen 3.260 N/A ALA 246.A N ALA 242.A O no hydrogen 3.103 N/A PHE 247.A N ILE 243.A O no hydrogen 3.218 N/A LYS 248.A N ASN 244.A O no hydrogen 3.053 N/A THR 249.A N ASP 245.A O no hydrogen 2.851 N/A THR 249.A OG1 ASP 245.A O no hydrogen 3.017 N/A VAL 250.A N ALA 246.A O no hydrogen 3.174 N/A ALA 251.A N PHE 247.A O no hydrogen 2.918 N/A GLY 253.A N VAL 250.A O no hydrogen 2.982 N/A LEU 255.A N VAL 250.A O no hydrogen 3.100 N/A LYS 256.A N GLY 253.A O no hydrogen 2.685 N/A ILE 258.A N LEU 255.A O no hydrogen 2.590 N/A VAL 259.A N LEU 255.A O no hydrogen 3.006 N/A GLU 260.A N ALA 278.A O no hydrogen 2.930 N/A SER 262.A N ILE 280.A O no hydrogen 2.780 N/A GLU 263.A N GLU 263.A OE1 no hydrogen 2.286 N/A VAL 267.A N ASP 270.A OD2 no hydrogen 2.762 N/A ASP 270.A N VAL 267.A O no hydrogen 2.902 N/A PHE 271.A N SER 268.A O no hydrogen 3.137 N/A ASN 272.A ND2 VAL 49.A O no hydrogen 3.664 N/A THR 273.A N ASP 300.A OD2 no hydrogen 3.124 N/A ASN 274.A N PHE 271.A O no hydrogen 3.086 N/A ASN 274.A ND2 GLU 260.A OE1 no hydrogen 2.815 N/A HIS 276.A N ASN 274.A OD1 no hydrogen 3.070 N/A SER 277.A N ILE 258.A O no hydrogen 2.654 N/A ALA 278.A N ILE 258.A O no hydrogen 3.266 N/A ILE 279.A N TRP 298.A O no hydrogen 2.613 N/A ILE 280.A N GLU 260.A O no hydrogen 2.672 N/A ASP 281.A N LEU 296.A O no hydrogen 2.821 N/A GLY 282.A N SER 262.A O no hydrogen 2.840 N/A SER 284.A N ASP 281.A O no hydrogen 2.733 N/A SER 284.A OG ASP 281.A OD1 no hydrogen 2.622 N/A THR 285.A N GLY 282.A O no hydrogen 3.251 N/A THR 285.A OG1 ASN 244.A OD1 no hydrogen 2.539 N/A MET 286.A N LYS 294.A O no hydrogen 3.041 N/A MET 288.A N LYS 292.A O no hydrogen 2.878 N/A ARG 291.A NE ASP 237.A OD1 no hydrogen 2.882 N/A LYS 292.A N MET 288.A O no hydrogen 3.197 N/A VAL 293.A N VAL 232.A O no hydrogen 2.647 N/A LYS 294.A N MET 286.A O no hydrogen 2.995 N/A LYS 294.A NZ ASP 229.A OD1 no hydrogen 2.760 N/A LYS 294.A NZ ASP 229.A OD2 no hydrogen 3.565 N/A VAL 295.A N LEU 230.A O no hydrogen 3.016 N/A ALA 297.A N VAL 228.A O no hydrogen 3.154 N/A TRP 298.A N ILE 279.A O no hydrogen 2.693 N/A TRP 298.A NE1 ASP 281.A OD2 no hydrogen 3.085 N/A TYR 299.A N SER 226.A O no hydrogen 2.965 N/A TYR 299.A OH THR 152.A OG1 no hydrogen 3.043 N/A GLU 302.A N ASP 300.A OD1 no hydrogen 2.856 N/A TRP 303.A N ASP 300.A OD1 no hydrogen 2.311 N/A GLY 304.A N ASP 300.A O no hydrogen 3.252 N/A TYR 305.A OH ALA 149.A O no hydrogen 2.473 N/A SER 306.A N GLU 302.A O no hydrogen 2.869 N/A SER 306.A OG GLU 302.A O no hydrogen 2.853 N/A ARG 307.A N TRP 303.A O no hydrogen 3.250 N/A ARG 307.A NH1 ARG 307.A O no hydrogen 3.172 N/A ARG 308.A N GLY 304.A O no hydrogen 3.009 N/A ARG 308.A NH1 THR 275.A O no hydrogen 2.963 N/A ARG 308.A NH1 SER 277.A OG no hydrogen 2.955 N/A ARG 308.A NH2 THR 275.A O no hydrogen 3.386 N/A VAL 309.A N TYR 305.A O no hydrogen 2.874 N/A VAL 310.A N SER 306.A O no hydrogen 3.155 N/A ASP 311.A N ARG 307.A O no hydrogen 2.887 N/A LEU 312.A N ARG 308.A O no hydrogen 2.670 N/A VAL 313.A N VAL 309.A O no hydrogen 2.701 N/A THR 314.A N VAL 310.A O no hydrogen 2.836 N/A THR 314.A OG1 VAL 310.A O no hydrogen 2.742 N/A LEU 315.A N ASP 311.A O no hydrogen 3.130 N/A LEU 315.A N LEU 312.A O no hydrogen 3.180 N/A VAL 316.A N LEU 312.A O no hydrogen 3.107 N/A VAL 317.A N VAL 313.A O no hydrogen 3.218 N/A ASP 318.A N LEU 315.A O no hydrogen 3.229 N/A GLU 319.A N VAL 316.A O no hydrogen 2.977 N/A LEU 320.A N VAL 316.A O no hydrogen 3.463 N/A GLN 323.A N GLU 319.A O no hydrogen 2.722 N/A