Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3jsk_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 7.A N SER 3.A O no hydrogen 2.920 N/A GLU 8.A N LYS 4.A O no hydrogen 2.747 N/A LEU 9.A N PRO 5.A O no hydrogen 3.163 N/A MET 10.A N LEU 6.A O no hydrogen 3.103 N/A THR 12.A N LEU 9.A O no hydrogen 2.810 N/A LEU 13.A N MET 10.A O no hydrogen 3.048 N/A THR 15.A N THR 12.A O no hydrogen 3.105 N/A THR 15.A OG1 THR 12.A O no hydrogen 2.590 N/A ALA 17.A N THR 15.A OG1 no hydrogen 3.296 N/A PHE 18.A N THR 15.A O no hydrogen 3.067 N/A THR 19.A OG1 PHE 20.A O no hydrogen 3.494 N/A THR 27.A N ARG 24.A O no hydrogen 2.838 N/A VAL 28.A N GLU 25.A O no hydrogen 2.836 N/A SER 29.A N GLU 25.A O no hydrogen 3.076 N/A ARG 30.A N SER 26.A O no hydrogen 2.946 N/A ALA 31.A N THR 27.A O no hydrogen 2.973 N/A MET 32.A N VAL 28.A O no hydrogen 3.110 N/A THR 33.A N SER 29.A O no hydrogen 3.009 N/A THR 33.A OG1 SER 29.A O no hydrogen 3.159 N/A THR 33.A OG1 ARG 30.A O no hydrogen 3.520 N/A ARG 34.A N ARG 30.A O no hydrogen 3.033 N/A ARG 35.A NH1 ALA 31.A O no hydrogen 3.112 N/A TYR 36.A N MET 32.A O no hydrogen 2.915 N/A PHE 37.A N THR 33.A O no hydrogen 3.005 N/A ALA 38.A N ARG 35.A O no hydrogen 3.078 N/A ASP 39.A N ARG 35.A O no hydrogen 2.987 N/A LEU 40.A N TYR 36.A O no hydrogen 2.757 N/A ASP 41.A N PHE 37.A O no hydrogen 2.998 N/A ALA 42.A N ALA 38.A O no hydrogen 2.983 N/A HIS 43.A N ASP 39.A O no hydrogen 2.779 N/A HIS 43.A ND1 THR 74.A OG1 no hydrogen 2.637 N/A ALA 44.A N ASP 41.A O no hydrogen 3.208 N/A THR 46.A N ASN 188.A O no hydrogen 2.841 N/A THR 46.A OG1 ARG 72.A O no hydrogen 3.230 N/A THR 46.A OG1 THR 74.A OG1 no hydrogen 2.741 N/A ILE 48.A N ARG 72.A O no hydrogen 3.192 N/A VAL 49.A N VAL 191.A O no hydrogen 3.121 N/A ILE 50.A N THR 74.A O no hydrogen 2.787 N/A VAL 51.A N ILE 193.A O no hydrogen 2.893 N/A GLY 52.A N VAL 76.A O no hydrogen 2.859 N/A ALA 53.A N GLU 77.A OE2 no hydrogen 2.814 N/A CYS 56.A SG MET 268.A O no hydrogen 3.562 N/A CYS 56.A SG SER 271.A OG no hydrogen 3.424 N/A LEU 58.A N GLY 54.A O no hydrogen 2.841 N/A SER 59.A N SER 55.A O no hydrogen 3.049 N/A SER 59.A OG SER 55.A O no hydrogen 2.936 N/A ALA 60.A N CYS 56.A O no hydrogen 2.887 N/A ALA 61.A N GLY 57.A O no hydrogen 2.763 N/A TYR 62.A N LEU 58.A O no hydrogen 2.968 N/A TYR 62.A OH GLU 108.A OE2 no hydrogen 2.604 N/A VAL 63.A N SER 59.A O no hydrogen 3.116 N/A LEU 64.A N ALA 60.A O no hydrogen 2.825 N/A SER 65.A N ALA 61.A O no hydrogen 2.977 N/A SER 65.A OG ALA 61.A O no hydrogen 3.229 N/A SER 65.A OG TYR 62.A O no hydrogen 3.343 N/A THR 66.A N TYR 62.A O no hydrogen 3.135 N/A THR 66.A OG1 TYR 62.A O no hydrogen 2.773 N/A LEU 67.A N VAL 63.A O no hydrogen 2.974 N/A ARG 68.A N LEU 64.A O no hydrogen 2.934 N/A ARG 68.A NE ASP 70.A OD1 no hydrogen 2.918 N/A ARG 68.A NE ASP 70.A OD2 no hydrogen 3.443 N/A ARG 68.A NH2 ASP 70.A OD2 no hydrogen 3.164 N/A LEU 71.A N ARG 68.A O no hydrogen 2.938 N/A ARG 72.A N ASP 47.A OD2 no hydrogen 2.660 N/A ILE 73.A N ASN 141.A O no hydrogen 2.906 N/A THR 74.A N ILE 48.A O no hydrogen 2.905 N/A THR 74.A OG1 HIS 43.A ND1 no hydrogen 2.637 N/A THR 74.A OG1 THR 46.A OG1 no hydrogen 2.741 N/A ILE 75.A N LYS 143.A O no hydrogen 2.924 N/A VAL 76.A N ILE 50.A O no hydrogen 2.762 N/A GLU 77.A N PHE 145.A O no hydrogen 2.961 N/A GLY 79.A N GLU 77.A OE1 no hydrogen 2.579 N/A GLY 83.A N ALA 53.A O no hydrogen 2.809 N/A ALA 86.A N GLY 83.A O no hydrogen 2.898 N/A TRP 87.A NE1 PRO 82.A O no hydrogen 2.954 N/A GLY 89.A N PHE 93.A O no hydrogen 2.566 N/A PHE 93.A N GLY 90.A O no hydrogen 2.793 N/A MET 96.A N VAL 122.A O no hydrogen 3.148 N/A MET 98.A N VAL 120.A O no hydrogen 3.012 N/A ARG 99.A NH1 MET 227.A O no hydrogen 2.932 N/A LYS 100.A N ASP 118.A O no hydrogen 2.762 N/A LYS 100.A NZ ASP 115.A OD1 no hydrogen 2.796 N/A LYS 100.A NZ ASP 115.A OD2 no hydrogen 2.772 N/A LYS 100.A NZ GLY 117.A O no hydrogen 2.677 N/A ALA 102.A N ARG 99.A O no hydrogen 3.030 N/A VAL 104.A N PRO 101.A O no hydrogen 2.847 N/A PHE 105.A N ALA 102.A O no hydrogen 3.328 N/A ASP 107.A N ASP 103.A O no hydrogen 2.962 N/A GLU 108.A N VAL 104.A O no hydrogen 3.276 N/A VAL 109.A N PHE 105.A O no hydrogen 2.994 N/A GLY 110.A N ASP 107.A O no hydrogen 3.358 N/A VAL 111.A N LEU 106.A O no hydrogen 2.888 N/A TYR 113.A OH ASP 107.A OD1 no hydrogen 2.720 N/A GLU 114.A N VAL 121.A O no hydrogen 3.007 N/A GLU 116.A N TYR 119.A O no hydrogen 2.811 N/A GLY 117.A N ASP 115.A OD1 no hydrogen 2.805 N/A VAL 120.A N MET 98.A O no hydrogen 2.978 N/A VAL 121.A N GLU 114.A O no hydrogen 3.032 N/A VAL 122.A N MET 96.A O no hydrogen 2.791 N/A ALA 125.A N SER 94.A O no hydrogen 2.840 N/A ALA 126.A N HIS 124.A ND1 no hydrogen 3.047 N/A LEU 127.A N HIS 124.A O no hydrogen 2.907 N/A PHE 128.A N ALA 125.A O no hydrogen 2.924 N/A THR 129.A N ALA 125.A O no hydrogen 3.191 N/A THR 129.A OG1 ALA 86.A O no hydrogen 2.485 N/A THR 129.A OG1 ALA 125.A O no hydrogen 3.552 N/A SER 130.A N ALA 126.A O no hydrogen 2.872 N/A SER 130.A OG ALA 126.A O no hydrogen 2.758 N/A SER 130.A OG LEU 127.A O no hydrogen 3.487 N/A THR 131.A N LEU 127.A O no hydrogen 3.122 N/A THR 131.A OG1 LEU 127.A O no hydrogen 2.636 N/A VAL 132.A N PHE 128.A O no hydrogen 2.937 N/A LEU 133.A N THR 129.A O no hydrogen 2.863 N/A SER 134.A N SER 130.A O no hydrogen 2.895 N/A LYS 135.A N THR 131.A O no hydrogen 3.069 N/A LYS 135.A NZ VAL 109.A O no hydrogen 2.926 N/A VAL 136.A N VAL 132.A O no hydrogen 2.934 N/A VAL 136.A N LEU 133.A O no hydrogen 3.082 N/A LEU 137.A N LEU 133.A O no hydrogen 2.805 N/A GLN 138.A N SER 134.A O no hydrogen 3.059 N/A ARG 139.A N VAL 136.A O no hydrogen 3.235 N/A ASN 141.A ND2 LEU 71.A O no hydrogen 2.837 N/A VAL 142.A N ARG 139.A O no hydrogen 3.433 N/A LYS 143.A N ILE 73.A O no hydrogen 3.036 N/A LYS 143.A NZ ASP 39.A OD2 no hydrogen 2.717 N/A PHE 145.A N ILE 75.A O no hydrogen 2.827 N/A ASN 146.A ND2 VAL 80.A O no hydrogen 2.909 N/A ALA 147.A N GLY 79.A O no hydrogen 3.396 N/A THR 148.A N GLU 77.A O no hydrogen 3.146 N/A THR 148.A OG1 PHE 145.A O no hydrogen 3.517 N/A THR 148.A OG1 ASN 146.A O no hydrogen 3.093 N/A THR 149.A N ASN 169.A O no hydrogen 2.880 N/A THR 149.A OG1 THR 171.A OG1 no hydrogen 2.674 N/A GLU 151.A N VAL 167.A O no hydrogen 2.825 N/A LEU 153.A N ASP 152.A OD1 no hydrogen 2.779 N/A ILE 154.A N GLY 165.A O no hydrogen 2.844 N/A ARG 156.A N ARG 162.A O no hydrogen 3.041 N/A ARG 156.A NH1 THR 155.A O no hydrogen 2.752 N/A HIS 158.A N LYS 160.A O no hydrogen 2.658 N/A ARG 162.A N ARG 156.A O no hydrogen 2.985 N/A ILE 163.A N PRO 243.A O no hydrogen 2.837 N/A ALA 164.A N ILE 154.A O no hydrogen 2.830 N/A VAL 166.A N ILE 187.A O no hydrogen 3.026 N/A VAL 167.A N ASP 152.A O no hydrogen 2.770 N/A THR 168.A N ASN 185.A O no hydrogen 2.910 N/A ASN 169.A ND2 GLU 151.A OE1 no hydrogen 3.337 N/A ASN 169.A ND2 MET 182.A O no hydrogen 3.340 N/A ASN 169.A ND2 ASP 183.A O no hydrogen 3.492 N/A TRP 170.A N ASN 169.A OD1 no hydrogen 3.005 N/A THR 171.A N ALA 147.A O no hydrogen 2.827 N/A THR 171.A OG1 ALA 78.A O no hydrogen 2.479 N/A THR 171.A OG1 THR 149.A OG1 no hydrogen 2.674 N/A VAL 173.A N TRP 170.A O no hydrogen 3.085 N/A SER 174.A N TRP 170.A O no hydrogen 3.178 N/A SER 174.A OG GLU 151.A OE2 no hydrogen 2.789 N/A SER 174.A OG TRP 170.A O no hydrogen 3.084 N/A MET 175.A N THR 171.A O no hydrogen 3.134 N/A HIS 176.A N VAL 173.A O no hydrogen 2.968 N/A HIS 177.A NE2 GLU 151.A OE2 no hydrogen 2.553 N/A ASP 179.A N HIS 176.A O no hydrogen 3.139 N/A ASN 185.A N THR 168.A O no hydrogen 2.737 N/A THR 186.A N ASN 185.A OD1 no hydrogen 2.633 N/A ILE 187.A N VAL 166.A O no hydrogen 3.082 N/A ASN 188.A N ALA 44.A O no hydrogen 2.786 N/A ALA 189.A N ALA 164.A O no hydrogen 3.110 N/A ILE 192.A N GLY 244.A O no hydrogen 2.836 N/A ILE 193.A N VAL 49.A O no hydrogen 2.758 N/A SER 194.A N ILE 246.A O no hydrogen 2.697 N/A SER 194.A OG SER 206.A OG no hydrogen 2.554 N/A SER 194.A OG GLU 251.A OE1 no hydrogen 2.815 N/A SER 194.A OG GLU 251.A OE2 no hydrogen 3.238 N/A THR 195.A N VAL 51.A O no hydrogen 2.936 N/A THR 195.A OG1 VAL 51.A O no hydrogen 2.836 N/A THR 195.A OG1 GLY 52.A O no hydrogen 2.876 N/A THR 196.A N GLU 251.A OE1 no hydrogen 2.842 N/A THR 196.A OG1 GLU 251.A OE1 no hydrogen 2.553 N/A HIS 198.A ND1 ASP 199.A O no hydrogen 2.985 N/A ASP 199.A N GLU 254.A OE2 no hydrogen 2.793 N/A ALA 204.A N THR 196.A O no hydrogen 3.280 N/A ALA 204.A N GLY 197.A O no hydrogen 2.792 N/A PHE 205.A N THR 196.A OG1 no hydrogen 2.931 N/A SER 206.A OG SER 194.A OG no hydrogen 2.554 N/A VAL 207.A N GLU 251.A OE2 no hydrogen 3.120 N/A LYS 208.A N ALA 204.A O no hydrogen 3.282 N/A LYS 208.A NZ ASP 199.A OD1 no hydrogen 3.057 N/A LYS 208.A NZ GLY 203.A O no hydrogen 3.298 N/A ARG 209.A N PHE 205.A O no hydrogen 2.963 N/A ARG 209.A NE ASP 152.A OD1 no hydrogen 2.621 N/A ARG 209.A NH1 SER 212.A OG no hydrogen 2.889 N/A ARG 209.A NH2 ASP 152.A OD1 no hydrogen 3.194 N/A ARG 209.A NH2 ASP 152.A OD2 no hydrogen 2.831 N/A LEU 210.A N SER 206.A O no hydrogen 3.132 N/A VAL 211.A N LYS 208.A O no hydrogen 3.232 N/A SER 212.A N LYS 208.A O no hydrogen 3.265 N/A SER 212.A OG ARG 209.A O no hydrogen 3.266 N/A MET 213.A N ARG 209.A O no hydrogen 2.837 N/A LYS 214.A N VAL 211.A O no hydrogen 2.714 N/A LYS 214.A NZ SER 212.A O no hydrogen 2.943 N/A GLN 215.A N LEU 210.A O no hydrogen 2.739 N/A GLN 215.A NE2 ALA 159.A O no hydrogen 3.371 N/A GLN 215.A NE2 MET 213.A O no hydrogen 3.089 N/A GLY 221.A N GLU 254.A O no hydrogen 2.857 N/A MET 222.A N GLU 254.A OE1 no hydrogen 3.035 N/A ARG 223.A N ALA 258.A O no hydrogen 2.957 N/A ARG 223.A NE ASN 220.A O no hydrogen 3.083 N/A ARG 223.A NE GLY 221.A O no hydrogen 3.127 N/A ARG 223.A NH2 ASN 220.A O no hydrogen 2.677 N/A ASP 226.A N ARG 260.A O no hydrogen 3.086 N/A SER 229.A N ASP 226.A OD1 no hydrogen 3.399 N/A ALA 230.A N ASP 226.A O no hydrogen 2.812 N/A GLU 231.A N MET 227.A O no hydrogen 3.235 N/A ALA 233.A N SER 229.A O no hydrogen 3.300 N/A ILE 234.A N ALA 230.A O no hydrogen 2.973 N/A VAL 235.A N GLU 231.A O no hydrogen 3.075 N/A ASN 236.A N ASP 232.A O no hydrogen 2.946 N/A ASN 237.A N ALA 233.A O no hydrogen 3.105 N/A ASN 237.A ND2 ALA 233.A O no hydrogen 2.909 N/A THR 238.A N VAL 235.A O no hydrogen 3.322 N/A THR 238.A OG1 ILE 234.A O no hydrogen 2.849 N/A THR 238.A OG1 SER 271.A OG no hydrogen 2.887 N/A ARG 239.A NE ASN 237.A O no hydrogen 2.949 N/A ARG 239.A NH2 ASP 256.A OD2 no hydrogen 2.971 N/A ILE 241.A N LEU 245.A O no hydrogen 2.732 N/A GLY 244.A N GLU 240.A OE2 no hydrogen 2.897 N/A LEU 245.A N VAL 242.A O no hydrogen 2.868 N/A ILE 246.A N ILE 192.A O no hydrogen 2.729 N/A VAL 247.A N ARG 239.A O no hydrogen 3.109 N/A GLY 248.A N SER 194.A O no hydrogen 3.347 N/A GLY 249.A N SER 271.A OG no hydrogen 2.675 N/A LEU 252.A N GLY 249.A O no hydrogen 3.128 N/A SER 253.A OG MET 250.A O no hydrogen 2.741 N/A GLU 254.A N GLU 251.A O no hydrogen 3.008 N/A ASP 256.A N LEU 252.A O no hydrogen 3.014 N/A ALA 258.A N SER 253.A O no hydrogen 3.214 N/A ARG 260.A N GLY 224.A O no hydrogen 2.971 N/A THR 264.A N GLY 262.A O no hydrogen 2.882 N/A THR 264.A OG1 VAL 97.A O no hydrogen 2.936 N/A PHE 265.A N VAL 97.A O no hydrogen 2.858 N/A ALA 267.A N GLU 231.A OE1 no hydrogen 2.811 N/A ALA 269.A N PHE 265.A O no hydrogen 3.508 N/A LEU 270.A N GLY 266.A O no hydrogen 3.184 N/A SER 271.A N ALA 267.A O no hydrogen 2.840 N/A SER 271.A OG THR 238.A OG1 no hydrogen 2.887 N/A GLY 272.A N MET 268.A O no hydrogen 3.001 N/A VAL 273.A N ALA 269.A O no hydrogen 3.025 N/A LYS 274.A N LEU 270.A O no hydrogen 2.817 N/A ALA 275.A N SER 271.A O no hydrogen 2.922 N/A ALA 276.A N GLY 272.A O no hydrogen 3.108 N/A HIS 277.A N VAL 273.A O no hydrogen 3.163 N/A GLU 278.A N LYS 274.A O no hydrogen 2.931 N/A ALA 279.A N ALA 275.A O no hydrogen 3.011 N/A ILE 280.A N ALA 276.A O no hydrogen 3.159 N/A ARG 281.A N HIS 277.A O no hydrogen 2.947 N/A ARG 281.A NE GLU 278.A OE1 no hydrogen 3.359 N/A ARG 281.A NE GLU 278.A OE2 no hydrogen 3.087 N/A ARG 281.A NH2 GLU 278.A OE1 no hydrogen 3.086 N/A VAL 282.A N GLU 278.A O no hydrogen 2.831 N/A PHE 283.A N ALA 279.A O no hydrogen 2.737 N/A LEU 285.A N VAL 282.A O no hydrogen 3.051 N/A ARG 286.A N VAL 282.A O no hydrogen 3.156 N/A ARG 286.A NE GLU 240.A OE2 no hydrogen 2.820 N/A ARG 286.A NH2 GLU 240.A OE1 no hydrogen 3.085 N/A ARG 286.A NH2 GLU 240.A OE2 no hydrogen 3.184 N/A LYS 287.A N PHE 283.A O no hydrogen 2.751 N/A LYS 287.A NZ ASP 291.A OD2 no hydrogen 3.207 N/A ALA 288.A N ASP 284.A O no hydrogen 3.183 N/A GLN 289.A N LEU 285.A O no hydrogen 3.090 N/A ASN 290.A N ARG 286.A O no hydrogen 2.836 N/A