Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2ekl_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 3.A OH ASP 47.A OD1 no hydrogen 2.597 N/A THR 4.A OG1 THR 4.A O no hydrogen 2.187 N/A LYS 6.A N ASP 47.A OD2 no hydrogen 2.793 N/A ALA 7.A N GLN 27.A O no hydrogen 2.837 N/A LEU 8.A N ILE 48.A O no hydrogen 2.842 N/A ILE 9.A N ASP 29.A O no hydrogen 3.000 N/A THR 10.A N VAL 50.A O no hydrogen 3.051 N/A THR 10.A OG1 ASP 11.A OD2 no hydrogen 3.359 N/A THR 10.A OG1 VAL 50.A O no hydrogen 3.484 N/A THR 10.A OG1 THR 55.A OG1 no hydrogen 2.856 N/A ILE 13.A N TYR 30.A OH no hydrogen 3.277 N/A ILE 16.A N ASP 14.A OD1 no hydrogen 2.840 N/A LEU 17.A N ASP 14.A O no hydrogen 3.342 N/A LYS 19.A N GLU 15.A O no hydrogen 2.799 N/A LYS 19.A NZ GLU 23.A OE2 no hydrogen 2.659 N/A THR 20.A N ILE 16.A O no hydrogen 2.951 N/A THR 20.A OG1 ILE 16.A O no hydrogen 2.710 N/A LEU 21.A N LEU 17.A O no hydrogen 3.103 N/A ARG 22.A N ILE 18.A O no hydrogen 2.916 N/A GLU 23.A N LYS 19.A O no hydrogen 2.876 N/A LYS 24.A N LEU 21.A O no hydrogen 3.123 N/A GLY 25.A N ARG 22.A O no hydrogen 3.003 N/A ILE 26.A N LEU 21.A O no hydrogen 3.201 N/A GLN 27.A N VAL 5.A O no hydrogen 3.284 N/A ASP 29.A N ALA 7.A O no hydrogen 2.907 N/A MET 31.A N ILE 9.A O no hydrogen 2.849 N/A ILE 34.A N MET 31.A O no hydrogen 3.149 N/A GLU 38.A N SER 35.A OG no hydrogen 3.141 N/A LEU 39.A N SER 35.A O no hydrogen 2.957 N/A LEU 40.A N LYS 36.A O no hydrogen 3.340 N/A ASN 41.A N GLU 37.A O no hydrogen 3.210 N/A ILE 42.A N GLU 38.A O no hydrogen 3.164 N/A ILE 42.A N LEU 39.A O no hydrogen 3.167 N/A ILE 43.A N LEU 39.A O no hydrogen 2.791 N/A ASN 45.A N ILE 42.A O no hydrogen 2.996 N/A TYR 46.A N ILE 43.A O no hydrogen 3.173 N/A TYR 46.A OH ASP 29.A OD2 no hydrogen 2.615 N/A ASP 47.A N LYS 6.A O no hydrogen 2.950 N/A ILE 48.A N LYS 6.A O no hydrogen 3.138 N/A ILE 49.A N ILE 70.A O no hydrogen 3.156 N/A VAL 50.A N LEU 8.A O no hydrogen 2.751 N/A VAL 51.A N ALA 72.A O no hydrogen 2.789 N/A ARG 52.A N ASP 11.A OD2 no hydrogen 2.787 N/A ARG 54.A NE ASP 11.A OD1 no hydrogen 2.947 N/A ARG 54.A NH1 ILE 34.A O no hydrogen 3.411 N/A ARG 54.A NH2 THR 10.A O no hydrogen 2.915 N/A ARG 54.A NH2 ILE 34.A O no hydrogen 3.016 N/A THR 55.A N ASP 11.A OD2 no hydrogen 3.427 N/A THR 55.A OG1 THR 10.A OG1 no hydrogen 2.856 N/A THR 55.A OG1 ASP 11.A OD1 no hydrogen 3.060 N/A THR 55.A OG1 ASP 11.A OD2 no hydrogen 3.145 N/A LYS 56.A NZ SER 53.A O no hydrogen 2.936 N/A VAL 57.A N ASN 80.A O no hydrogen 2.918 N/A THR 58.A OG1 ASP 60.A OD1 no hydrogen 2.410 N/A VAL 61.A N THR 58.A O no hydrogen 3.009 N/A ILE 62.A N THR 58.A O no hydrogen 3.110 N/A GLU 63.A N LYS 59.A O no hydrogen 2.999 N/A LYS 64.A N ASP 60.A O no hydrogen 3.157 N/A LYS 64.A NZ LEU 40.A O no hydrogen 2.775 N/A GLY 65.A N VAL 61.A O no hydrogen 2.977 N/A LYS 66.A N LYS 64.A O no hydrogen 2.840 N/A LEU 68.A N GLY 65.A O no hydrogen 3.158 N/A LYS 69.A N ASP 47.A O no hydrogen 2.746 N/A LYS 69.A NZ TYR 3.A OH no hydrogen 3.295 N/A LYS 69.A NZ ASP 47.A OD1 no hydrogen 2.685 N/A LYS 69.A NZ LYS 67.A O no hydrogen 2.912 N/A ILE 70.A N ASP 47.A O no hydrogen 3.107 N/A ILE 71.A N LYS 92.A O no hydrogen 2.807 N/A ALA 72.A N ILE 49.A O no hydrogen 2.804 N/A ARG 73.A N VAL 94.A O no hydrogen 2.835 N/A ALA 74.A N VAL 51.A O no hydrogen 2.870 N/A GLY 75.A N ARG 73.A O no hydrogen 2.794 N/A ASN 80.A ND2 ARG 52.A O no hydrogen 3.110 N/A ASN 80.A ND2 THR 55.A O no hydrogen 2.753 N/A ILE 81.A N LEU 78.A O no hydrogen 3.129 N/A ASP 82.A N VAL 57.A O no hydrogen 3.075 N/A THR 83.A N ILE 81.A O no hydrogen 2.985 N/A THR 83.A OG1 GLU 84.A OE1 no hydrogen 3.234 N/A GLU 85.A N ASP 82.A OD1 no hydrogen 2.734 N/A ALA 86.A N ASP 82.A O no hydrogen 2.983 N/A GLU 87.A N THR 83.A O no hydrogen 3.000 N/A LYS 88.A N GLU 84.A O no hydrogen 3.177 N/A ARG 89.A N GLU 85.A O no hydrogen 3.165 N/A ASN 90.A N GLU 87.A O no hydrogen 2.814 N/A ILE 91.A N ALA 86.A O no hydrogen 2.879 N/A LYS 92.A N LYS 69.A O no hydrogen 3.052 N/A LYS 92.A NZ ALA 305.A O no hydrogen 3.303 N/A VAL 94.A N ILE 71.A O no hydrogen 2.922 N/A ALA 96.A N GLY 75.A O no hydrogen 3.012 N/A ALA 99.A N ALA 96.A O no hydrogen 3.193 N/A THR 101.A N GLY 98.A O no hydrogen 3.287 N/A THR 101.A OG1 GLY 98.A O no hydrogen 2.953 N/A SER 103.A OG THR 287.A OG1 no hydrogen 2.681 N/A ALA 104.A N SER 100.A O no hydrogen 2.995 N/A VAL 105.A N THR 101.A O no hydrogen 2.876 N/A GLU 106.A N ASP 102.A O no hydrogen 2.976 N/A LEU 107.A N SER 103.A O no hydrogen 3.113 N/A THR 108.A N ALA 104.A O no hydrogen 3.002 N/A THR 108.A OG1 ALA 104.A O no hydrogen 2.796 N/A THR 108.A OG1 THR 230.A OG1 no hydrogen 2.813 N/A ILE 109.A N VAL 105.A O no hydrogen 3.137 N/A GLY 110.A N GLU 106.A O no hydrogen 2.929 N/A LEU 111.A N LEU 107.A O no hydrogen 2.794 N/A MET 112.A N THR 108.A O no hydrogen 2.941 N/A ILE 113.A N ILE 109.A O no hydrogen 3.086 N/A ALA 114.A N GLY 110.A O no hydrogen 2.878 N/A ALA 115.A N LEU 111.A O no hydrogen 2.849 N/A ALA 116.A N MET 112.A O no hydrogen 2.983 N/A ARG 117.A N ILE 113.A O no hydrogen 2.896 N/A LYS 118.A NZ GLU 135.A O no hydrogen 3.469 N/A MET 119.A N ALA 114.A O no hydrogen 3.056 N/A SER 122.A N LYS 118.A O no hydrogen 3.203 N/A MET 123.A N MET 119.A O no hydrogen 2.801 N/A ALA 124.A N TYR 120.A O no hydrogen 2.902 N/A LEU 125.A N THR 121.A O no hydrogen 3.034 N/A ALA 126.A N SER 122.A O no hydrogen 2.906 N/A LYS 127.A N MET 123.A O no hydrogen 3.028 N/A SER 128.A N ALA 124.A O no hydrogen 3.200 N/A SER 128.A N LEU 125.A O no hydrogen 2.981 N/A SER 128.A OG LEU 125.A O no hydrogen 2.554 N/A GLY 129.A N ALA 126.A O no hydrogen 2.770 N/A ILE 130.A N LEU 125.A O no hydrogen 2.994 N/A LEU 137.A N ALA 116.A O no hydrogen 2.779 N/A GLY 141.A N GLY 164.A O no hydrogen 2.807 N/A LYS 142.A N LEU 139.A O no hydrogen 3.049 N/A LYS 142.A NZ GLU 138.A O no hydrogen 2.711 N/A THR 143.A N ASP 197.A OD2 no hydrogen 2.844 N/A ILE 144.A N LYS 166.A O no hydrogen 2.797 N/A GLY 145.A N VAL 198.A O no hydrogen 2.729 N/A ILE 146.A N LEU 168.A O no hydrogen 2.779 N/A VAL 147.A N SER 200.A O no hydrogen 2.968 N/A GLY 148.A N TYR 170.A O no hydrogen 2.855 N/A PHE 149.A N ASP 171.A OD2 no hydrogen 2.766 N/A THR 154.A N GLY 150.A O no hydrogen 2.958 N/A THR 154.A OG1 PHE 149.A O no hydrogen 3.493 N/A THR 154.A OG1 GLY 150.A O no hydrogen 2.776 N/A LYS 155.A NZ ASP 102.A OD1 no hydrogen 2.738 N/A VAL 156.A N ILE 152.A O no hydrogen 3.001 N/A GLY 157.A N GLY 153.A O no hydrogen 3.077 N/A ILE 158.A N THR 154.A O no hydrogen 3.045 N/A ILE 159.A N LYS 155.A O no hydrogen 3.026 N/A ALA 160.A N VAL 156.A O no hydrogen 2.849 N/A ASN 161.A N GLY 157.A O no hydrogen 2.919 N/A ASN 161.A ND2 ASN 183.A OD1 no hydrogen 2.959 N/A ALA 162.A N ILE 158.A O no hydrogen 3.194 N/A MET 163.A N ILE 159.A O no hydrogen 3.002 N/A MET 163.A N ALA 160.A O no hydrogen 3.014 N/A GLY 164.A N ASN 161.A O no hydrogen 2.902 N/A MET 165.A N ALA 160.A O no hydrogen 3.033 N/A LYS 166.A N LYS 142.A O no hydrogen 2.802 N/A LEU 168.A N ILE 144.A O no hydrogen 2.867 N/A ALA 169.A N LYS 185.A O no hydrogen 2.959 N/A TYR 170.A N ILE 146.A O no hydrogen 2.904 N/A LEU 173.A N ASP 171.A OD1 no hydrogen 2.856 N/A ARG 176.A N ASP 174.A OD1 no hydrogen 3.319 N/A ALA 179.A N ILE 175.A O no hydrogen 2.861 N/A GLU 180.A N ARG 176.A O no hydrogen 3.229 N/A LYS 181.A N GLU 177.A O no hydrogen 2.991 N/A ILE 182.A N ALA 179.A O no hydrogen 3.046 N/A ASN 183.A N GLU 180.A O no hydrogen 3.075 N/A ALA 184.A N ALA 179.A O no hydrogen 2.899 N/A LYS 185.A N VAL 167.A O no hydrogen 2.995 N/A VAL 187.A N ALA 169.A O no hydrogen 2.876 N/A GLU 191.A N SER 188.A OG no hydrogen 3.107 N/A LEU 192.A N SER 188.A O no hydrogen 3.007 N/A LEU 193.A N LEU 189.A O no hydrogen 2.850 N/A LYS 194.A N GLU 190.A O no hydrogen 2.961 N/A ASN 195.A N GLU 191.A O no hydrogen 3.093 N/A ASN 195.A N LEU 192.A O no hydrogen 3.297 N/A ASN 195.A ND2 GLU 191.A O no hydrogen 2.883 N/A SER 196.A OG LEU 192.A O no hydrogen 2.737 N/A ASP 197.A N THR 143.A O no hydrogen 2.759 N/A VAL 198.A N THR 143.A O no hydrogen 3.139 N/A ILE 199.A N ILE 226.A O no hydrogen 2.816 N/A SER 200.A N GLY 145.A O no hydrogen 2.932 N/A SER 200.A OG HIS 202.A NE2 no hydrogen 2.571 N/A LEU 201.A N VAL 228.A O no hydrogen 2.882 N/A HIS 202.A N VAL 147.A O no hydrogen 2.826 N/A HIS 202.A NE2 SER 200.A OG no hydrogen 2.571 N/A ILE 213.A N ALA 235.A O no hydrogen 2.973 N/A ASP 214.A N GLN 217.A OE1 no hydrogen 2.755 N/A TYR 215.A N ASP 214.A OD1 no hydrogen 2.602 N/A TYR 215.A OH ASP 243.A OD2 no hydrogen 3.112 N/A PHE 218.A N ASP 214.A O no hydrogen 3.002 N/A GLU 219.A N TYR 215.A O no hydrogen 3.027 N/A LEU 220.A N PRO 216.A O no hydrogen 3.129 N/A MET 221.A N GLN 217.A O no hydrogen 3.203 N/A MET 221.A N PHE 218.A O no hydrogen 3.295 N/A LYS 222.A NZ ASP 197.A OD1 no hydrogen 2.740 N/A ASN 224.A N LYS 249.A O no hydrogen 2.742 N/A ILE 226.A N ASP 197.A O no hydrogen 2.970 N/A ILE 227.A N ALA 252.A O no hydrogen 2.962 N/A VAL 228.A N ILE 199.A O no hydrogen 2.753 N/A ASN 229.A N ALA 254.A O no hydrogen 2.802 N/A ASN 229.A ND2 ARG 232.A O no hydrogen 3.042 N/A ASN 229.A ND2 TYR 253.A OH no hydrogen 3.098 N/A THR 230.A OG1 THR 108.A OG1 no hydrogen 2.813 N/A SER 231.A N ASN 229.A OD1 no hydrogen 2.928 N/A SER 231.A OG LEU 201.A O no hydrogen 3.298 N/A SER 231.A OG ASN 229.A OD1 no hydrogen 2.838 N/A ARG 232.A N SER 231.A OG no hydrogen 2.678 N/A ARG 232.A NH2 ASP 79.A OD1 no hydrogen 2.876 N/A ALA 235.A N ARG 232.A O no hydrogen 3.192 N/A VAL 236.A N ALA 233.A O no hydrogen 2.958 N/A ASN 237.A N ILE 213.A O no hydrogen 2.987 N/A ASN 237.A ND2 ASP 214.A OD1 no hydrogen 2.892 N/A ALA 240.A N ASN 237.A OD1 no hydrogen 2.936 N/A LEU 241.A N ASN 237.A O no hydrogen 2.908 N/A LEU 242.A N GLY 238.A O no hydrogen 2.996 N/A ASP 243.A N LYS 239.A O no hydrogen 3.070 N/A TYR 244.A N ALA 240.A O no hydrogen 2.936 N/A TYR 244.A OH GLU 219.A OE1 no hydrogen 2.633 N/A ILE 245.A N LEU 241.A O no hydrogen 2.864 N/A ILE 245.A N LEU 242.A O no hydrogen 3.237 N/A LYS 246.A N LEU 242.A O no hydrogen 2.926 N/A LYS 246.A NZ GLU 270.A OE2 no hydrogen 3.102 N/A LYS 247.A N ASP 243.A O no hydrogen 3.018 N/A GLY 248.A N ILE 245.A O no hydrogen 2.966 N/A LYS 249.A N TYR 244.A O no hydrogen 3.071 N/A LYS 249.A NZ PHE 218.A O no hydrogen 2.810 N/A LYS 249.A NZ MET 221.A O no hydrogen 2.865 N/A VAL 250.A N TYR 244.A O no hydrogen 3.284 N/A TYR 251.A N VAL 225.A O no hydrogen 2.881 N/A TYR 253.A N ARG 276.A O no hydrogen 2.899 N/A ALA 254.A N ILE 227.A O no hydrogen 2.824 N/A THR 255.A N ILE 278.A O no hydrogen 2.813 N/A THR 255.A OG1 ASN 229.A O no hydrogen 2.935 N/A THR 255.A OG1 VAL 257.A O no hydrogen 2.668 N/A ASP 256.A N ASN 229.A O no hydrogen 2.992 N/A VAL 257.A N THR 255.A OG1 no hydrogen 2.946 N/A PHE 258.A N GLU 261.A OE2 no hydrogen 2.892 N/A TRP 259.A NE1 VAL 236.A O no hydrogen 3.124 N/A ASN 260.A ND2 GLU 268.A OE1 no hydrogen 2.785 N/A LYS 264.A N GLU 268.A OE1 no hydrogen 3.499 N/A TRP 267.A NE1 GLU 265.A OE1 no hydrogen 2.902 N/A LEU 269.A N GLU 265.A O no hydrogen 2.951 N/A GLU 270.A N GLU 266.A O no hydrogen 3.045 N/A LEU 271.A N TRP 267.A O no hydrogen 3.093 N/A LEU 272.A N GLU 268.A O no hydrogen 2.980 N/A LYS 273.A N LEU 269.A O no hydrogen 3.145 N/A HIS 274.A N LEU 271.A O no hydrogen 3.038 N/A ARG 276.A NH1 GLY 248.A O no hydrogen 3.351 N/A ARG 276.A NH1 VAL 250.A O no hydrogen 2.891 N/A VAL 277.A N HIS 274.A O no hydrogen 3.055 N/A ILE 278.A N TYR 253.A O no hydrogen 2.794 N/A THR 280.A N THR 255.A O no hydrogen 2.930 N/A THR 280.A OG1 THR 255.A O no hydrogen 3.509 N/A THR 280.A OG1 ASP 256.A OD1 no hydrogen 2.712 N/A HIS 282.A N THR 280.A O no hydrogen 2.971 N/A HIS 282.A ND1 GLU 261.A OE1 no hydrogen 3.041 N/A HIS 282.A ND1 GLU 261.A OE2 no hydrogen 3.098 N/A ILE 283.A N ASP 256.A OD1 no hydrogen 2.755 N/A GLY 284.A N ASP 256.A OD2 no hydrogen 2.848 N/A GLN 286.A N ILE 283.A O no hydrogen 2.863 N/A THR 287.A N ALA 285.A O no hydrogen 3.134 N/A THR 287.A OG1 SER 103.A OG no hydrogen 2.681 N/A LYS 288.A NZ GLU 289.A OE2 no hydrogen 2.939 N/A GLU 289.A N GLU 289.A OE1 no hydrogen 2.697 N/A ALA 290.A N THR 287.A OG1 no hydrogen 2.990 N/A GLN 291.A N THR 287.A O no hydrogen 2.977 N/A LYS 292.A N LYS 288.A O no hydrogen 3.022 N/A ARG 293.A N GLU 289.A O no hydrogen 3.021 N/A ARG 293.A NE ALA 99.A O no hydrogen 2.933 N/A ARG 293.A NH2 ALA 99.A O no hydrogen 2.921 N/A VAL 294.A N ALA 290.A O no hydrogen 2.910 N/A ALA 295.A N GLN 291.A O no hydrogen 3.209 N/A GLU 296.A N LYS 292.A O no hydrogen 2.906 N/A MET 297.A N ARG 293.A O no hydrogen 2.770 N/A THR 298.A N VAL 294.A O no hydrogen 2.975 N/A THR 298.A OG1 ARG 73.A O no hydrogen 3.538 N/A THR 298.A OG1 VAL 294.A O no hydrogen 2.762 N/A THR 299.A N ALA 295.A O no hydrogen 2.934 N/A THR 299.A OG1 ALA 295.A O no hydrogen 2.712 N/A GLN 300.A N GLU 296.A O no hydrogen 2.802 N/A ASN 301.A N MET 297.A O no hydrogen 2.816 N/A ASN 301.A ND2 TYR 95.A O no hydrogen 2.792 N/A LEU 302.A N THR 298.A O no hydrogen 2.961 N/A LEU 303.A N THR 299.A O no hydrogen 2.975 N/A ASN 304.A N GLN 300.A O no hydrogen 3.002 N/A ALA 305.A N ASN 301.A O no hydrogen 3.089 N/A MET 306.A N LEU 302.A O no hydrogen 2.940 N/A LYS 307.A N LEU 303.A O no hydrogen 2.858 N/A GLU 308.A N ASN 304.A O no hydrogen 2.963 N/A LEU 309.A N ALA 305.A O no hydrogen 3.206 N/A LEU 309.A N MET 306.A O no hydrogen 3.092 N/A GLY 310.A N LYS 307.A O no hydrogen 2.897 N/A MET 311.A N MET 306.A O no hydrogen 2.947 N/A