Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2jed_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 2.A NZ GLU 4.A OE1 no hydrogen 3.201 N/A ASP 5.A N LYS 2.A O no hydrogen 3.148 N/A PHE 6.A N ILE 3.A O no hydrogen 3.220 N/A GLU 7.A N GLU 24.A O no hydrogen 2.879 N/A HIS 9.A N LEU 22.A O no hydrogen 2.857 N/A HIS 9.A NE2 GLU 24.A OE1 no hydrogen 2.971 N/A LEU 12.A N VAL 20.A O no hydrogen 2.747 N/A GLY 13.A N VAL 20.A O no hydrogen 3.378 N/A GLY 15.A N GLY 18.A O no hydrogen 2.823 N/A GLY 18.A N GLY 15.A O no hydrogen 2.846 N/A LYS 19.A N ALA 36.A O no hydrogen 3.406 N/A LYS 19.A NZ ARG 300.A O no hydrogen 2.861 N/A VAL 20.A N GLY 13.A O no hydrogen 3.003 N/A PHE 21.A N ILE 34.A O no hydrogen 2.854 N/A LEU 22.A N LYS 10.A O no hydrogen 2.829 N/A ALA 23.A N PHE 32.A O no hydrogen 2.979 N/A GLU 24.A N GLU 7.A O no hydrogen 3.006 N/A PHE 25.A N GLN 30.A O no hydrogen 2.832 N/A LYS 26.A N ASP 5.A O no hydrogen 2.839 N/A THR 28.A N PHE 25.A O no hydrogen 3.246 N/A ASN 29.A N PHE 25.A O no hydrogen 2.858 N/A PHE 32.A N ALA 23.A O no hydrogen 2.737 N/A ALA 33.A N MET 84.A O no hydrogen 2.835 N/A ILE 34.A N PHE 21.A O no hydrogen 2.876 N/A LYS 35.A N PHE 82.A O no hydrogen 3.076 N/A LYS 35.A NZ PHE 17.A O no hydrogen 2.645 N/A LYS 35.A NZ GLU 54.A OE1 no hydrogen 3.201 N/A ALA 36.A N LYS 19.A O no hydrogen 2.787 N/A LEU 37.A N LEU 80.A O no hydrogen 2.859 N/A LYS 38.A NZ GLU 78.A OE1 no hydrogen 3.116 N/A LYS 38.A NZ ASN 79.A OD1 no hydrogen 2.940 N/A LYS 39.A N GLU 78.A O no hydrogen 2.771 N/A LYS 39.A NZ GLN 75.A OE1 no hydrogen 2.809 N/A LYS 39.A NZ THR 76.A O no hydrogen 2.781 N/A VAL 42.A N LYS 38.A O no hydrogen 2.988 N/A LEU 43.A N LYS 39.A O no hydrogen 3.078 N/A MET 44.A N ASP 40.A O no hydrogen 2.874 N/A ASP 45.A N VAL 41.A O no hydrogen 2.883 N/A ASP 46.A N LEU 43.A O no hydrogen 3.223 N/A ASP 47.A N VAL 42.A O no hydrogen 2.868 N/A CYS 50.A SG ASP 47.A OD1 no hydrogen 3.913 N/A THR 51.A N ASP 47.A O no hydrogen 3.099 N/A THR 51.A OG1 ASP 47.A O no hydrogen 2.849 N/A MET 52.A N VAL 48.A O no hydrogen 3.241 N/A VAL 53.A N GLU 49.A O no hydrogen 3.021 N/A GLU 54.A N CYS 50.A O no hydrogen 3.148 N/A LYS 55.A N THR 51.A O no hydrogen 3.114 N/A LYS 55.A NZ ASN 318.A O no hydrogen 2.749 N/A ARG 56.A N MET 52.A O no hydrogen 2.912 N/A ARG 56.A NE GLU 154.A OE1 no hydrogen 2.869 N/A ARG 56.A NE GLU 154.A OE2 no hydrogen 2.909 N/A ARG 56.A NH2 GLU 49.A OE2 no hydrogen 2.908 N/A ARG 56.A NH2 GLU 154.A OE1 no hydrogen 2.703 N/A VAL 57.A N VAL 53.A O no hydrogen 2.849 N/A LEU 58.A N GLU 54.A O no hydrogen 2.911 N/A SER 59.A N LYS 55.A O no hydrogen 2.964 N/A SER 59.A OG LYS 55.A O no hydrogen 2.753 N/A LEU 60.A N VAL 57.A O no hydrogen 2.991 N/A ALA 61.A N LEU 58.A O no hydrogen 3.228 N/A GLU 63.A N LEU 60.A O no hydrogen 3.159 N/A HIS 64.A N ALA 61.A O no hydrogen 3.063 N/A THR 68.A N ILE 146.A O no hydrogen 3.046 N/A HIS 69.A N GLU 85.A OE1 no hydrogen 3.063 N/A HIS 69.A NE2 HIS 64.A O no hydrogen 2.866 N/A PHE 71.A N VAL 83.A O no hydrogen 2.743 N/A CYS 72.A N VAL 83.A O no hydrogen 3.416 N/A THR 73.A N PHE 320.A O no hydrogen 3.033 N/A PHE 74.A N PHE 81.A O no hydrogen 3.151 N/A GLN 75.A NE2 PHE 316.A O no hydrogen 2.683 N/A THR 76.A N ASN 79.A O no hydrogen 2.810 N/A LYS 77.A NZ ASN 309.A OD1 no hydrogen 2.752 N/A LEU 80.A N LEU 37.A O no hydrogen 2.781 N/A PHE 81.A N PHE 74.A O no hydrogen 2.910 N/A PHE 82.A N LYS 35.A O no hydrogen 2.910 N/A VAL 83.A N CYS 72.A O no hydrogen 2.689 N/A MET 84.A N ALA 33.A O no hydrogen 2.718 N/A GLU 85.A N HIS 69.A O no hydrogen 2.951 N/A TYR 86.A OH PRO 284.A O no hydrogen 2.615 N/A ASN 88.A ND2 SER 283.A O no hydrogen 2.962 N/A ASN 88.A ND2 ASP 286.A O no hydrogen 3.017 N/A LEU 92.A N ILE 136.A O no hydrogen 2.882 N/A MET 93.A N LEU 133.A O no hydrogen 3.247 N/A TYR 94.A N ASP 91.A OD2 no hydrogen 3.036 N/A HIS 95.A N ASP 91.A O no hydrogen 3.110 N/A HIS 95.A NE2 GLY 89.A O no hydrogen 2.727 N/A ILE 96.A N LEU 92.A O no hydrogen 2.820 N/A GLN 97.A N MET 93.A O no hydrogen 3.244 N/A SER 98.A N HIS 95.A O no hydrogen 3.320 N/A SER 98.A OG TYR 94.A O no hydrogen 3.559 N/A SER 98.A OG HIS 95.A O no hydrogen 3.422 N/A CYS 99.A SG HIS 95.A O no hydrogen 3.575 N/A CYS 99.A SG LYS 101.A O no hydrogen 3.528 N/A HIS 100.A N ILE 96.A O no hydrogen 2.655 N/A PHE 102.A N MET 198.A O no hydrogen 2.755 N/A SER 105.A OG ASP 103.A OD1 no hydrogen 3.149 N/A ARG 106.A N ASP 103.A OD1 no hydrogen 3.068 N/A ARG 106.A NE TYR 110.A OH no hydrogen 2.969 N/A ARG 106.A NH2 TYR 110.A OH no hydrogen 3.236 N/A ALA 107.A N ASP 103.A O no hydrogen 2.869 N/A THR 108.A N LEU 104.A O no hydrogen 2.911 N/A THR 108.A OG1 LEU 104.A O no hydrogen 2.629 N/A PHE 109.A N SER 105.A O no hydrogen 3.081 N/A TYR 110.A N ARG 106.A O no hydrogen 3.106 N/A ALA 111.A N ALA 107.A O no hydrogen 2.889 N/A ALA 112.A N THR 108.A O no hydrogen 3.008 N/A GLU 113.A N PHE 109.A O no hydrogen 3.054 N/A ILE 114.A N TYR 110.A O no hydrogen 2.966 N/A ILE 115.A N ALA 111.A O no hydrogen 2.948 N/A LEU 116.A N ALA 112.A O no hydrogen 3.175 N/A GLY 117.A N GLU 113.A O no hydrogen 2.969 N/A LEU 118.A N ILE 114.A O no hydrogen 2.762 N/A GLN 119.A N ILE 115.A O no hydrogen 2.872 N/A PHE 120.A N LEU 116.A O no hydrogen 3.138 N/A LEU 121.A N GLY 117.A O no hydrogen 3.215 N/A HIS 122.A N LEU 118.A O no hydrogen 2.893 N/A HIS 122.A NE2 ASP 187.A OD2 no hydrogen 2.828 N/A SER 123.A N GLN 119.A O no hydrogen 3.110 N/A SER 123.A OG PHE 120.A O no hydrogen 2.599 N/A LYS 124.A N LEU 121.A O no hydrogen 3.192 N/A LYS 124.A NZ GLU 63.A OE1 no hydrogen 3.364 N/A LYS 124.A NZ GLU 63.A OE2 no hydrogen 3.242 N/A GLY 125.A N HIS 122.A O no hydrogen 3.030 N/A ILE 126.A N LEU 121.A O no hydrogen 2.893 N/A VAL 127.A N LYS 153.A O no hydrogen 2.951 N/A TYR 128.A N ASP 187.A OD2 no hydrogen 2.871 N/A TYR 128.A OH ALA 147.A O no hydrogen 2.478 N/A TYR 128.A OH ASP 148.A O no hydrogen 3.300 N/A ARG 129.A N ASP 187.A OD1 no hydrogen 2.763 N/A ARG 129.A NE MET 151.A O no hydrogen 2.802 N/A ARG 129.A NH1 GLU 164.A OE1 no hydrogen 2.864 N/A ARG 129.A NH1 TYR 182.A OH no hydrogen 2.893 N/A ARG 129.A NH2 MET 151.A O no hydrogen 2.995 N/A LEU 133.A N TYR 171.A OH no hydrogen 3.296 N/A ASN 135.A N LYS 132.A O no hydrogen 2.910 N/A ASN 135.A ND2 TYR 128.A OH no hydrogen 3.184 N/A ASN 135.A ND2 ASP 130.A O no hydrogen 3.058 N/A ASN 135.A ND2 ASP 130.A OD2 no hydrogen 3.196 N/A ILE 136.A N LEU 133.A O no hydrogen 3.447 N/A LEU 137.A N LYS 145.A O no hydrogen 2.818 N/A LEU 138.A N GLY 90.A O no hydrogen 2.945 N/A ASP 139.A N HIS 143.A O no hydrogen 2.891 N/A ASP 141.A N ASP 139.A OD1 no hydrogen 2.935 N/A GLY 142.A N ASP 139.A O no hydrogen 3.093 N/A GLY 142.A N ASP 139.A OD1 no hydrogen 2.999 N/A HIS 143.A N ASP 139.A OD1 no hydrogen 3.118 N/A HIS 143.A ND1 GLU 113.A OE1 no hydrogen 2.833 N/A ILE 144.A N GLU 113.A OE2 no hydrogen 2.813 N/A LYS 145.A N LEU 137.A O no hydrogen 2.614 N/A LYS 145.A NZ PRO 65.A O no hydrogen 2.993 N/A LYS 145.A NZ LEU 67.A O no hydrogen 3.244 N/A LYS 145.A NZ GLU 85.A OE1 no hydrogen 3.158 N/A LYS 145.A NZ GLU 85.A OE2 no hydrogen 3.342 N/A ILE 146.A N PHE 66.A O no hydrogen 2.807 N/A ALA 147.A N ASN 135.A O no hydrogen 2.798 N/A GLY 150.A N ASP 148.A OD1 no hydrogen 3.294 N/A CYS 152.A SG PHE 149.A O no hydrogen 3.499 N/A LYS 153.A N VAL 127.A O no hydrogen 2.842 N/A LYS 153.A NZ GLU 164.A OE2 no hydrogen 3.208 N/A MET 156.A N GLY 125.A O no hydrogen 2.969 N/A ASP 159.A N ASP 159.A OD2 no hydrogen 2.463 N/A ALA 160.A N LEU 157.A O no hydrogen 3.480 N/A THR 162.A N TYR 182.A O no hydrogen 2.941 N/A THR 168.A OG1 ASP 130.A OD1 no hydrogen 3.277 N/A TYR 171.A N THR 168.A O no hydrogen 2.894 N/A GLU 175.A N GLU 175.A OE1 no hydrogen 2.785 N/A ILE 176.A N ALA 173.A O no hydrogen 3.038 N/A LEU 177.A N ALA 173.A O no hydrogen 3.216 N/A LEU 178.A N PRO 174.A O no hydrogen 2.938 N/A GLY 179.A N ILE 176.A O no hydrogen 3.019 N/A GLN 180.A N GLU 175.A O no hydrogen 3.031 N/A GLN 180.A NE2 LEU 178.A O no hydrogen 3.202 N/A TYR 182.A N THR 162.A O no hydrogen 2.856 N/A TYR 182.A OH GLU 164.A O no hydrogen 2.642 N/A SER 185.A N ASN 183.A OD1 no hydrogen 3.258 N/A SER 185.A OG GLU 175.A OE2 no hydrogen 2.619 N/A SER 185.A OG ASN 183.A OD1 no hydrogen 3.558 N/A VAL 186.A N ASN 183.A O no hydrogen 3.387 N/A ASP 187.A N HIS 184.A O no hydrogen 2.971 N/A TRP 188.A N SER 185.A O no hydrogen 3.144 N/A TRP 189.A N SER 185.A O no hydrogen 3.154 N/A SER 190.A N VAL 186.A O no hydrogen 3.083 N/A SER 190.A OG TYR 171.A O no hydrogen 2.756 N/A SER 190.A OG VAL 186.A O no hydrogen 3.299 N/A PHE 191.A N ASP 187.A O no hydrogen 2.952 N/A GLY 192.A N TRP 188.A O no hydrogen 3.136 N/A VAL 193.A N TRP 189.A O no hydrogen 3.120 N/A LEU 194.A N SER 190.A O no hydrogen 2.916 N/A LEU 195.A N PHE 191.A O no hydrogen 2.836 N/A TYR 196.A N GLY 192.A O no hydrogen 2.840 N/A TYR 196.A OH PHE 223.A O no hydrogen 2.612 N/A GLU 197.A N VAL 193.A O no hydrogen 2.994 N/A MET 198.A N LEU 194.A O no hydrogen 3.039 N/A LEU 199.A N LEU 195.A O no hydrogen 3.059 N/A ILE 200.A N TYR 196.A O no hydrogen 2.851 N/A GLY 201.A N GLU 197.A O no hydrogen 2.668 N/A SER 203.A OG GLU 197.A OE2 no hydrogen 2.631 N/A HIS 206.A N SER 216.A OG no hydrogen 3.138 N/A GLN 208.A N GLU 212.A OE1 no hydrogen 2.730 N/A GLU 212.A N ASP 209.A OD1 no hydrogen 2.844 N/A LEU 213.A N ASP 209.A O no hydrogen 3.039 N/A PHE 214.A N GLU 210.A O no hydrogen 2.851 N/A HIS 215.A N GLU 211.A O no hydrogen 3.139 N/A SER 216.A N GLU 212.A O no hydrogen 2.930 N/A SER 216.A OG ASP 220.A OD2 no hydrogen 2.556 N/A ILE 217.A N LEU 213.A O no hydrogen 2.917 N/A ARG 218.A N PHE 214.A O no hydrogen 3.110 N/A MET 219.A N SER 216.A O no hydrogen 3.155 N/A ASP 220.A N SER 216.A O no hydrogen 2.897 N/A LEU 228.A N PRO 225.A O no hydrogen 2.971 N/A GLU 231.A N GLU 229.A OE2 no hydrogen 3.141 N/A LYS 233.A N GLU 229.A O no hydrogen 2.997 N/A ASP 234.A N LYS 230.A O no hydrogen 2.928 N/A LEU 235.A N GLU 231.A O no hydrogen 3.050 N/A LEU 236.A N ALA 232.A O no hydrogen 3.147 N/A VAL 237.A N LYS 233.A O no hydrogen 2.800 N/A LYS 238.A N ASP 234.A O no hydrogen 3.107 N/A LYS 238.A NZ ASP 234.A OD2 no hydrogen 2.627 N/A LEU 239.A N LEU 235.A O no hydrogen 2.962 N/A PHE 240.A N LEU 236.A O no hydrogen 2.833 N/A ARG 242.A NE ILE 217.A O no hydrogen 2.876 N/A ARG 242.A NH2 ILE 217.A O no hydrogen 2.834 N/A ARG 242.A NH2 ASP 220.A O no hydrogen 2.698 N/A GLU 243.A N GLU 243.A OE1 no hydrogen 2.633 N/A LYS 246.A N GLU 243.A O no hydrogen 2.882 N/A ARG 247.A N PRO 244.A O no hydrogen 3.208 N/A ARG 247.A NE VAL 241.A O no hydrogen 2.880 N/A ARG 247.A NH1 GLU 175.A OE1 no hydrogen 3.419 N/A ARG 247.A NH1 GLU 175.A OE2 no hydrogen 2.659 N/A ARG 247.A NH1 SER 185.A O no hydrogen 2.898 N/A ARG 247.A NH2 GLU 175.A OE1 no hydrogen 3.083 N/A ARG 247.A NH2 VAL 241.A O no hydrogen 2.838 N/A LEU 248.A N LYS 238.A O no hydrogen 3.288 N/A GLY 249.A N ARG 251.A O no hydrogen 3.326 N/A VAL 250.A N ARG 247.A O no hydrogen 3.158 N/A ARG 251.A N ARG 247.A O no hydrogen 3.020 N/A ARG 251.A NH2 LYS 246.A O no hydrogen 3.539 N/A ARG 255.A NE GLN 119.A OE1 no hydrogen 2.769 N/A ARG 255.A NH2 GLN 119.A OE1 no hydrogen 2.910 N/A GLN 256.A N ASP 253.A O no hydrogen 2.959 N/A HIS 257.A N ILE 254.A O no hydrogen 3.121 N/A HIS 257.A NE2 ASP 234.A OD2 no hydrogen 2.691 N/A LEU 259.A N HIS 257.A ND1 no hydrogen 3.107 N/A PHE 260.A N HIS 257.A O no hydrogen 2.962 N/A ARG 261.A N PRO 258.A O no hydrogen 3.134 N/A ILE 263.A N PHE 260.A O no hydrogen 2.814 N/A GLU 267.A N ASN 264.A OD1 no hydrogen 3.049 N/A LEU 268.A N ASN 264.A O no hydrogen 2.996 N/A GLU 269.A N TRP 265.A O no hydrogen 3.123 N/A ARG 270.A N GLU 266.A O no hydrogen 3.212 N/A ARG 270.A NE GLU 272.A OE1 no hydrogen 3.158 N/A ARG 270.A NE GLU 272.A OE2 no hydrogen 2.960 N/A ARG 270.A NH2 GLU 272.A OE1 no hydrogen 3.024 N/A LYS 271.A N LEU 268.A O no hydrogen 2.987 N/A LYS 271.A NZ ASP 139.A OD2 no hydrogen 3.238 N/A GLU 272.A N GLU 267.A O no hydrogen 2.770 N/A LYS 282.A N ASP 286.A OD2 no hydrogen 2.918 N/A PHE 285.A N SER 283.A OG no hydrogen 3.063 N/A ASP 286.A N SER 283.A O no hydrogen 3.162 N/A CYS 287.A SG PHE 285.A O no hydrogen 3.399 N/A SER 288.A N ASP 286.A OD1 no hydrogen 2.899 N/A ASN 289.A ND2 LYS 280.A O no hydrogen 2.821 N/A PHE 290.A N CYS 287.A O no hydrogen 3.479 N/A LYS 292.A NZ CYS 287.A O no hydrogen 3.225 N/A LYS 292.A NZ PHE 290.A O no hydrogen 2.976 N/A GLU 293.A N ASP 291.A OD1 no hydrogen 3.008 N/A LEU 295.A N LYS 292.A O no hydrogen 3.129 N/A GLU 297.A N PHE 294.A O no hydrogen 3.034 N/A ARG 300.A N LYS 298.A O no hydrogen 2.725 N/A ASP 304.A N ASP 40.A OD2 no hydrogen 2.919 N/A ILE 308.A N ASP 304.A O no hydrogen 2.969 N/A ASN 309.A N ARG 305.A O no hydrogen 2.886 N/A SER 310.A N LEU 307.A O no hydrogen 3.391 N/A SER 310.A OG ALA 306.A O no hydrogen 2.904 N/A SER 310.A OG LEU 307.A O no hydrogen 3.328 N/A MET 311.A N LEU 307.A O no hydrogen 2.893 N/A ASN 314.A N ASP 312.A OD1 no hydrogen 3.438 N/A ARG 317.A N ASN 314.A O no hydrogen 3.472 N/A ASN 322.A N PHE 71.A O no hydrogen 2.897 N/A ASN 322.A ND2 MET 70.A O no hydrogen 3.174 N/A