Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4jei_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 1.A N ASN 209.A OD1 no hydrogen 2.775 N/A SER 3.A N SER 268.A O no hydrogen 3.377 N/A SER 3.A OG GLN 265.A O no hydrogen 2.941 N/A GLU 5.A N SER 3.A OG no hydrogen 3.338 N/A SER 7.A N MET 263.A O no hydrogen 2.902 N/A SER 7.A OG SER 213.A OG no hydrogen 2.672 N/A TYR 14.A N ASP 10.A O no hydrogen 3.050 N/A TYR 14.A OH PRO 256.A O no hydrogen 2.611 N/A ASN 15.A N GLN 11.A O no hydrogen 2.985 N/A PHE 16.A N GLU 12.A O no hydrogen 3.029 N/A PHE 17.A N SER 13.A O no hydrogen 3.090 N/A GLU 18.A N TYR 14.A O no hydrogen 3.027 N/A LYS 19.A N ASN 15.A O no hydrogen 3.019 N/A LYS 19.A NZ TYR 81.A OH no hydrogen 2.896 N/A TYR 20.A N PHE 16.A O no hydrogen 3.444 N/A ALA 21.A N PHE 17.A O no hydrogen 2.977 N/A ARG 22.A N GLU 18.A O no hydrogen 2.846 N/A ARG 22.A NH1 GLU 18.A OE1 no hydrogen 3.120 N/A LEU 23.A N LYS 19.A O no hydrogen 2.931 N/A ALA 24.A N TYR 20.A O no hydrogen 2.856 N/A ASN 25.A N ALA 21.A O no hydrogen 2.876 N/A ASN 25.A ND2 GLN 45.A OE1 no hydrogen 2.762 N/A ASN 25.A ND2 VAL 297.A O no hydrogen 3.110 N/A ILE 26.A N ARG 22.A O no hydrogen 2.939 N/A GLY 27.A N ALA 24.A O no hydrogen 3.326 N/A TYR 28.A N ASN 25.A O no hydrogen 3.139 N/A TYR 28.A OH HIS 160.A ND1 no hydrogen 3.107 N/A CYS 29.A N ILE 26.A O no hydrogen 2.943 N/A CYS 29.A SG ILE 26.A O no hydrogen 2.659 N/A THR 34.A OG1 CYS 29.A O no hydrogen 2.597 N/A THR 34.A OG1 GLY 31.A O no hydrogen 3.360 N/A ILE 36.A N GLU 57.A OE1 no hydrogen 2.761 N/A PHE 37.A N ASN 41.A O no hydrogen 2.737 N/A LYS 38.A NZ LEU 54.A O no hydrogen 3.153 N/A LYS 38.A NZ ILE 55.A O no hydrogen 3.456 N/A ASN 41.A N PHE 37.A O no hydrogen 2.657 N/A GLN 45.A NE2 VAL 297.A O no hydrogen 3.221 N/A PHE 49.A N CYS 46.A O no hydrogen 2.834 N/A GLU 53.A N VAL 73.A O no hydrogen 2.753 N/A LEU 54.A N PRO 39.A O no hydrogen 2.677 N/A ILE 55.A N LEU 71.A O no hydrogen 2.947 N/A GLU 56.A N LEU 71.A O no hydrogen 3.227 N/A PHE 58.A N GLY 69.A O no hydrogen 2.771 N/A ASP 60.A N VAL 67.A O no hydrogen 3.130 N/A LEU 63.A N ASP 66.A OD2 no hydrogen 3.131 N/A ASP 66.A N LEU 63.A O no hydrogen 2.996 N/A SER 68.A N ARG 85.A O no hydrogen 2.758 N/A SER 68.A OG THR 87.A OG1 no hydrogen 2.695 N/A GLY 69.A N PHE 58.A O no hydrogen 2.816 N/A TYR 70.A N VAL 83.A O no hydrogen 2.984 N/A TYR 70.A OH LEU 23.A O no hydrogen 2.719 N/A LEU 71.A N GLU 56.A O no hydrogen 2.721 N/A ALA 72.A N TYR 81.A O no hydrogen 2.930 N/A VAL 73.A N GLU 53.A O no hydrogen 2.864 N/A ASP 74.A N GLN 79.A O no hydrogen 2.736 N/A HIS 75.A N ASN 51.A O no hydrogen 2.812 N/A ALA 76.A N ASP 74.A OD1 no hydrogen 3.131 N/A SER 77.A N ASP 74.A OD1 no hydrogen 2.914 N/A SER 77.A OG TYR 81.A OH no hydrogen 3.143 N/A LYS 78.A NZ HIS 75.A O no hydrogen 2.714 N/A GLN 79.A N ASP 74.A O no hydrogen 3.152 N/A GLN 79.A NE2 SER 77.A OG no hydrogen 2.657 N/A ILE 80.A N GLN 154.A O no hydrogen 2.885 N/A TYR 81.A N ALA 72.A O no hydrogen 2.665 N/A TYR 81.A OH ASP 74.A OD2 no hydrogen 2.791 N/A LEU 82.A N ALA 156.A O no hydrogen 2.974 N/A VAL 83.A N TYR 70.A O no hydrogen 2.916 N/A ILE 84.A N THR 158.A O no hydrogen 2.910 N/A ARG 85.A N SER 68.A O no hydrogen 2.806 N/A ARG 85.A NE GLY 27.A O no hydrogen 2.994 N/A ARG 85.A NH1 GLY 86.A O no hydrogen 2.781 N/A THR 87.A N ASP 66.A O no hydrogen 3.080 N/A THR 87.A OG1 ASP 60.A O no hydrogen 2.708 N/A THR 87.A OG1 SER 68.A OG no hydrogen 2.695 N/A ASP 92.A N SER 89.A OG no hydrogen 3.427 N/A VAL 93.A N SER 89.A O no hydrogen 3.195 N/A ILE 94.A N LEU 90.A O no hydrogen 2.714 N/A THR 95.A N GLU 91.A O no hydrogen 3.060 N/A THR 95.A OG1 GLU 91.A O no hydrogen 3.136 N/A ILE 97.A N VAL 93.A O no hydrogen 3.120 N/A ARG 98.A N ILE 94.A O no hydrogen 2.792 N/A ILE 99.A N THR 95.A O no hydrogen 2.772 N/A THR 105.A N VAL 124.A O no hydrogen 2.861 N/A THR 105.A OG1 ASN 106.A O no hydrogen 3.266 N/A PHE 107.A N CYS 122.A O no hydrogen 2.925 N/A ALA 110.A N PHE 107.A O no hydrogen 3.025 N/A ALA 111.A N GLN 133.A OE1 no hydrogen 3.300 N/A SER 114.A OG THR 116.A OG1 no hydrogen 3.102 N/A SER 115.A OG ASP 108.A OD2 no hydrogen 3.502 N/A THR 116.A OG1 SER 114.A OG no hydrogen 3.102 N/A ALA 117.A N SER 114.A O no hydrogen 3.161 N/A THR 118.A N SER 114.A O no hydrogen 3.452 N/A THR 118.A OG1 SER 114.A O no hydrogen 3.141 N/A CYS 119.A SG GLY 195.A O no hydrogen 3.448 N/A CYS 122.A N CYS 119.A O no hydrogen 3.243 N/A CYS 122.A SG GLY 195.A O no hydrogen 3.623 N/A LEU 123.A N ASN 193.A OD1 no hydrogen 2.805 N/A VAL 124.A N THR 105.A O no hydrogen 2.715 N/A HIS 125.A N VAL 191.A O no hydrogen 2.844 N/A ASN 126.A N PRO 103.A O no hydrogen 2.804 N/A GLY 127.A N HIS 125.A ND1 no hydrogen 2.898 N/A PHE 128.A N HIS 125.A ND1 no hydrogen 3.379 N/A ILE 129.A N HIS 125.A O no hydrogen 3.180 N/A GLN 130.A N ASN 126.A O no hydrogen 3.347 N/A SER 131.A N GLY 127.A O no hydrogen 2.983 N/A SER 131.A OG PHE 65.A O no hydrogen 2.625 N/A SER 131.A OG GLY 127.A O no hydrogen 3.406 N/A TYR 132.A N PHE 128.A O no hydrogen 2.874 N/A TYR 132.A OH ALA 111.A O no hydrogen 2.709 N/A GLN 133.A N ILE 129.A O no hydrogen 2.780 N/A ASN 134.A N GLN 130.A O no hydrogen 2.782 N/A THR 135.A N SER 131.A O no hydrogen 3.048 N/A THR 135.A OG1 SER 131.A O no hydrogen 2.993 N/A TYR 136.A N TYR 132.A O no hydrogen 3.057 N/A ASN 137.A N GLN 133.A O no hydrogen 2.960 N/A GLN 138.A N ASN 134.A O no hydrogen 3.197 N/A GLN 138.A N THR 135.A O no hydrogen 3.239 N/A ILE 139.A N THR 135.A O no hydrogen 2.862 N/A GLY 140.A N TYR 136.A O no hydrogen 2.800 N/A LEU 143.A N ILE 139.A O no hydrogen 2.944 N/A ASP 144.A N GLY 140.A O no hydrogen 3.015 N/A SER 145.A N PRO 141.A O no hydrogen 3.103 N/A SER 145.A OG LYS 142.A O no hydrogen 2.878 N/A VAL 146.A N LYS 142.A O no hydrogen 3.046 N/A ILE 147.A N LEU 143.A O no hydrogen 2.799 N/A GLU 148.A N ASP 144.A O no hydrogen 3.320 N/A GLN 149.A N SER 145.A O no hydrogen 2.986 N/A TYR 150.A N VAL 146.A O no hydrogen 2.837 N/A TYR 153.A N TYR 150.A O no hydrogen 3.329 N/A GLN 154.A N LYS 78.A O no hydrogen 3.241 N/A GLN 154.A NE2 ASP 180.A O no hydrogen 3.292 N/A ALA 156.A N ILE 80.A O no hydrogen 2.898 N/A VAL 157.A N LEU 182.A O no hydrogen 2.675 N/A THR 158.A N LEU 82.A O no hydrogen 2.958 N/A THR 158.A OG1 TYR 20.A O no hydrogen 3.560 N/A THR 158.A OG1 VAL 184.A O no hydrogen 2.717 N/A HIS 160.A ND1 TYR 28.A OH no hydrogen 3.107 N/A HIS 160.A NE2 HIS 288.A O no hydrogen 2.718 N/A SER 161.A N LEU 186.A O no hydrogen 2.872 N/A SER 161.A OG HIS 288.A NE2 no hydrogen 2.816 N/A GLY 164.A N SER 161.A O no hydrogen 3.060 N/A ALA 166.A N LEU 162.A O no hydrogen 3.069 N/A ALA 167.A N GLY 163.A O no hydrogen 2.812 N/A LEU 168.A N GLY 164.A O no hydrogen 2.987 N/A LEU 169.A N ALA 165.A O no hydrogen 3.221 N/A PHE 170.A N ALA 166.A O no hydrogen 2.839 N/A GLY 171.A N ALA 167.A O no hydrogen 2.795 N/A ILE 172.A N LEU 168.A O no hydrogen 2.871 N/A ASN 173.A N LEU 169.A O no hydrogen 3.080 N/A ASN 173.A ND2 GLN 112.A O no hydrogen 3.554 N/A ASN 173.A ND2 GLN 112.A OE1 no hydrogen 3.515 N/A LEU 174.A N PHE 170.A O no hydrogen 3.088 N/A LYS 175.A N GLY 171.A O no hydrogen 3.029 N/A VAL 176.A N ILE 172.A O no hydrogen 2.812 N/A ASN 177.A N ASN 173.A O no hydrogen 3.133 N/A ASN 177.A ND2 GLN 112.A O no hydrogen 3.471 N/A HIS 179.A N LEU 174.A O no hydrogen 3.036 N/A LEU 182.A N ILE 155.A O no hydrogen 2.855 N/A VAL 183.A N LYS 220.A O no hydrogen 2.696 N/A VAL 184.A N VAL 157.A O no hydrogen 3.037 N/A THR 185.A N TYR 222.A O no hydrogen 2.860 N/A THR 185.A OG1 TYR 222.A O no hydrogen 3.484 N/A LEU 186.A N GLY 159.A O no hydrogen 2.978 N/A GLY 187.A N ILE 224.A O no hydrogen 2.865 N/A GLN 188.A NE2 THR 185.A OG1 no hydrogen 2.919 N/A ILE 190.A N VAL 234.A O no hydrogen 2.824 N/A ASN 193.A N LEU 123.A O no hydrogen 2.954 N/A ASN 193.A ND2 ASP 121.A O no hydrogen 2.905 N/A ASN 193.A ND2 ASP 121.A OD1 no hydrogen 3.505 N/A ASN 193.A ND2 ASP 121.A OD2 no hydrogen 3.299 N/A PHE 196.A N ASN 193.A OD1 no hydrogen 3.036 N/A ALA 197.A N ASN 193.A O no hydrogen 2.885 N/A ASN 198.A N ALA 194.A O no hydrogen 2.997 N/A TRP 199.A N PHE 196.A O no hydrogen 3.070 N/A VAL 200.A N PHE 196.A O no hydrogen 2.932 N/A ASP 201.A N ALA 197.A O no hydrogen 3.130 N/A LYS 202.A N ASN 198.A O no hydrogen 3.307 N/A LEU 203.A N TRP 199.A O no hydrogen 2.877 N/A PHE 204.A N VAL 200.A O no hydrogen 2.828 N/A PHE 205.A N ASP 201.A O no hydrogen 2.950 N/A GLY 206.A N LYS 202.A O no hydrogen 2.908 N/A GLN 207.A NE2 GLU 208.A O no hydrogen 3.325 N/A GLN 207.A NE2 ASN 209.A O no hydrogen 3.309 N/A VAL 212.A N GLN 265.A OE1 no hydrogen 2.664 N/A SER 213.A OG SER 7.A OG no hydrogen 2.672 N/A SER 216.A OG ASP 218.A OD2 no hydrogen 2.946 N/A ASP 218.A N SER 216.A OG no hydrogen 3.244 N/A ARG 219.A NE LEU 221.A O no hydrogen 2.848 N/A ARG 219.A NH1 VAL 212.A O no hydrogen 2.889 N/A ARG 219.A NH2 LEU 221.A O no hydrogen 3.279 N/A LYS 220.A NZ ASP 180.A OD2 no hydrogen 3.206 N/A TYR 222.A N VAL 183.A O no hydrogen 2.927 N/A ARG 223.A N GLY 245.A O no hydrogen 3.324 N/A ILE 224.A N THR 185.A O no hydrogen 2.688 N/A THR 225.A N VAL 247.A O no hydrogen 2.731 N/A THR 225.A OG1 GLU 246.A OE2 no hydrogen 2.468 N/A THR 225.A OG1 VAL 247.A O no hydrogen 3.454 N/A HIS 226.A ND1 ASN 287.A O no hydrogen 2.619 N/A ARG 227.A N ILE 249.A O no hydrogen 3.020 N/A ASP 229.A N HIS 226.A O no hydrogen 3.114 N/A VAL 231.A N ASP 229.A OD1 no hydrogen 3.201 N/A GLN 233.A N ILE 230.A O no hydrogen 2.908 N/A GLN 233.A NE2 ASP 229.A O no hydrogen 3.438 N/A VAL 234.A N VAL 231.A O no hydrogen 2.955 N/A TRP 237.A NE1 MET 100.A O no hydrogen 3.304 N/A TYR 240.A N TRP 237.A O no hydrogen 3.419 N/A TYR 240.A OH ALA 102.A O no hydrogen 2.664 N/A GLN 241.A N GLY 192.A O no hydrogen 2.913 N/A HIS 242.A NE2 PRO 232.A O no hydrogen 2.551 N/A CYS 243.A SG SER 244.A O no hydrogen 3.307 N/A SER 244.A N ASP 201.A OD1 no hydrogen 2.671 N/A SER 244.A OG ASP 201.A OD2 no hydrogen 2.834 N/A VAL 247.A N ARG 223.A O no hydrogen 2.755 N/A PHE 248.A N VAL 262.A O no hydrogen 2.788 N/A ILE 249.A N THR 225.A O no hydrogen 2.809 N/A ASP 250.A N ASN 260.A O no hydrogen 2.798 N/A HIS 255.A N PHE 292.A O no hydrogen 2.723 N/A SER 259.A OG ASN 260.A OD1 no hydrogen 2.927 N/A ASN 260.A N PRO 257.A O no hydrogen 2.834 N/A ASN 260.A ND2 ASP 250.A O no hydrogen 2.836 N/A VAL 262.A N PHE 248.A O no hydrogen 2.859 N/A MET 263.A N SER 7.A O no hydrogen 2.733 N/A CYS 264.A N GLU 246.A O no hydrogen 2.951 N/A GLN 265.A N GLU 5.A O no hydrogen 3.166 N/A GLN 267.A N TYR 1.A O no hydrogen 2.750 N/A GLN 267.A NE2 ASN 198.A OD1 no hydrogen 3.064 N/A GLN 267.A NE2 ASP 201.A OD2 no hydrogen 3.098 N/A SER 268.A N TYR 1.A O no hydrogen 3.168 N/A ASN 269.A ND2 GLU 5.A O no hydrogen 3.407 N/A ASN 269.A ND2 GLN 265.A O no hydrogen 2.819 N/A GLN 271.A N ASN 269.A OD1 no hydrogen 3.034 N/A CYS 272.A N ASN 269.A O no hydrogen 3.000 N/A SER 273.A N GLU 246.A OE2 no hydrogen 2.786 N/A GLY 275.A N CYS 272.A O no hydrogen 3.053 N/A ASN 276.A N SER 273.A O no hydrogen 3.338 N/A ASN 276.A ND2 HIS 226.A O no hydrogen 3.664 N/A ASN 276.A ND2 ASP 229.A O no hydrogen 3.069 N/A GLN 281.A N LEU 278.A O no hydrogen 2.996 N/A ASN 287.A N ASN 283.A O no hydrogen 2.809 N/A HIS 288.A N ILE 285.A O no hydrogen 2.798 N/A HIS 288.A ND1 ASP 229.A OD1 no hydrogen 2.978 N/A HIS 288.A ND1 ASP 229.A OD2 no hydrogen 2.786 N/A HIS 288.A NE2 SER 161.A OG no hydrogen 2.816 N/A LEU 289.A N ILE 285.A O no hydrogen 3.179 N/A GLN 290.A NE2 ASN 287.A OD1 no hydrogen 3.546 N/A TYR 291.A N LEU 289.A O no hydrogen 3.185 N/A TYR 291.A N VAL 293.A O no hydrogen 3.185 N/A TYR 291.A OH ASP 229.A OD2 no hydrogen 2.560 N/A VAL 293.A N TYR 291.A O no hydrogen 2.639 N/A GLU 295.A N LEU 289.A O no hydrogen 2.653 N/A VAL 297.A N ASN 25.A OD1 no hydrogen 3.302 N/A CYS 298.A SG CYS 42.A O no hydrogen 3.491 N/A