Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3pms_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 2.A ND2 TYR 132.A O no hydrogen 3.361 N/A THR 3.A OG1 ASN 2.A OD1 no hydrogen 3.040 N/A VAL 4.A N ILE 130.A O no hydrogen 2.868 N/A ASN 5.A ND2 ASP 127.A OD2 no hydrogen 2.822 N/A ASN 5.A ND2 ASP 129.A OD1 no hydrogen 2.948 N/A ILE 6.A N PHE 128.A O no hydrogen 2.771 N/A LYS 7.A NZ ASN 5.A OD1 no hydrogen 2.886 N/A THR 8.A N VAL 126.A O no hydrogen 2.952 N/A THR 8.A OG1 VAL 126.A O no hydrogen 2.848 N/A LYS 11.A N SER 125.A OG no hydrogen 3.071 N/A VAL 12.A N TYR 124.A O no hydrogen 2.956 N/A ASN 14.A N ARG 122.A O no hydrogen 2.806 N/A ASN 14.A ND2 THR 114.A OG1 no hydrogen 2.718 N/A ALA 15.A N SER 21.A O no hydrogen 2.953 N/A PHE 16.A N LEU 118.A O no hydrogen 3.021 N/A LEU 20.A N GLY 17.A O no hydrogen 3.026 N/A SER 21.A OG SER 23.A O no hydrogen 2.897 N/A GLN 22.A NE2 THR 116.A O no hydrogen 2.794 N/A SER 23.A N SER 21.A OG no hydrogen 3.301 N/A ALA 24.A N ILE 112.A O no hydrogen 2.836 N/A GLY 26.A N LEU 110.A O no hydrogen 3.078 N/A PHE 28.A N THR 108.A O no hydrogen 2.876 N/A PHE 30.A N GLY 106.A O no hydrogen 2.953 N/A THR 35.A N ASP 33.A OD1 no hydrogen 2.902 N/A THR 35.A OG1 ASP 33.A OD1 no hydrogen 2.605 N/A VAL 37.A N VAL 34.A O no hydrogen 3.109 N/A LYS 38.A N VAL 131.A O no hydrogen 2.834 N/A LYS 38.A NZ.A THR 134.A O no hydrogen 3.275 N/A THR 39.A N VAL 131.A O no hydrogen 3.292 N/A ILE 40.A N THR 98.A OG1 no hydrogen 2.889 N/A LYS 41.A N ASP 129.A O no hydrogen 2.855 N/A LYS 41.A NZ ASP 96.A OD2 no hydrogen 2.765 N/A MET 42.A N ILE 95.A O no hydrogen 2.839 N/A PHE 43.A N ASP 127.A O no hydrogen 2.787 N/A ILE 44.A N LEU 93.A O no hydrogen 2.789 N/A LYS 45.A N SER 125.A O no hydrogen 2.822 N/A ASN 46.A N THR 86.A OG1 no hydrogen 2.864 N/A ASN 46.A ND2 GLU 123.A O no hydrogen 2.864 N/A GLU 47.A N GLU 123.A O no hydrogen 3.043 N/A CYS 48.A N GLU 87.A OE2.A no hydrogen 2.854 N/A CYS 48.A SG TRP 83.A O no hydrogen 3.436 N/A THR 52.A N PRO 49.A O no hydrogen 3.127 N/A THR 52.A OG1 PRO 49.A O no hydrogen 2.577 N/A CYS 53.A SG ASP 54.A O no hydrogen 3.935 N/A CYS 53.A SG TRP 83.A O no hydrogen 3.887 N/A ASP 54.A N GLY 121.A O no hydrogen 2.782 N/A GLU 55.A N GLU 55.A OE1 no hydrogen 2.798 N/A TRP 56.A N ASP 54.A OD1 no hydrogen 3.113 N/A ARG 58.A N THR 80.A OG1 no hydrogen 2.905 N/A ARG 58.A NE ASP 54.A OD1 no hydrogen 3.332 N/A ARG 58.A NE ASP 54.A OD2 no hydrogen 2.754 N/A ARG 58.A NH2 ASP 54.A OD1 no hydrogen 3.203 N/A ARG 58.A NH2 ASP 54.A OD2 no hydrogen 3.060 N/A TYR 59.A OH ASN 149.A O no hydrogen 2.705 N/A ALA 60.A N PHE 78.A O no hydrogen 2.879 N/A ASN 61.A N TYR 113.A O no hydrogen 2.918 N/A ASN 61.A ND2 TYR 63.A OH no hydrogen 3.192 N/A ASN 61.A ND2 GLU 74.A OE2 no hydrogen 2.896 N/A ASN 61.A ND2 ASN 149.A O no hydrogen 3.124 N/A VAL 62.A N GLY 76.A O no hydrogen 2.923 N/A TYR 63.A N LYS 111.A O no hydrogen 2.798 N/A VAL 64.A N TYR 73.A O no hydrogen 2.956 N/A LYS 65.A N GLU 109.A O no hydrogen 2.921 N/A LYS 65.A NZ GLU 109.A OE1 no hydrogen 2.791 N/A ASN 66.A N GLU 71.A O no hydrogen 2.882 N/A ASN 66.A ND2 TYR 73.A OH no hydrogen 2.836 N/A LYS 67.A NZ SER 105.A O no hydrogen 3.003 N/A LYS 67.A NZ THR 108.A OG1 no hydrogen 3.089 N/A THR 68.A N ASN 66.A OD1 no hydrogen 2.824 N/A THR 68.A OG1 ASN 66.A OD1 no hydrogen 2.937 N/A THR 69.A N ASN 66.A OD1 no hydrogen 2.973 N/A GLY 70.A N ASN 66.A O no hydrogen 2.869 N/A GLU 71.A N THR 69.A OG1 no hydrogen 3.236 N/A TYR 73.A N VAL 64.A O no hydrogen 2.773 N/A GLU 74.A N GLN 147.A OE1 no hydrogen 2.961 N/A ILE 75.A N VAL 62.A O no hydrogen 2.820 N/A ARG 77.A NE GLU 74.A OE2 no hydrogen 2.861 N/A ARG 77.A NH1 THR 184.A O no hydrogen 3.463 N/A ARG 77.A NH1 SER 186.A OG no hydrogen 2.904 N/A ARG 77.A NH1 ALA 291.A O no hydrogen 3.042 N/A ARG 77.A NH2 GLU 74.A OE1 no hydrogen 2.836 N/A ARG 77.A NH2 GLU 74.A OE2 no hydrogen 3.446 N/A ARG 77.A NH2 THR 184.A O no hydrogen 3.144 N/A PHE 78.A N ALA 60.A O no hydrogen 2.869 N/A ILE 79.A N MET 252.A O no hydrogen 3.152 N/A THR 80.A N ARG 58.A O no hydrogen 2.879 N/A THR 80.A OG1 TRP 56.A O no hydrogen 2.993 N/A THR 80.A OG1 PRO 81.A O no hydrogen 3.435 N/A TYR 82.A N GLN 236.A OE1 no hydrogen 2.864 N/A TRP 83.A N GLU 55.A O no hydrogen 2.794 N/A VAL 84.A N TYR 82.A O no hydrogen 2.682 N/A THR 86.A N ASN 46.A O no hydrogen 3.013 N/A THR 86.A OG1 ASN 46.A O no hydrogen 3.483 N/A GLU 87.A N GLU 87.A OE1.A no hydrogen 2.923 N/A GLU 87.A N GLU 87.A OE2.B no hydrogen 2.768 N/A LYS 88.A NZ ASN 234.A OD1 no hydrogen 3.400 N/A LEU 89.A N THR 86.A O no hydrogen 2.626 N/A ARG 91.A NH1 ASP 129.A OD2 no hydrogen 2.798 N/A ARG 91.A NH2 ASP 127.A OD2 no hydrogen 2.934 N/A ARG 91.A NH2 ASP 129.A OD1 no hydrogen 3.005 N/A ARG 91.A NH2 ASP 129.A OD2 no hydrogen 3.476 N/A GLY 92.A N LEU 89.A O no hydrogen 3.012 N/A LEU 93.A N ILE 44.A O no hydrogen 2.837 N/A ILE 95.A N MET 42.A O no hydrogen 2.884 N/A VAL 97.A N ILE 40.A O no hydrogen 2.883 N/A THR 98.A N ASP 96.A OD1 no hydrogen 2.976 N/A THR 98.A OG1 ILE 40.A O no hydrogen 3.470 N/A THR 98.A OG1 ASP 96.A OD1 no hydrogen 2.580 N/A THR 98.A OG1 ASP 96.A OD2 no hydrogen 3.525 N/A PHE 100.A N VAL 97.A O no hydrogen 2.836 N/A LYS 101.A N THR 98.A O no hydrogen 2.882 N/A LYS 101.A NZ VAL 37.A O no hydrogen 2.919 N/A LEU 103.A N PHE 100.A O no hydrogen 2.825 N/A LEU 104.A N PHE 100.A O no hydrogen 3.100 N/A LEU 104.A N LYS 101.A O no hydrogen 3.184 N/A SER 105.A OG ALA 32.A O no hydrogen 2.755 N/A GLY 106.A N PRO 31.A O no hydrogen 3.265 N/A THR 108.A N PHE 28.A O no hydrogen 2.811 N/A THR 108.A OG1 LEU 103.A O no hydrogen 3.534 N/A THR 108.A OG1 GLY 106.A O no hydrogen 2.860 N/A LEU 110.A N GLY 26.A O no hydrogen 2.959 N/A LYS 111.A N TYR 63.A O no hydrogen 2.933 N/A ILE 112.A N ALA 24.A O no hydrogen 2.861 N/A TYR 113.A N ASN 61.A O no hydrogen 2.876 N/A THR 114.A N GLN 22.A O no hydrogen 3.069 N/A THR 114.A OG1 TYR 124.A OH no hydrogen 2.727 N/A GLU 115.A N TYR 59.A O no hydrogen 2.840 N/A THR 116.A OG1 ASP 54.A OD2 no hydrogen 2.697 N/A THR 116.A OG1 LEU 118.A O no hydrogen 3.563 N/A LYS 120.A NZ GLU 55.A OE1 no hydrogen 2.979 N/A GLY 121.A N LEU 118.A O no hydrogen 3.207 N/A ARG 122.A N ASN 14.A O no hydrogen 2.900 N/A ARG 122.A NE ASP 54.A O no hydrogen 2.961 N/A ARG 122.A NH1 ASN 46.A OD1 no hydrogen 2.735 N/A ARG 122.A NH1 VAL 84.A O no hydrogen 2.891 N/A ARG 122.A NH2 ASP 54.A O no hydrogen 2.760 N/A ARG 122.A NH2 PRO 81.A O no hydrogen 2.769 N/A TYR 124.A N VAL 12.A O no hydrogen 2.817 N/A TYR 124.A OH THR 114.A OG1 no hydrogen 2.727 N/A SER 125.A N LYS 45.A O no hydrogen 2.885 N/A SER 125.A OG GLU 47.A OE2 no hydrogen 2.846 N/A VAL 126.A N PHE 9.A O no hydrogen 2.926 N/A ASP 127.A N PHE 43.A O no hydrogen 3.012 N/A PHE 128.A N ILE 6.A O no hydrogen 2.919 N/A ASP 129.A N LYS 41.A O no hydrogen 2.860 N/A ILE 130.A N VAL 4.A O no hydrogen 2.736 N/A VAL 131.A N THR 39.A O no hydrogen 2.841 N/A TYR 132.A N ASN 2.A O no hydrogen 2.848 N/A GLY 133.A N ALA 36.A O no hydrogen 2.801 N/A LYS 138.A N ASN 301.A OD1 no hydrogen 2.824 N/A TYR 139.A N SER 300.A O no hydrogen 2.889 N/A ALA 141.A N ALA 298.A O no hydrogen 2.883 N/A VAL 143.A N VAL 296.A O no hydrogen 3.116 N/A VAL 145.A N SER 294.A O no hydrogen 2.731 N/A VAL 146.A N SER 294.A O no hydrogen 3.229 N/A GLN 147.A NE2 TRP 72.A O no hydrogen 2.977 N/A TYR 148.A N ILE 292.A O no hydrogen 2.886 N/A TYR 148.A OH ALA 165.A O no hydrogen 2.469 N/A ASN 149.A ND2 GLU 74.A OE1 no hydrogen 2.921 N/A ASN 149.A ND2 GLN 147.A OE1 no hydrogen 3.077 N/A LYS 150.A NZ TYR 113.A OH no hydrogen 3.279 N/A LYS 150.A NZ LYS 150.A O no hydrogen 3.042 N/A SER 151.A OG ASP 154.A OD2 no hydrogen 2.755 N/A SER 152.A N GLU 115.A OE1 no hydrogen 3.134 N/A SER 152.A OG GLU 115.A OE1 no hydrogen 2.700 N/A SER 152.A OG GLU 115.A OE2 no hydrogen 3.233 N/A ASP 154.A N SER 151.A O no hydrogen 3.176 N/A GLY 155.A N SER 152.A O no hydrogen 3.461 N/A VAL 156.A N TYR 290.A O no hydrogen 2.795 N/A TYR 158.A N ALA 288.A O no hydrogen 2.969 N/A TYR 158.A OH GLN 277.A O no hydrogen 2.711 N/A LYS 160.A NZ ASP 287.A OD1 no hydrogen 2.845 N/A LYS 167.A NZ.A ASN 215.A OD1 no hydrogen 2.799 N/A LYS 168.A N TYR 272.A O no hydrogen 2.971 N/A LYS 168.A NZ VAL 145.A O no hydrogen 2.926 N/A ASN 169.A N THR 310.A O no hydrogen 2.940 N/A ILE 170.A N PHE 270.A O no hydrogen 2.794 N/A GLN 171.A N VAL 308.A O no hydrogen 2.827 N/A LEU 172.A N SER 268.A O no hydrogen 3.212 N/A THR 176.A N PRO 173.A O no hydrogen 3.036 N/A THR 176.A OG1 PRO 173.A O no hydrogen 2.631 N/A GLU 177.A N LYS 299.A O no hydrogen 2.818 N/A LYS 178.A N LYS 299.A O no hydrogen 3.242 N/A TYR 180.A N ILE 297.A O no hydrogen 2.983 N/A TYR 180.A OH ASP 99.A OD1 no hydrogen 2.534 N/A LEU 181.A N ASP 259.A O no hydrogen 2.849 N/A ARG 182.A N PHE 295.A O no hydrogen 2.896 N/A ARG 182.A NH1 ASP 96.A O no hydrogen 3.447 N/A ARG 182.A NH1 ASP 99.A OD2 no hydrogen 2.825 N/A ARG 182.A NH2 ILE 75.A O no hydrogen 2.904 N/A ARG 182.A NH2 ASP 96.A O no hydrogen 2.909 N/A THR 183.A N ARG 257.A O no hydrogen 2.861 N/A THR 183.A OG1 SER 294.A OG.A no hydrogen 2.819 N/A THR 183.A OG1 SER 294.A OG.B no hydrogen 2.838 N/A THR 184.A N SER 293.A O no hydrogen 2.931 N/A SER 186.A N ALA 291.A O no hydrogen 2.968 N/A TRP 188.A N PHE 289.A O no hydrogen 2.885 N/A HIS 190.A ND1 ASN 285.A O no hydrogen 3.136 N/A ALA 191.A N CYS 201.A O no hydrogen 2.776 N/A ASP 195.A N ARG 199.A O no hydrogen 2.897 N/A SER 198.A OG.A GLY 197.A O no hydrogen 2.729 N/A ARG 199.A N ASP 195.A O no hydrogen 3.200 N/A ARG 199.A NH1 TRP 204.A O no hydrogen 2.793 N/A ARG 199.A NH1 ASP 244.A O no hydrogen 2.853 N/A ARG 199.A NH2 ASP 244.A O no hydrogen 2.947 N/A CYS 201.A N ALA 191.A O no hydrogen 2.968 N/A ALA 202.A N TRP 188.A O no hydrogen 2.926 N/A GLU 203.A N GLY 189.A O no hydrogen 2.971 N/A TRP 204.A N GLY 200.A O no hydrogen 3.113 N/A ARG 207.A N LEU 223.A O no hydrogen 3.468 N/A ARG 207.A NE TYR 158.A OH no hydrogen 3.028 N/A ARG 207.A NH1 ASP 195.A OD1 no hydrogen 3.516 N/A ARG 207.A NH1 ASP 195.A OD2 no hydrogen 2.712 N/A ARG 207.A NH1 PHE 206.A O no hydrogen 2.755 N/A ARG 207.A NH2 ASP 195.A OD1 no hydrogen 3.101 N/A THR 208.A N GLN 277.A OE1 no hydrogen 2.906 N/A HIS 209.A N HIS 221.A O no hydrogen 2.894 N/A THR 210.A N LYS 275.A O no hydrogen 2.909 N/A ILE 211.A N PHE 219.A O no hydrogen 2.854 N/A ALA 212.A N GLU 273.A O no hydrogen 2.868 N/A ILE 213.A N SER 216.A O no hydrogen 2.913 N/A ASN 214.A N SER 271.A O no hydrogen 2.948 N/A SER 216.A N ILE 213.A O no hydrogen 3.006 N/A THR 218.A N ILE 211.A O no hydrogen 2.965 N/A THR 218.A OG1 SER 216.A O no hydrogen 2.707 N/A PHE 219.A N ILE 211.A O no hydrogen 3.186 N/A HIS 221.A N HIS 209.A O no hydrogen 2.820 N/A HIS 221.A ND1 TYR 274.A OH no hydrogen 2.808 N/A HIS 221.A NE2 ASP 259.A OD2 no hydrogen 2.706 N/A LEU 223.A N ARG 207.A O no hydrogen 2.761 N/A GLY 227.A N ASP 244.A OD2 no hydrogen 2.941 N/A CYS 228.A N ASP 244.A OD2 no hydrogen 2.817 N/A CYS 228.A SG PRO 243.A O no hydrogen 3.446 N/A CYS 228.A SG ASP 244.A OD2 no hydrogen 3.840 N/A CYS 228.A SG TRP 248.A O no hydrogen 3.515 N/A ALA 230.A N GLY 227.A O no hydrogen 3.033 N/A ASN 231.A N CYS 228.A O no hydrogen 3.125 N/A ASN 231.A ND2 GLY 251.A O no hydrogen 3.244 N/A ILE 233.A N ASN 231.A OD1 no hydrogen 2.879 N/A ASN 235.A ND2 GLU 87.A OE1.B no hydrogen 2.993 N/A GLN 236.A NE2 ILE 233.A O no hydrogen 2.972 N/A GLN 236.A NE2 PRO 250.A O no hydrogen 3.262 N/A GLY 239.A N GLN 236.A O no hydrogen 2.938 N/A TRP 241.A N GLY 239.A O no hydrogen 2.910 N/A TRP 241.A NE1 SER 237.A OG.B no hydrogen 3.203 N/A ARG 245.A NE GLU 203.A OE2 no hydrogen 2.979 N/A ARG 245.A NH1 ASN 240.A O no hydrogen 2.902 N/A ARG 245.A NH2 ASN 240.A O no hydrogen 2.884 N/A ARG 245.A NH2 PRO 243.A O no hydrogen 2.884 N/A ALA 246.A N GLU 203.A O no hydrogen 2.929 N/A GLY 247.A N GLY 224.A O no hydrogen 2.826 N/A TRP 248.A NE1 GLY 187.A O no hydrogen 3.059 N/A GLY 251.A N ILE 79.A O no hydrogen 2.819 N/A VAL 254.A N ARG 77.A O no hydrogen 2.818 N/A ARG 257.A N THR 183.A O no hydrogen 2.828 N/A ARG 257.A NH1 GLN 222.A O no hydrogen 2.977 N/A ARG 257.A NH2 GLN 222.A O no hydrogen 3.267 N/A ASP 259.A N LEU 181.A O no hydrogen 2.984 N/A LEU 261.A N ALA 179.A O no hydrogen 2.968 N/A LEU 265.A N ASN 262.A O no hydrogen 3.019 N/A ILE 266.A N ASN 263.A O no hydrogen 3.079 N/A GLY 267.A N LEU 172.A O no hydrogen 3.245 N/A SER 268.A N LEU 265.A O no hydrogen 3.108 N/A SER 268.A OG LEU 265.A O no hydrogen 2.491 N/A PHE 270.A N ILE 170.A O no hydrogen 2.841 N/A TYR 272.A N LYS 168.A O no hydrogen 2.842 N/A TYR 272.A OH SER 294.A OG.A no hydrogen 3.107 N/A TYR 272.A OH SER 294.A OG.B no hydrogen 2.615 N/A GLU 273.A N ALA 212.A O no hydrogen 2.905 N/A TYR 274.A N LEU 166.A O no hydrogen 2.960 N/A TYR 274.A OH HIS 221.A ND1 no hydrogen 2.808 N/A LYS 275.A N THR 210.A O no hydrogen 2.776 N/A LYS 275.A NZ ASN 217.A OD1 no hydrogen 2.801 N/A GLN 277.A N HIS 209.A ND1 no hydrogen 2.997 N/A ASN 281.A N GLY 159.A O no hydrogen 3.027 N/A ASN 281.A ND2 GLY 286.A O no hydrogen 2.951 N/A ASN 282.A N LYS 192.A O no hydrogen 2.932 N/A ASN 282.A ND2 THR 284.A OG1 no hydrogen 2.738 N/A GLY 283.A N ASN 281.A OD1 no hydrogen 2.804 N/A ASN 285.A ND2 HIS 190.A O no hydrogen 2.904 N/A PHE 289.A N TRP 188.A O no hydrogen 3.042 N/A TYR 290.A N VAL 156.A O no hydrogen 2.887 N/A ALA 291.A N SER 186.A O no hydrogen 2.912 N/A ILE 292.A N TYR 148.A O no hydrogen 2.971 N/A SER 293.A N THR 184.A O no hydrogen 2.982 N/A SER 293.A OG GLU 74.A OE1 no hydrogen 2.661 N/A SER 294.A N VAL 146.A O no hydrogen 2.987 N/A SER 294.A OG.A THR 183.A OG1 no hydrogen 2.819 N/A SER 294.A OG.A TYR 272.A OH no hydrogen 3.107 N/A SER 294.A OG.B THR 183.A OG1 no hydrogen 2.838 N/A SER 294.A OG.B TYR 272.A OH no hydrogen 2.615 N/A PHE 295.A N ARG 182.A O no hydrogen 2.786 N/A VAL 296.A N VAL 143.A O no hydrogen 2.979 N/A ILE 297.A N TYR 180.A O no hydrogen 2.849 N/A ALA 298.A N ALA 141.A O no hydrogen 2.922 N/A LYS 299.A N LYS 178.A O no hydrogen 2.863 N/A LYS 299.A NZ TYR 180.A OH no hydrogen 3.008 N/A SER 300.A N TYR 139.A O no hydrogen 2.913 N/A SER 300.A OG ASN 175.A O no hydrogen 2.729 N/A SER 300.A OG GLU 177.A OE2 no hydrogen 3.469 N/A SER 300.A OG THR 302.A O no hydrogen 3.336 N/A ASN 301.A N GLU 177.A OE2 no hydrogen 2.731 N/A ASN 301.A ND2 ASP 136.A O no hydrogen 3.067 N/A THR 302.A N SER 300.A OG no hydrogen 3.190 N/A VAL 308.A N GLN 171.A O no hydrogen 3.039 N/A THR 310.A N ASN 169.A O no hydrogen 2.902 N/A