Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2d8a_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 2.A NZ ASP 19.A OD1 no hydrogen 3.118 N/A ALA 4.A N VAL 16.A O no hydrogen 2.826 N/A ILE 5.A N PHE 108.A O no hydrogen 2.857 N/A LYS 6.A N GLN 59.A O no hydrogen 2.898 N/A LYS 6.A NZ GLY 10.A O no hydrogen 2.652 N/A LYS 6.A NZ GLY 12.A O no hydrogen 2.627 N/A LYS 6.A NZ ILE 44.A O no hydrogen 2.879 N/A LYS 6.A NZ TYR 45.A O no hydrogen 2.925 N/A THR 7.A OG1 GLU 14.A OE2 no hydrogen 3.082 N/A TYR 11.A OH GLU 315.A OE2 no hydrogen 3.003 N/A VAL 16.A N ALA 4.A O no hydrogen 2.871 N/A VAL 20.A N GLU 1.A O no hydrogen 3.080 N/A GLY 24.A N GLU 27.A OE1 no hydrogen 2.879 N/A GLY 26.A N PRO 73.A O no hydrogen 2.922 N/A GLU 27.A N GLY 24.A O no hydrogen 3.031 N/A VAL 28.A N VAL 114.A O no hydrogen 3.023 N/A LEU 29.A N GLU 70.A O no hydrogen 2.599 N/A ILE 30.A N ALA 112.A O no hydrogen 2.957 N/A LYS 31.A N GLU 67.A O no hydrogen 2.675 N/A VAL 32.A N GLU 110.A O no hydrogen 2.902 N/A LEU 33.A N ALA 65.A O no hydrogen 2.947 N/A ALA 34.A N ALA 65.A O no hydrogen 3.127 N/A THR 35.A N PHE 326.A O no hydrogen 2.992 N/A THR 35.A OG1 GLU 63.A O no hydrogen 2.777 N/A SER 36.A N GLU 63.A O no hydrogen 3.315 N/A SER 36.A OG GLU 63.A OE2 no hydrogen 2.486 N/A SER 36.A OG THR 132.A O no hydrogen 3.172 N/A SER 36.A OG THR 132.A OG1 no hydrogen 3.155 N/A ILE 37.A N VAL 324.A O no hydrogen 3.013 N/A CYS 38.A N ASP 41.A OD2 no hydrogen 2.850 N/A CYS 38.A SG HIS 62.A NE2 no hydrogen 4.003 N/A LEU 42.A N CYS 38.A O no hydrogen 3.205 N/A HIS 43.A N GLY 39.A O no hydrogen 3.112 N/A ILE 44.A N THR 40.A O no hydrogen 3.108 N/A TYR 45.A N ASP 41.A O no hydrogen 2.890 N/A GLU 46.A N LEU 42.A O no hydrogen 2.804 N/A ASN 48.A N HIS 43.A O no hydrogen 3.255 N/A ALA 51.A N ASN 48.A OD1 no hydrogen 3.027 N/A GLN 52.A N ASN 48.A O no hydrogen 2.728 N/A GLN 52.A NE2 TRP 47.A O no hydrogen 2.950 N/A SER 53.A N TRP 50.A O no hydrogen 3.193 N/A SER 53.A OG GLU 49.A O no hydrogen 3.371 N/A SER 53.A OG TRP 50.A O no hydrogen 2.795 N/A ARG 54.A N ALA 51.A O no hydrogen 3.151 N/A ARG 54.A NE ASP 103.A OD1 no hydrogen 3.019 N/A ARG 54.A NH2 ASP 103.A OD2 no hydrogen 2.908 N/A ILE 55.A N ALA 51.A O no hydrogen 2.993 N/A GLN 59.A N LYS 6.A O no hydrogen 3.061 N/A GLN 59.A NE2 VAL 102.A O no hydrogen 3.060 N/A ILE 60.A N ASP 105.A OD1 no hydrogen 2.878 N/A GLY 61.A N ASP 41.A OD1 no hydrogen 3.249 N/A ALA 65.A N ALA 34.A O no hydrogen 2.928 N/A GLY 66.A N VAL 84.A O no hydrogen 2.755 N/A GLU 67.A N LYS 31.A O no hydrogen 2.900 N/A VAL 68.A N ASP 82.A O no hydrogen 2.931 N/A VAL 69.A N LEU 29.A O no hydrogen 2.756 N/A GLU 70.A N LEU 29.A O no hydrogen 3.345 N/A GLY 72.A N GLU 27.A O no hydrogen 2.666 N/A GLU 79.A N ASP 82.A OD2 no hydrogen 2.853 N/A GLY 81.A N VAL 68.A O no hydrogen 2.773 N/A ASP 82.A N GLU 79.A O no hydrogen 3.112 N/A TYR 83.A OH ILE 126.A O no hydrogen 2.603 N/A VAL 84.A N GLY 66.A O no hydrogen 2.784 N/A SER 85.A N TRP 120.A O no hydrogen 2.881 N/A SER 85.A OG VAL 64.A O no hydrogen 2.954 N/A SER 85.A OG ALA 131.A O no hydrogen 3.198 N/A GLU 87.A N ASN 118.A O no hydrogen 2.895 N/A THR 88.A N GLU 135.A OE1 no hydrogen 3.138 N/A HIS 89.A N GLU 87.A OE1 no hydrogen 2.693 N/A ILE 90.A N LYS 98.A O no hydrogen 3.071 N/A ILE 99.A N ASP 103.A OD2 no hydrogen 2.689 N/A PHE 100.A N THR 88.A O no hydrogen 2.842 N/A GLY 101.A N THR 104.A OG1 no hydrogen 3.207 N/A VAL 102.A N ILE 99.A O no hydrogen 2.974 N/A ASP 103.A N ILE 99.A O no hydrogen 2.873 N/A THR 104.A OG1 ASP 105.A O no hydrogen 3.198 N/A GLY 106.A N ILE 60.A O no hydrogen 2.677 N/A VAL 107.A N GLY 61.A O no hydrogen 3.100 N/A GLU 110.A N VAL 3.A O no hydrogen 3.281 N/A ALA 112.A N ILE 30.A O no hydrogen 2.979 N/A VAL 114.A N VAL 28.A O no hydrogen 2.973 N/A ALA 116.A N GLY 26.A O no hydrogen 2.780 N/A GLN 117.A N GLN 117.A OE1 no hydrogen 2.545 N/A ASN 118.A N PRO 115.A O no hydrogen 3.019 N/A ASN 118.A ND2 GLU 87.A O no hydrogen 2.758 N/A ASN 118.A ND2 HIS 89.A O no hydrogen 2.985 N/A ILE 119.A N ALA 116.A O no hydrogen 3.144 N/A TRP 120.A N SER 85.A O no hydrogen 2.966 N/A LYS 121.A NZ GLY 77.A O no hydrogen 2.603 N/A LYS 121.A NZ GLU 79.A OE2 no hydrogen 2.909 N/A LYS 121.A NZ ASP 82.A OD2 no hydrogen 3.229 N/A ASN 122.A N TYR 83.A O no hydrogen 2.731 N/A ASN 122.A ND2 SER 85.A OG no hydrogen 2.907 N/A LYS 124.A NZ GLY 81.A O no hydrogen 3.519 N/A ILE 126.A N PRO 123.A O no hydrogen 3.131 N/A GLU 129.A N GLU 129.A OE1 no hydrogen 2.800 N/A TYR 130.A N PRO 127.A O no hydrogen 2.984 N/A TYR 130.A OH ASP 297.A OD1 no hydrogen 2.341 N/A ALA 131.A N PRO 127.A O no hydrogen 2.977 N/A THR 132.A N PRO 128.A O no hydrogen 3.069 N/A THR 132.A OG1 ALA 34.A O no hydrogen 3.556 N/A THR 132.A OG1 SER 36.A OG no hydrogen 3.155 N/A LEU 133.A N TYR 130.A O no hydrogen 3.035 N/A GLN 134.A N ALA 131.A O no hydrogen 3.249 N/A GLN 134.A NE2 ASN 122.A OD1 no hydrogen 2.803 N/A GLN 134.A NE2 ALA 131.A O no hydrogen 2.909 N/A LEU 137.A N LEU 133.A O no hydrogen 2.833 N/A GLY 138.A N GLN 134.A O no hydrogen 2.871 N/A ASN 139.A N GLU 135.A O no hydrogen 3.285 N/A ALA 140.A N PRO 136.A O no hydrogen 3.108 N/A VAL 141.A N LEU 137.A O no hydrogen 2.702 N/A ASP 142.A N GLY 138.A O no hydrogen 2.952 N/A THR 143.A N ASN 139.A O no hydrogen 3.075 N/A THR 143.A OG1 ASN 139.A O no hydrogen 2.789 N/A VAL 144.A N ALA 140.A O no hydrogen 2.880 N/A LEU 145.A N VAL 141.A O no hydrogen 2.781 N/A GLY 151.A N GLY 174.A O no hydrogen 2.816 N/A LYS 152.A N ILE 149.A O no hydrogen 3.151 N/A SER 153.A N ASP 220.A OD2 no hydrogen 2.927 N/A SER 153.A OG ASP 220.A OD2 no hydrogen 3.098 N/A VAL 154.A N PRO 177.A O no hydrogen 2.820 N/A LEU 155.A N VAL 221.A O no hydrogen 2.860 N/A ILE 156.A N ILE 179.A O no hydrogen 2.665 N/A THR 157.A N LEU 223.A O no hydrogen 3.164 N/A THR 157.A OG1 GLU 224.A OE2 no hydrogen 2.656 N/A GLY 158.A N SER 181.A O no hydrogen 2.876 N/A ALA 159.A N GLU 182.A OE1 no hydrogen 2.678 N/A LEU 164.A N GLY 160.A O no hydrogen 2.844 N/A LEU 165.A N PRO 161.A O no hydrogen 2.938 N/A GLY 166.A N LEU 162.A O no hydrogen 2.817 N/A ILE 167.A N GLY 163.A O no hydrogen 2.913 N/A ALA 168.A N LEU 164.A O no hydrogen 3.055 N/A VAL 169.A N LEU 165.A O no hydrogen 2.922 N/A ALA 170.A N GLY 166.A O no hydrogen 2.818 N/A LYS 171.A N ILE 167.A O no hydrogen 2.935 N/A LYS 171.A NZ ALA 175.A O no hydrogen 3.085 N/A LYS 171.A NZ ASP 197.A OD1 no hydrogen 3.252 N/A LYS 171.A NZ ASP 197.A OD2 no hydrogen 2.789 N/A ALA 172.A N ALA 168.A O no hydrogen 3.069 N/A SER 173.A N VAL 169.A O no hydrogen 2.917 N/A SER 173.A N ALA 170.A O no hydrogen 3.107 N/A SER 173.A OG VAL 169.A O no hydrogen 2.876 N/A GLY 174.A N LYS 171.A O no hydrogen 3.140 N/A ALA 175.A N ALA 170.A O no hydrogen 3.028 N/A TYR 176.A N LYS 152.A O no hydrogen 2.893 N/A VAL 178.A N ASP 197.A OD2 no hydrogen 2.791 N/A ILE 179.A N VAL 154.A O no hydrogen 2.695 N/A VAL 180.A N TYR 198.A O no hydrogen 2.954 N/A SER 181.A N ILE 156.A O no hydrogen 2.927 N/A GLU 182.A N ILE 200.A O no hydrogen 3.040 N/A SER 184.A N GLU 182.A OE2 no hydrogen 2.895 N/A ARG 187.A N SER 184.A OG no hydrogen 3.236 N/A ARG 187.A NE THR 321.A O no hydrogen 3.229 N/A ARG 187.A NH2 THR 321.A O no hydrogen 3.180 N/A ARG 188.A N SER 184.A O no hydrogen 2.783 N/A ARG 188.A NH1 GLU 182.A O no hydrogen 2.850 N/A ARG 188.A NH1 PRO 183.A O no hydrogen 3.064 N/A ARG 188.A NH2 ASP 185.A OD1 no hydrogen 2.708 N/A GLU 189.A N ASP 185.A O no hydrogen 2.986 N/A LEU 190.A N PHE 186.A O no hydrogen 3.079 N/A ALA 191.A N ARG 187.A O no hydrogen 2.906 N/A LYS 192.A N ARG 188.A O no hydrogen 3.274 N/A LYS 192.A NZ ALA 196.A O no hydrogen 3.207 N/A LYS 193.A N GLU 189.A O no hydrogen 3.027 N/A VAL 194.A N LEU 190.A O no hydrogen 2.824 N/A GLY 195.A N ALA 191.A O no hydrogen 3.095 N/A ALA 196.A N ALA 191.A O no hydrogen 2.998 N/A ASP 197.A N VAL 178.A O no hydrogen 2.969 N/A TYR 198.A N VAL 178.A O no hydrogen 3.310 N/A ILE 200.A N VAL 180.A O no hydrogen 2.718 N/A ASN 201.A N GLU 205.A OE1 no hydrogen 3.094 N/A PHE 203.A N ASN 201.A OD1 no hydrogen 3.146 N/A GLU 204.A N ASN 201.A O no hydrogen 3.063 N/A GLU 205.A N ASN 201.A O no hydrogen 2.841 N/A LYS 209.A N ASP 206.A OD1 no hydrogen 3.332 N/A LYS 209.A NZ ASP 206.A OD1 no hydrogen 3.350 N/A LYS 209.A NZ ASP 206.A OD2 no hydrogen 2.860 N/A GLU 210.A N ASP 206.A O no hydrogen 2.997 N/A VAL 211.A N VAL 207.A O no hydrogen 2.908 N/A ILE 213.A N GLU 210.A O no hydrogen 2.939 N/A THR 214.A N VAL 211.A O no hydrogen 2.808 N/A THR 214.A OG1 VAL 211.A O no hydrogen 2.926 N/A ASP 215.A N ASP 212.A O no hydrogen 3.395 N/A ASN 217.A N THR 214.A O no hydrogen 3.041 N/A GLY 218.A N THR 214.A OG1 no hydrogen 2.799 N/A VAL 219.A N ALA 238.A O no hydrogen 2.971 N/A ASP 220.A N SER 153.A OG no hydrogen 2.856 N/A VAL 221.A N SER 153.A O no hydrogen 3.020 N/A PHE 222.A N ARG 244.A O no hydrogen 2.967 N/A LEU 223.A N LEU 155.A O no hydrogen 2.877 N/A GLU 224.A N SER 246.A O no hydrogen 2.890 N/A PHE 225.A N THR 157.A O no hydrogen 2.825 N/A SER 226.A N GLU 224.A OE2 no hydrogen 2.812 N/A SER 226.A OG GLU 224.A OE2 no hydrogen 2.556 N/A GLY 227.A N GLU 224.A OE1 no hydrogen 2.751 N/A ALA 228.A N SER 226.A OG no hydrogen 3.080 N/A LYS 230.A NZ GLU 233.A OE1 no hydrogen 2.717 N/A LEU 232.A N ALA 228.A O no hydrogen 3.171 N/A GLU 233.A N PRO 229.A O no hydrogen 3.152 N/A GLN 234.A N LYS 230.A O no hydrogen 2.944 N/A GLY 235.A N ALA 231.A O no hydrogen 2.914 N/A LEU 236.A N LEU 232.A O no hydrogen 3.098 N/A GLN 237.A N GLU 233.A O no hydrogen 3.149 N/A ALA 238.A N GLN 234.A O no hydrogen 2.820 N/A VAL 239.A N GLY 235.A O no hydrogen 2.886 N/A THR 240.A N VAL 219.A O no hydrogen 2.750 N/A THR 240.A OG1 ASN 217.A O no hydrogen 3.038 N/A ALA 242.A N LYS 266.A O no hydrogen 2.653 N/A GLY 243.A N THR 240.A O no hydrogen 2.925 N/A ARG 244.A N ASP 220.A O no hydrogen 3.062 N/A ARG 244.A NH1 THR 143.A O no hydrogen 3.220 N/A ARG 244.A NH1 VAL 144.A O no hydrogen 3.169 N/A ARG 244.A NH1 SER 246.A OG no hydrogen 2.872 N/A ARG 244.A NH2 VAL 144.A O no hydrogen 2.896 N/A ARG 244.A NH2 PRO 148.A O no hydrogen 3.075 N/A VAL 245.A N THR 269.A O no hydrogen 2.845 N/A SER 246.A N PHE 222.A O no hydrogen 2.931 N/A SER 246.A OG THR 143.A O no hydrogen 2.815 N/A LEU 247.A N TYR 271.A O no hydrogen 2.850 N/A LEU 248.A N GLU 224.A O no hydrogen 3.097 N/A GLY 249.A N GLU 224.A O no hydrogen 2.915 N/A PHE 259.A N ILE 257.A O no hydrogen 3.007 N/A ASN 261.A N ASP 258.A OD1 no hydrogen 3.126 N/A ASN 261.A ND2 ASP 258.A OD2 no hydrogen 2.797 N/A LEU 262.A N ASP 258.A O no hydrogen 3.121 N/A ILE 263.A N PHE 259.A O no hydrogen 3.038 N/A ILE 264.A N PHE 259.A O no hydrogen 2.864 N/A PHE 265.A N ASN 260.A O no hydrogen 2.833 N/A LYS 266.A NZ LEU 236.A O no hydrogen 2.711 N/A LYS 266.A NZ VAL 239.A O no hydrogen 2.810 N/A ALA 267.A N ILE 264.A O no hydrogen 2.958 N/A LEU 268.A N ILE 263.A O no hydrogen 3.117 N/A THR 269.A N GLY 243.A O no hydrogen 3.142 N/A TYR 271.A N VAL 245.A O no hydrogen 2.847 N/A ILE 273.A N LEU 247.A O no hydrogen 2.743 N/A ARG 276.A N ASP 142.A OD2 no hydrogen 2.871 N/A HIS 277.A ND1 GLU 87.A OE2 no hydrogen 3.180 N/A THR 281.A N LEU 278.A O no hydrogen 3.078 N/A THR 281.A OG1 ASP 142.A OD1 no hydrogen 2.676 N/A THR 281.A OG1 ASP 142.A OD2 no hydrogen 3.423 N/A TRP 282.A NE1 GLU 87.A OE2 no hydrogen 2.823 N/A TYR 283.A N TRP 279.A O no hydrogen 2.789 N/A THR 284.A N GLU 280.A O no hydrogen 3.118 N/A THR 284.A OG1 GLU 280.A O no hydrogen 3.079 N/A THR 284.A OG1 GLU 280.A OE1 no hydrogen 3.410 N/A VAL 285.A N THR 281.A O no hydrogen 2.918 N/A SER 286.A N TRP 282.A O no hydrogen 2.917 N/A ARG 287.A N TYR 283.A O no hydrogen 3.104 N/A ARG 287.A NE TYR 283.A OH no hydrogen 3.005 N/A ARG 287.A NH1 GLN 290.A OE1 no hydrogen 3.095 N/A ARG 287.A NH2 TYR 283.A OH no hydrogen 3.163 N/A LEU 288.A N THR 284.A O no hydrogen 3.000 N/A LEU 289.A N VAL 285.A O no hydrogen 2.938 N/A GLN 290.A N SER 286.A O no hydrogen 2.859 N/A SER 291.A N ARG 287.A O no hydrogen 2.855 N/A SER 291.A OG LEU 288.A O no hydrogen 2.570 N/A GLY 292.A N LEU 289.A O no hydrogen 3.283 N/A LYS 293.A N SER 291.A OG no hydrogen 3.190 N/A ASN 295.A ND2 VAL 194.A O no hydrogen 2.912 N/A LEU 296.A N LEU 294.A O no hydrogen 2.954 N/A ILE 299.A N LEU 296.A O no hydrogen 2.914 N/A ILE 300.A N LEU 296.A O no hydrogen 3.370 N/A THR 301.A N LYS 323.A O no hydrogen 3.288 N/A HIS 302.A NE2 LYS 320.A O no hydrogen 3.326 N/A LYS 303.A NZ GLU 129.A OE2 no hydrogen 3.465 N/A TYR 304.A N VAL 325.A O no hydrogen 2.840 N/A TYR 304.A OH GLU 312.A OE2 no hydrogen 3.222 N/A TYR 310.A N PHE 307.A O no hydrogen 2.976 N/A TYR 310.A OH ALA 13.A O no hydrogen 2.611 N/A ALA 313.A N LYS 309.A O no hydrogen 3.177 N/A PHE 314.A N TYR 310.A O no hydrogen 3.025 N/A GLU 315.A N GLU 311.A O no hydrogen 3.127 N/A LEU 316.A N GLU 312.A O no hydrogen 3.004 N/A ALA 318.A N GLU 315.A O no hydrogen 3.030 N/A LYS 320.A N LEU 316.A O no hydrogen 2.997 N/A GLY 322.A N THR 301.A OG1 no hydrogen 2.904 N/A LYS 323.A N ILE 299.A O no hydrogen 2.823 N/A LYS 323.A NZ ILE 37.A O no hydrogen 2.812 N/A LYS 323.A NZ GLU 63.A OE1 no hydrogen 3.082 N/A LYS 323.A NZ GLU 63.A OE2 no hydrogen 2.871 N/A VAL 325.A N HIS 302.A O no hydrogen 2.876 N/A PHE 326.A N THR 35.A O no hydrogen 2.698 N/A