Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3pfi_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 6.A N GLU 56.A OE2 no hydrogen 3.532 N/A TYR 9.A N PHE 6.A O no hydrogen 3.013 N/A GLN 12.A NE2 GLU 146.A O no hydrogen 2.869 N/A GLN 12.A NE2 TYR 148.A OH no hydrogen 3.444 N/A LYS 16.A N GLN 12.A O no hydrogen 2.894 N/A LYS 16.A NZ PHE 6.A O no hydrogen 3.193 N/A LYS 17.A N GLU 13.A O no hydrogen 2.849 N/A ASN 18.A N SER 14.A O no hydrogen 3.238 N/A LEU 19.A N ILE 15.A O no hydrogen 2.877 N/A ASN 20.A N LYS 16.A O no hydrogen 2.951 N/A VAL 21.A N LYS 17.A O no hydrogen 3.363 N/A PHE 22.A N ASN 18.A O no hydrogen 2.995 N/A ILE 23.A N LEU 19.A O no hydrogen 2.793 N/A ALA 24.A N ASN 20.A O no hydrogen 3.219 N/A ALA 25.A N VAL 21.A O no hydrogen 3.136 N/A ALA 26.A N PHE 22.A O no hydrogen 3.055 N/A LYS 27.A N ILE 23.A O no hydrogen 3.233 N/A LYS 28.A N ALA 24.A O no hydrogen 2.779 N/A ARG 29.A N ALA 25.A O no hydrogen 2.694 N/A ASN 30.A N LYS 27.A O no hydrogen 2.722 N/A GLU 31.A N ALA 26.A O no hydrogen 2.671 N/A CYS 32.A SG LEU 33.A O no hydrogen 3.802 N/A CYS 32.A SG THR 122.A OG1 no hydrogen 3.335 N/A ILE 36.A N LEU 123.A O no hydrogen 2.914 N/A PHE 38.A N GLY 125.A O no hydrogen 2.795 N/A SER 39.A N PHE 143.A O no hydrogen 3.033 N/A GLY 40.A N THR 127.A O no hydrogen 3.135 N/A LYS 46.A NZ GLY 40.A O no hydrogen 2.771 N/A LYS 46.A NZ PRO 41.A O no hydrogen 2.861 N/A LEU 49.A N GLY 45.A O no hydrogen 3.210 N/A ALA 50.A N LYS 46.A O no hydrogen 3.180 N/A ASN 51.A N THR 47.A O no hydrogen 3.262 N/A ASN 51.A ND2 THR 47.A O no hydrogen 2.620 N/A ILE 52.A N THR 48.A O no hydrogen 2.927 N/A ILE 53.A N LEU 49.A O no hydrogen 2.850 N/A SER 54.A N ALA 50.A O no hydrogen 3.260 N/A SER 54.A OG ASN 51.A O no hydrogen 2.512 N/A TYR 55.A N ASN 51.A O no hydrogen 3.218 N/A GLU 56.A N ILE 52.A O no hydrogen 2.846 N/A ALA 58.A N SER 54.A O no hydrogen 2.922 N/A ILE 60.A N ASN 59.A OD1 no hydrogen 2.840 N/A LYS 61.A N ILE 85.A O no hydrogen 2.982 N/A THR 63.A N PHE 87.A O no hydrogen 2.933 N/A THR 63.A OG1 ALA 64.A O no hydrogen 3.565 N/A ALA 65.A N ASP 89.A O no hydrogen 2.930 N/A ALA 74.A N SER 70.A O no hydrogen 3.276 N/A ALA 75.A N GLY 71.A O no hydrogen 2.619 N/A ILE 76.A N ASP 72.A O no hydrogen 2.836 N/A LEU 77.A N LEU 73.A O no hydrogen 2.994 N/A THR 78.A N ALA 74.A O no hydrogen 3.103 N/A THR 78.A OG1 ALA 75.A O no hydrogen 2.226 N/A ASN 79.A N ALA 75.A O no hydrogen 3.127 N/A ASN 79.A N ILE 76.A O no hydrogen 3.192 N/A SER 81.A N ASP 84.A OD2 no hydrogen 2.457 N/A GLY 83.A N LYS 120.A O no hydrogen 3.101 N/A ASP 84.A N SER 81.A O no hydrogen 3.003 N/A ILE 85.A N ASN 59.A O no hydrogen 3.131 N/A LEU 86.A N THR 122.A O no hydrogen 2.894 N/A PHE 87.A N LYS 61.A O no hydrogen 2.853 N/A ILE 88.A N ILE 124.A O no hydrogen 2.942 N/A ASP 89.A N THR 63.A O no hydrogen 3.009 N/A GLU 90.A N ASP 89.A OD2 no hydrogen 2.775 N/A ILE 91.A N ALA 126.A O no hydrogen 3.123 N/A ARG 93.A N GLU 90.A O no hydrogen 2.849 N/A LEU 94.A N ILE 91.A O no hydrogen 3.362 N/A ILE 98.A N SER 95.A OG no hydrogen 3.417 N/A GLU 99.A N SER 95.A O no hydrogen 2.875 N/A GLU 100.A N PRO 96.A O no hydrogen 2.752 N/A GLU 100.A N ALA 97.A O no hydrogen 3.137 N/A VAL 101.A N ALA 97.A O no hydrogen 3.211 N/A VAL 101.A N ILE 98.A O no hydrogen 2.922 N/A LEU 102.A N ILE 98.A O no hydrogen 3.024 N/A TYR 103.A N GLU 99.A O no hydrogen 3.347 N/A TYR 103.A OH GLU 99.A OE1 no hydrogen 2.943 N/A ASP 107.A N PRO 104.A O no hydrogen 2.893 N/A TYR 108.A N PRO 104.A O no hydrogen 3.294 N/A THR 122.A N ASP 84.A O no hydrogen 3.038 N/A THR 122.A OG1 LEU 33.A O no hydrogen 2.756 N/A LEU 123.A N HIS 35.A ND1 no hydrogen 3.128 N/A ILE 124.A N LEU 86.A O no hydrogen 2.791 N/A GLY 125.A N ILE 36.A O no hydrogen 2.853 N/A ALA 126.A N ILE 88.A O no hydrogen 2.903 N/A THR 127.A N PHE 38.A O no hydrogen 3.058 N/A THR 127.A OG1 HIS 92.A ND1 no hydrogen 2.580 N/A ARG 129.A N THR 127.A OG1 no hydrogen 2.938 N/A ARG 129.A NH1 THR 258.A OG1 no hydrogen 2.738 N/A GLY 131.A N ASP 261.A OD1 no hydrogen 2.634 N/A SER 133.A OG GLU 99.A OE1 no hydrogen 2.393 N/A LEU 136.A N SER 133.A O no hydrogen 2.981 N/A ARG 137.A N SER 133.A O no hydrogen 2.972 N/A ASP 138.A N ASN 134.A O no hydrogen 2.928 N/A ARG 139.A N LEU 136.A O no hydrogen 3.237 N/A ARG 139.A NE GLU 106.A OE2 no hydrogen 3.075 N/A ARG 139.A NH1 PRO 135.A O no hydrogen 2.926 N/A ARG 139.A NH2 GLU 106.A OE2 no hydrogen 2.905 N/A PHE 140.A N ARG 137.A O no hydrogen 2.968 N/A PHE 143.A N LEU 37.A O no hydrogen 2.886 N/A LEU 145.A N SER 39.A O no hydrogen 2.940 N/A GLU 146.A N GLN 12.A OE1 no hydrogen 3.227 N/A TYR 148.A N SER 182.A O no hydrogen 3.361 N/A TYR 148.A OH LEU 44.A O no hydrogen 2.650 N/A LYS 149.A N GLU 152.A OE1 no hydrogen 3.046 N/A GLU 152.A N LYS 149.A O no hydrogen 3.135 N/A LEU 153.A N LYS 149.A O no hydrogen 3.073 N/A ALA 154.A N ASP 150.A O no hydrogen 2.863 N/A LEU 155.A N SER 151.A O no hydrogen 3.375 N/A ILE 156.A N GLU 152.A O no hydrogen 3.117 N/A LEU 157.A N LEU 153.A O no hydrogen 2.793 N/A GLN 158.A N ALA 154.A O no hydrogen 2.878 N/A LYS 159.A N LEU 155.A O no hydrogen 2.990 N/A LYS 159.A NZ GLY 8.A O no hydrogen 3.511 N/A ALA 160.A N ILE 156.A O no hydrogen 2.962 N/A ALA 161.A N LEU 157.A O no hydrogen 2.710 N/A LEU 162.A N GLN 158.A O no hydrogen 3.217 N/A LYS 163.A N LYS 159.A O no hydrogen 3.339 N/A LEU 164.A N ALA 160.A O no hydrogen 3.246 N/A LEU 164.A N ALA 161.A O no hydrogen 2.814 N/A ASN 165.A N LEU 162.A O no hydrogen 2.931 N/A LYS 166.A N ALA 161.A O no hydrogen 3.105 N/A LYS 166.A NZ ASP 199.A OD1 no hydrogen 2.875 N/A THR 167.A N GLU 204.A O no hydrogen 2.870 N/A CYS 168.A SG GLU 169.A O no hydrogen 3.584 N/A GLU 169.A N ILE 206.A O no hydrogen 3.171 N/A ALA 173.A N GLU 169.A O no hydrogen 2.935 N/A LEU 174.A N GLU 170.A O no hydrogen 2.867 N/A GLU 175.A N LYS 171.A O no hydrogen 3.263 N/A ILE 176.A N ALA 172.A O no hydrogen 3.167 N/A ALA 177.A N ALA 173.A O no hydrogen 2.967 N/A LYS 178.A N LEU 174.A O no hydrogen 2.934 N/A ARG 179.A N ILE 176.A O no hydrogen 2.960 N/A ARG 179.A NE GLU 175.A OE2 no hydrogen 3.276 N/A ARG 179.A NH1 ASN 216.A OD1 no hydrogen 3.055 N/A ARG 179.A NH1 VAL 220.A O no hydrogen 2.837 N/A ARG 179.A NH2 GLU 175.A OE2 no hydrogen 3.498 N/A ARG 179.A NH2 ASN 216.A OD1 no hydrogen 2.717 N/A SER 180.A N ALA 177.A O no hydrogen 2.783 N/A SER 180.A OG ILE 176.A O no hydrogen 2.635 N/A ARG 181.A NE ASP 228.A OD2 no hydrogen 2.871 N/A ARG 181.A NH2 ASP 228.A OD1 no hydrogen 3.038 N/A ARG 181.A NH2 ASP 228.A OD2 no hydrogen 3.482 N/A SER 182.A OG TYR 148.A O no hydrogen 3.216 N/A THR 183.A N SER 180.A O no hydrogen 3.058 N/A THR 183.A OG1 ARG 181.A O no hydrogen 2.827 N/A ALA 187.A N THR 183.A O no hydrogen 3.076 N/A LEU 188.A N PRO 184.A O no hydrogen 2.778 N/A ARG 189.A N ARG 185.A O no hydrogen 2.911 N/A LEU 190.A N ILE 186.A O no hydrogen 2.848 N/A LEU 191.A N ALA 187.A O no hydrogen 2.920 N/A LYS 192.A N LEU 188.A O no hydrogen 3.381 N/A ARG 193.A N LEU 190.A O no hydrogen 3.052 N/A VAL 194.A N LEU 190.A O no hydrogen 3.011 N/A ARG 195.A N LEU 191.A O no hydrogen 2.922 N/A ARG 195.A NE ASP 196.A OD1 no hydrogen 3.475 N/A ASP 196.A N LYS 192.A O no hydrogen 3.459 N/A ALA 198.A N VAL 194.A O no hydrogen 3.088 N/A ASP 199.A N ARG 195.A O no hydrogen 2.738 N/A VAL 200.A N ASP 196.A O no hydrogen 3.148 N/A ASN 201.A N ALA 198.A O no hydrogen 2.965 N/A ASP 202.A N ASP 199.A O no hydrogen 3.089 N/A GLU 203.A N ALA 198.A O no hydrogen 2.981 N/A ILE 206.A N THR 167.A O no hydrogen 2.815 N/A THR 207.A OG1 GLU 169.A OE1 no hydrogen 3.369 N/A ALA 211.A N THR 207.A O no hydrogen 3.016 N/A ASN 212.A N GLU 208.A O no hydrogen 2.967 N/A GLU 213.A N LYS 209.A O no hydrogen 3.048 N/A ALA 214.A N ARG 210.A O no hydrogen 3.035 N/A LEU 215.A N ALA 211.A O no hydrogen 2.902 N/A ASN 216.A N ASN 212.A O no hydrogen 2.878 N/A SER 217.A N GLU 213.A O no hydrogen 2.864 N/A LEU 218.A N ALA 214.A O no hydrogen 2.929 N/A GLY 219.A N ASN 216.A O no hydrogen 2.852 N/A VAL 220.A N LEU 215.A O no hydrogen 3.073 N/A ASN 221.A ND2 ASN 293.A OD1 no hydrogen 3.121 N/A GLU 222.A N GLU 222.A OE1 no hydrogen 2.237 N/A LEU 223.A N ASN 221.A OD1 no hydrogen 2.556 N/A GLY 224.A N ASN 221.A O no hydrogen 3.193 N/A ASP 226.A N ASP 228.A OD2 no hydrogen 2.745 N/A LEU 229.A N ASP 226.A O no hydrogen 3.423 N/A ARG 230.A N ALA 227.A O no hydrogen 3.102 N/A TYR 231.A OH GLU 264.A OE1 no hydrogen 2.743 N/A LEU 232.A N ASP 228.A O no hydrogen 2.966 N/A GLU 233.A N LEU 229.A O no hydrogen 2.941 N/A LEU 234.A N ARG 230.A O no hydrogen 2.987 N/A LEU 235.A N TYR 231.A O no hydrogen 3.110 N/A THR 236.A N LEU 232.A O no hydrogen 2.673 N/A ALA 237.A N GLU 233.A O no hydrogen 2.771 N/A ALA 238.A N LEU 234.A O no hydrogen 3.284 N/A LYS 241.A N LYS 239.A O no hydrogen 2.209 N/A ILE 243.A N ARG 280.A O no hydrogen 2.983 N/A ILE 248.A N GLY 244.A O no hydrogen 2.953 N/A ALA 249.A N LEU 245.A O no hydrogen 2.529 N/A ALA 250.A N ALA 246.A O no hydrogen 3.204 N/A ALA 251.A N SER 247.A O no hydrogen 2.703 N/A LEU 252.A N ILE 248.A O no hydrogen 2.839 N/A SER 253.A N ALA 250.A O no hydrogen 3.291 N/A GLU 254.A N ALA 249.A O no hydrogen 3.120 N/A ASN 257.A N ASP 255.A OD2 no hydrogen 3.197 N/A ASN 257.A ND2 ASP 261.A OD1 no hydrogen 3.343 N/A THR 258.A N ASP 255.A O no hydrogen 3.181 N/A ASP 261.A N ASN 257.A O no hydrogen 3.083 N/A ILE 263.A N THR 258.A O no hydrogen 2.997 N/A GLU 264.A N ILE 259.A O no hydrogen 2.873 N/A LEU 268.A N GLU 264.A O no hydrogen 2.822 N/A ALA 269.A N PRO 265.A O no hydrogen 2.988 N/A ASN 270.A N TYR 266.A O no hydrogen 3.000 N/A GLY 271.A N LEU 268.A O no hydrogen 3.160 N/A TYR 272.A N LEU 267.A O no hydrogen 2.816 N/A GLU 274.A N ILE 281.A O no hydrogen 2.934 N/A ARG 275.A NH1 GLU 260.A O no hydrogen 3.192 N/A THR 276.A OG1 GLY 279.A O no hydrogen 2.783 N/A ARG 280.A N ILE 243.A O no hydrogen 2.804 N/A ILE 281.A N GLU 274.A O no hydrogen 3.086 N/A SER 283.A N TYR 272.A O no hydrogen 2.987 N/A SER 283.A OG GLY 271.A O no hydrogen 2.570 N/A LYS 285.A NZ ASN 270.A O no hydrogen 2.942 N/A SER 286.A N SER 283.A O no hydrogen 3.034 N/A SER 286.A OG TYR 272.A O no hydrogen 2.503 N/A SER 288.A N ALA 284.A O no hydrogen 3.100 N/A SER 288.A OG ALA 284.A O no hydrogen 2.828 N/A SER 288.A OG LYS 285.A O no hydrogen 3.098 N/A ALA 289.A N LYS 285.A O no hydrogen 2.668 N/A LEU 290.A N SER 286.A O no hydrogen 2.786 N/A LYS 291.A N TYR 287.A O no hydrogen 3.172 N/A LEU 292.A N SER 288.A O no hydrogen 3.110 N/A ASN 293.A N ALA 289.A O no hydrogen 2.863 N/A TYR 294.A N LEU 290.A O no hydrogen 3.099 N/A TYR 294.A OH GLU 233.A OE2 no hydrogen 2.499 N/A GLU 295.A N LEU 292.A O no hydrogen 3.487 N/A