Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3fy2_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 4.A NE2 GLU 9.A OE1 no hydrogen 2.552 N/A PHE 6.A N VAL 3.A O no hydrogen 3.093 N/A LEU 10.A N VAL 82.A O no hydrogen 2.736 N/A THR 13.A N ASP 11.A OD1 no hydrogen 3.122 N/A THR 13.A OG1 ASP 11.A OD1 no hydrogen 2.935 N/A ASN 14.A N ASP 11.A O no hydrogen 2.885 N/A ILE 15.A N ALA 12.A O no hydrogen 3.066 N/A SER 16.A N ARG 33.A O no hydrogen 2.931 N/A ASP 18.A N SER 31.A O no hydrogen 2.829 N/A LYS 19.A N SER 31.A O no hydrogen 3.277 N/A LYS 19.A NZ SER 31.A OG no hydrogen 2.631 N/A VAL 21.A N VAL 29.A O no hydrogen 2.825 N/A GLY 24.A N GLY 27.A O no hydrogen 2.771 N/A VAL 29.A N GLY 22.A O no hydrogen 2.831 N/A CYS 30.A N ILE 46.A O no hydrogen 2.685 N/A SER 31.A N LYS 19.A O no hydrogen 2.773 N/A GLY 32.A N VAL 44.A O no hydrogen 2.908 N/A ARG 33.A N SER 16.A O no hydrogen 2.896 N/A ARG 33.A NE GLU 41.A OE1 no hydrogen 3.157 N/A ARG 33.A NH2 GLU 41.A OE1 no hydrogen 2.788 N/A LEU 34.A N ILE 42.A O no hydrogen 2.840 N/A LYS 35.A N ASN 14.A O no hydrogen 2.872 N/A LYS 35.A NZ LYS 39.A O no hydrogen 2.999 N/A LYS 35.A NZ GLU 41.A OE2 no hydrogen 2.669 N/A LEU 36.A N LYS 40.A O no hydrogen 2.721 N/A LYS 39.A N LEU 36.A O no hydrogen 2.777 N/A LYS 40.A N SER 38.A OG no hydrogen 3.310 N/A ILE 42.A N LEU 34.A O no hydrogen 2.958 N/A VAL 44.A N GLY 32.A O no hydrogen 2.933 N/A ALA 45.A N THR 93.A O no hydrogen 2.918 N/A ILE 46.A N CYS 30.A O no hydrogen 2.738 N/A LYS 47.A N ILE 91.A O no hydrogen 2.787 N/A THR 48.A N GLU 28.A O no hydrogen 3.060 N/A THR 48.A OG1 GLU 28.A O no hydrogen 3.330 N/A LEU 49.A N VAL 89.A O no hydrogen 2.917 N/A LYS 50.A N PHE 26.A O no hydrogen 2.743 N/A TYR 53.A N LYS 50.A O no hydrogen 3.252 N/A THR 54.A N GLN 57.A OE1 no hydrogen 2.768 N/A THR 54.A OG1 GLN 57.A OE1 no hydrogen 3.202 N/A LYS 56.A NZ ASP 60.A OD2 no hydrogen 3.504 N/A GLN 57.A N THR 54.A OG1 no hydrogen 3.029 N/A ARG 58.A N THR 54.A O no hydrogen 3.013 N/A ARG 59.A N GLU 55.A O no hydrogen 2.997 N/A ARG 59.A NH1 GLU 55.A OE2 no hydrogen 3.319 N/A ASP 60.A N LYS 56.A O no hydrogen 2.892 N/A PHE 61.A N GLN 57.A O no hydrogen 2.886 N/A LEU 62.A N ARG 58.A O no hydrogen 2.934 N/A GLY 63.A N ARG 59.A O no hydrogen 2.814 N/A GLU 64.A N ASP 60.A O no hydrogen 3.317 N/A SER 66.A N LEU 62.A O no hydrogen 2.867 N/A SER 66.A OG LEU 62.A O no hydrogen 3.164 N/A ILE 67.A N GLY 63.A O no hydrogen 3.211 N/A MET 68.A N GLU 64.A O no hydrogen 3.035 N/A GLY 69.A N ALA 65.A O no hydrogen 2.914 N/A GLN 70.A N ILE 67.A O no hydrogen 2.940 N/A GLN 70.A NE2 SER 66.A O no hydrogen 3.222 N/A PHE 71.A N MET 68.A O no hydrogen 3.094 N/A ASN 75.A N HIS 73.A ND1 no hydrogen 2.981 N/A ASN 75.A ND2 CYS 154.A O no hydrogen 3.014 N/A ILE 76.A N HIS 73.A O no hydrogen 3.179 N/A ILE 77.A N VAL 156.A O no hydrogen 2.949 N/A ARG 78.A N GLU 94.A OE2 no hydrogen 2.822 N/A ARG 78.A NE GLU 80.A OE2 no hydrogen 2.986 N/A GLU 80.A N VAL 92.A O no hydrogen 2.803 N/A GLY 81.A N VAL 92.A O no hydrogen 3.278 N/A VAL 82.A N LYS 8.A O no hydrogen 2.890 N/A VAL 83.A N MET 90.A O no hydrogen 2.977 N/A THR 84.A N GLU 9.A OE2 no hydrogen 2.815 N/A THR 84.A OG1 GLU 9.A OE1 no hydrogen 2.619 N/A THR 84.A OG1 GLU 9.A OE2 no hydrogen 3.454 N/A LYS 85.A N GLU 9.A OE2 no hydrogen 3.084 N/A LYS 87.A NZ TYR 53.A OH no hydrogen 2.756 N/A MET 90.A N VAL 83.A O no hydrogen 2.935 N/A ILE 91.A N LYS 47.A O no hydrogen 2.812 N/A VAL 92.A N GLY 81.A O no hydrogen 2.947 N/A THR 93.A N ALA 45.A O no hydrogen 2.957 N/A GLU 94.A N ARG 78.A O no hydrogen 2.961 N/A ASN 98.A N ILE 148.A O no hydrogen 2.976 N/A ASN 98.A ND2 ASN 149.A O no hydrogen 2.992 N/A GLY 99.A N MET 96.A O no hydrogen 3.182 N/A SER 100.A OG ARG 144.A O no hydrogen 3.385 N/A LEU 101.A N ILE 146.A O no hydrogen 2.840 N/A SER 103.A OG.A ASP 102.A OD1 no hydrogen 3.446 N/A SER 103.A OG.B SER 100.A O no hydrogen 3.035 N/A PHE 104.A N SER 100.A O no hydrogen 3.052 N/A LEU 105.A N LEU 101.A O no hydrogen 2.905 N/A ARG 106.A N ASP 102.A O no hydrogen 3.062 N/A ARG 106.A NE GLY 205.A O no hydrogen 2.780 N/A ARG 106.A NH2 ASP 102.A OD2 no hydrogen 2.797 N/A ARG 106.A NH2 GLY 205.A O no hydrogen 3.278 N/A LYS 107.A N PHE 104.A O no hydrogen 3.111 N/A HIS 108.A N LEU 105.A O no hydrogen 2.980 N/A HIS 108.A ND1 GLN 111.A OE1 no hydrogen 2.859 N/A GLN 111.A N HIS 108.A O no hydrogen 2.803 N/A PHE 112.A N TYR 204.A OH no hydrogen 3.042 N/A THR 113.A N GLN 116.A OE1 no hydrogen 2.924 N/A THR 113.A OG1 GLN 116.A OE1 no hydrogen 3.449 N/A GLN 116.A N THR 113.A OG1 no hydrogen 3.027 N/A LEU 117.A N THR 113.A O no hydrogen 3.065 N/A VAL 118.A N VAL 114.A O no hydrogen 2.829 N/A GLY 119.A N ILE 115.A O no hydrogen 2.889 N/A MET 120.A N GLN 116.A O no hydrogen 3.112 N/A LEU 121.A N LEU 117.A O no hydrogen 3.014 N/A ARG 122.A N VAL 118.A O no hydrogen 2.819 N/A ARG 122.A NE ASP 263.A OD1 no hydrogen 2.745 N/A ARG 122.A NH2 ASP 263.A OD1 no hydrogen 3.450 N/A ARG 122.A NH2 ASP 263.A OD2 no hydrogen 3.026 N/A GLY 123.A N GLY 119.A O no hydrogen 3.143 N/A ILE 124.A N MET 120.A O no hydrogen 3.068 N/A ALA 125.A N LEU 121.A O no hydrogen 2.973 N/A SER 126.A N ARG 122.A O no hydrogen 2.847 N/A GLY 127.A N GLY 123.A O no hydrogen 3.029 N/A MET 128.A N ILE 124.A O no hydrogen 2.970 N/A LYS 129.A N ALA 125.A O no hydrogen 2.862 N/A LYS 129.A NZ ASP 133.A OD1 no hydrogen 3.547 N/A LYS 129.A NZ ASP 133.A OD2 no hydrogen 2.783 N/A TYR 130.A N SER 126.A O no hydrogen 3.171 N/A LEU 131.A N GLY 127.A O no hydrogen 2.957 N/A SER 132.A N MET 128.A O no hydrogen 2.899 N/A SER 132.A OG MET 128.A O no hydrogen 2.807 N/A SER 132.A OG LYS 129.A O no hydrogen 2.897 N/A ASP 133.A N LYS 129.A O no hydrogen 2.881 N/A MET 134.A N TYR 130.A O no hydrogen 2.943 N/A MET 134.A N LEU 131.A O no hydrogen 3.179 N/A GLY 135.A N SER 132.A O no hydrogen 3.005 N/A TYR 136.A N LEU 131.A O no hydrogen 3.181 N/A TYR 136.A OH GLN 70.A OE1 no hydrogen 2.957 N/A VAL 137.A N ARG 163.A O no hydrogen 2.995 N/A HIS 138.A N ASP 190.A OD2 no hydrogen 2.820 N/A HIS 138.A NE2 SER 157.A O no hydrogen 2.873 N/A ARG 139.A N ASP 190.A OD1 no hydrogen 3.100 N/A ARG 139.A NH1 LEU 161.A O no hydrogen 2.843 N/A ASP 140.A N HIS 138.A ND1 no hydrogen 3.039 N/A ALA 143.A N GLU 200.A OE1 no hydrogen 2.963 N/A ARG 144.A NH2 ASP 140.A OD1 no hydrogen 2.860 N/A ASN 145.A N ALA 142.A O no hydrogen 2.807 N/A ASN 145.A ND2 ASP 140.A O no hydrogen 2.825 N/A ILE 146.A N ALA 143.A O no hydrogen 3.094 N/A LEU 147.A N LYS 155.A O no hydrogen 3.000 N/A ILE 148.A N GLY 99.A O no hydrogen 2.869 N/A ASN 149.A N VAL 153.A O no hydrogen 3.067 N/A ASN 151.A N ASN 149.A OD1 no hydrogen 2.926 N/A LEU 152.A N ASN 149.A O no hydrogen 3.004 N/A VAL 153.A N ASN 149.A OD1 no hydrogen 3.003 N/A CYS 154.A SG LEU 152.A O no hydrogen 3.822 N/A LYS 155.A N LEU 147.A O no hydrogen 2.902 N/A LYS 155.A NZ.A PRO 74.A O no hydrogen 2.749 N/A LYS 155.A NZ.B PRO 74.A O no hydrogen 2.995 N/A LYS 155.A NZ.B GLU 94.A OE1 no hydrogen 2.952 N/A LYS 155.A NZ.B GLU 94.A OE2 no hydrogen 3.532 N/A VAL 156.A N ASN 75.A O no hydrogen 2.903 N/A SER 157.A N ASN 145.A O no hydrogen 2.942 N/A PHE 159.A N GLU 64.A OE2 no hydrogen 2.858 N/A GLY 160.A N ASP 158.A OD1 no hydrogen 3.315 N/A SER 162.A N PHE 159.A O no hydrogen 3.120 N/A SER 162.A OG VAL 137.A O no hydrogen 3.355 N/A ARG 163.A N VAL 137.A O no hydrogen 3.090 N/A LEU 165.A N GLY 135.A O no hydrogen 2.830 N/A ARG 173.A NE PRO 208.A O no hydrogen 2.849 N/A ARG 173.A NE TRP 210.A O no hydrogen 3.419 N/A ARG 173.A NH1 MET 212.A O no hydrogen 3.373 N/A ARG 173.A NH2 TYR 209.A O no hydrogen 3.371 N/A ARG 173.A NH2 TRP 210.A O no hydrogen 2.907 N/A ARG 173.A NH2 MET 212.A O no hydrogen 2.707 N/A TRP 174.A N PRO 171.A O no hydrogen 2.935 N/A TRP 174.A NE1 GLU 200.A OE1 no hydrogen 2.897 N/A THR 175.A N ILE 172.A O no hydrogen 3.128 N/A THR 175.A OG1 PRO 171.A O no hydrogen 2.690 N/A GLU 178.A N GLU 178.A OE1 no hydrogen 2.807 N/A ALA 179.A N SER 176.A OG no hydrogen 3.265 N/A ILE 180.A N SER 176.A O no hydrogen 2.955 N/A ALA 181.A N PRO 177.A O no hydrogen 2.866 N/A TYR 182.A N GLU 178.A O no hydrogen 3.079 N/A ARG 183.A N ALA 179.A O no hydrogen 2.873 N/A LYS 184.A N GLU 178.A O no hydrogen 3.440 N/A THR 186.A N SER 189.A OG no hydrogen 2.833 N/A SER 189.A N THR 186.A O no hydrogen 2.959 N/A SER 189.A N THR 186.A OG1 no hydrogen 3.291 N/A SER 189.A OG THR 186.A O no hydrogen 2.696 N/A ASP 190.A N THR 186.A O no hydrogen 3.276 N/A VAL 191.A N SER 187.A O no hydrogen 2.883 N/A TRP 192.A N ALA 188.A O no hydrogen 3.137 N/A SER 193.A N SER 189.A O no hydrogen 3.206 N/A SER 193.A OG TRP 174.A O no hydrogen 2.720 N/A SER 193.A OG SER 189.A O no hydrogen 3.240 N/A TYR 194.A N ASP 190.A O no hydrogen 2.833 N/A TYR 194.A OH LEU 121.A O no hydrogen 2.779 N/A GLY 195.A N VAL 191.A O no hydrogen 3.011 N/A ILE 196.A N TRP 192.A O no hydrogen 3.174 N/A VAL 197.A N SER 193.A O no hydrogen 2.885 N/A LEU 198.A N TYR 194.A O no hydrogen 2.779 N/A TRP 199.A N GLY 195.A O no hydrogen 3.013 N/A TRP 199.A NE1 PRO 228.A O no hydrogen 2.852 N/A GLU 200.A N ILE 196.A O no hydrogen 2.834 N/A VAL 201.A N VAL 197.A O no hydrogen 2.804 N/A MET 202.A N LEU 198.A O no hydrogen 3.035 N/A SER 203.A N TRP 199.A O no hydrogen 2.922 N/A SER 203.A OG TRP 199.A O no hydrogen 2.846 N/A TYR 204.A N VAL 201.A O no hydrogen 3.047 N/A GLY 205.A N GLU 200.A O no hydrogen 2.759 N/A GLU 206.A N SER 203.A O no hydrogen 3.319 N/A ARG 207.A NH1.B GLU 211.A OE2 no hydrogen 3.224 N/A TRP 210.A N ARG 207.A O no hydrogen 2.896 N/A MET 212.A N TYR 209.A O no hydrogen 3.053 N/A VAL 217.A N SER 213.A O no hydrogen 2.919 N/A ILE 218.A N ASN 214.A O no hydrogen 3.053 N/A LYS 219.A N GLN 215.A O no hydrogen 3.009 N/A ALA 220.A N ASP 216.A O no hydrogen 2.888 N/A VAL 221.A N VAL 217.A O no hydrogen 3.145 N/A ASP 222.A N ILE 218.A O no hydrogen 3.103 N/A GLU 223.A N LYS 219.A O no hydrogen 2.902 N/A GLY 224.A N VAL 221.A O no hydrogen 2.968 N/A TYR 225.A N ALA 220.A O no hydrogen 3.007 N/A ARG 226.A N LEU 283.A O no hydrogen 2.760 N/A ARG 226.A NE TRP 245.A O no hydrogen 3.140 N/A ARG 226.A NH1 VAL 221.A O no hydrogen 2.899 N/A ARG 226.A NH1 TYR 225.A O no hydrogen 2.867 N/A ARG 226.A NH2 TRP 245.A O no hydrogen 2.995 N/A CYS 233.A N PRO 230.A O no hydrogen 3.082 N/A CYS 233.A SG PRO 234.A O no hydrogen 3.480 N/A ALA 235.A N ILE 274.A O no hydrogen 2.862 N/A LEU 237.A N PRO 234.A O no hydrogen 2.973 N/A TYR 238.A N PRO 234.A O no hydrogen 3.087 N/A TYR 238.A OH LEU 227.A O no hydrogen 2.717 N/A GLN 239.A N ALA 235.A O no hydrogen 2.888 N/A GLN 239.A NE2 ASP 243.A OD1 no hydrogen 2.978 N/A LEU 240.A N ALA 236.A O no hydrogen 3.096 N/A MET 241.A N LEU 237.A O no hydrogen 3.025 N/A LEU 242.A N TYR 238.A O no hydrogen 2.990 N/A ASP 243.A N GLN 239.A O no hydrogen 2.893 N/A CYS 244.A N LEU 240.A O no hydrogen 2.887 N/A CYS 244.A SG LEU 240.A O no hydrogen 3.390 N/A TRP 245.A N MET 241.A O no hydrogen 2.913 N/A TRP 245.A N LEU 242.A O no hydrogen 3.206 N/A GLN 246.A N ASP 243.A O no hydrogen 3.279 N/A GLN 246.A NE2 LEU 242.A O no hydrogen 3.170 N/A LYS 247.A NZ ASP 222.A O no hydrogen 2.904 N/A ASN 250.A N ASP 248.A OD1 no hydrogen 2.933 N/A ASN 251.A N ASP 248.A O no hydrogen 2.918 N/A ARG 252.A N ARG 249.A O no hydrogen 3.239 N/A ARG 252.A NE GLN 246.A O no hydrogen 2.856 N/A ARG 252.A NH1 GLU 178.A OE2 no hydrogen 2.769 N/A ARG 252.A NH1 ALA 188.A O no hydrogen 3.002 N/A ARG 252.A NH2 GLU 178.A OE1 no hydrogen 2.943 N/A ARG 252.A NH2 GLU 178.A OE2 no hydrogen 3.501 N/A ARG 252.A NH2 GLN 246.A O no hydrogen 2.958 N/A LYS 254.A N GLN 257.A OE1 no hydrogen 2.878 N/A ILE 258.A N LYS 254.A O no hydrogen 2.980 N/A VAL 259.A N PHE 255.A O no hydrogen 2.930 N/A SER 260.A N GLU 256.A O no hydrogen 3.049 N/A ILE 261.A N GLN 257.A O no hydrogen 2.857 N/A LEU 262.A N ILE 258.A O no hydrogen 2.988 N/A ASP 263.A N VAL 259.A O no hydrogen 2.865 N/A LYS 264.A N SER 260.A O no hydrogen 3.026 N/A LEU 265.A N ILE 261.A O no hydrogen 3.156 N/A ILE 266.A N LEU 262.A O no hydrogen 2.935 N/A ARG 267.A N ASP 263.A O no hydrogen 2.970 N/A ASN 268.A N LYS 264.A O no hydrogen 2.909 N/A SER 271.A N ASN 268.A O no hydrogen 2.864 N/A SER 271.A OG ASN 268.A O no hydrogen 2.461 N/A LEU 272.A N PRO 269.A O no hydrogen 3.084 N/A LYS 273.A N GLY 270.A O no hydrogen 3.015 N/A ILE 274.A N SER 271.A O no hydrogen 3.492 N/A THR 276.A N CYS 233.A O no hydrogen 2.937 N/A THR 276.A OG1 CYS 233.A O no hydrogen 2.972 N/A ARG 278.A NE SER 280.A O no hydrogen 2.827 N/A ARG 278.A NE ASN 281.A O no hydrogen 3.045 N/A ARG 278.A NH2 ASN 281.A O no hydrogen 2.782 N/A ARG 278.A NH2 ASN 281.A OD1 no hydrogen 3.415 N/A SER 280.A OG LEU 282.A O no hydrogen 2.692 N/A LEU 283.A N ARG 226.A O no hydrogen 2.811 N/A ASP 285.A N GLY 224.A O no hydrogen 2.962 N/A