Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3f7w_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 1.A N VAL 20.A O no hydrogen 3.388 N/A ASN 3.A ND2.B TYR 32.A OH no hydrogen 2.472 N/A SER 4.A OG.A ASP 49.A OD1.A no hydrogen 3.305 N/A SER 4.A OG.A ASP 49.A OD1.B no hydrogen 2.633 N/A SER 4.A OG.A ASP 49.A OD2.A no hydrogen 2.699 N/A SER 4.A OG.A ASP 49.A OD2.B no hydrogen 2.827 N/A ALA 6.A N VAL 2.A O.A no hydrogen 3.252 N/A ALA 7.A N ASN 3.A O.A no hydrogen 3.041 N/A ARG 8.A N SER 4.A O.A no hydrogen 2.983 N/A ARG 8.A N SER 4.A O.B no hydrogen 3.035 N/A ARG 8.A NE THR 86.A OG1 no hydrogen 3.145 N/A ARG 8.A NH1 LEU 47.A O no hydrogen 3.218 N/A ARG 8.A NH2 LEU 47.A O no hydrogen 3.114 N/A ARG 8.A NH2 THR 86.A OG1 no hydrogen 2.915 N/A VAL 9.A N VAL 5.A O.A no hydrogen 2.924 N/A VAL 9.A N VAL 5.A O.B no hydrogen 2.951 N/A THR 10.A N ALA 6.A O no hydrogen 3.054 N/A THR 10.A OG1 ALA 6.A O no hydrogen 3.195 N/A THR 10.A OG1 ARG 15.A O no hydrogen 3.042 N/A GLU 11.A N.A ALA 7.A O no hydrogen 3.046 N/A GLU 11.A N.B ALA 7.A O no hydrogen 3.031 N/A LEU 12.A N ARG 8.A O no hydrogen 2.920 N/A THR 13.A N VAL 9.A O no hydrogen 2.825 N/A THR 13.A OG1 VAL 9.A O no hydrogen 2.879 N/A GLY 14.A N THR 10.A O no hydrogen 2.802 N/A ARG 15.A N THR 13.A OG1 no hydrogen 3.089 N/A ALA 18.A N GLU 35.A O no hydrogen 2.659 N/A ALA 19.A N GLU 35.A O no hydrogen 3.123 N/A ALA 21.A N ARG 33.A O no hydrogen 2.842 N/A ARG 23.A N LEU 31.A O no hydrogen 2.777 N/A ARG 23.A NH1 GLU 22.A O no hydrogen 2.913 N/A SER 26.A N TRP 29.A O no hydrogen 2.912 N/A TRP 29.A N SER 26.A O no hydrogen 2.928 N/A HIS 30.A N ALA 46.A O no hydrogen 2.901 N/A LEU 31.A N GLY 24.A O no hydrogen 2.800 N/A TYR 32.A N VAL 44.A O no hydrogen 2.857 N/A ARG 33.A N ALA 21.A O no hydrogen 2.952 N/A ARG 33.A NH1 GLU 35.A OE1 no hydrogen 3.070 N/A VAL 34.A N LEU 42.A O no hydrogen 2.844 N/A GLU 35.A N ALA 19.A O no hydrogen 2.824 N/A LEU 36.A N THR 40.A O no hydrogen 2.836 N/A ALA 37.A N GLU 16.A O no hydrogen 2.895 N/A GLY 39.A N LEU 36.A O no hydrogen 2.926 N/A THR 40.A N ASP 38.A OD1 no hydrogen 2.852 N/A THR 40.A OG1 ASP 38.A OD1 no hydrogen 2.500 N/A THR 40.A OG1 ASP 38.A OD2 no hydrogen 3.209 N/A LEU 42.A N VAL 34.A O no hydrogen 2.727 N/A VAL 44.A N TYR 32.A O no hydrogen 2.930 N/A LYS 45.A N LEU 87.A O no hydrogen 2.829 N/A LYS 45.A NZ GLU 61.A OE1 no hydrogen 2.580 N/A LYS 45.A NZ GLU 61.A OE2 no hydrogen 3.137 N/A LYS 45.A NZ ASP 208.A OD1 no hydrogen 2.714 N/A ALA 46.A N HIS 30.A O no hydrogen 2.948 N/A LEU 47.A N ARG 85.A O no hydrogen 2.878 N/A ALA 51.A N PRO 48.A O no hydrogen 3.164 N/A LEU 57.A N LEU 54.A O no hydrogen 3.225 N/A ALA 60.A N GLY 56.A O no hydrogen 3.007 N/A ALA 62.A N PHE 58.A O no hydrogen 2.880 N/A LEU 63.A N ARG 59.A O.A no hydrogen 2.843 N/A LEU 63.A N ARG 59.A O.B no hydrogen 2.870 N/A GLY 64.A N ALA 60.A O no hydrogen 2.907 N/A LEU 65.A N GLU 61.A O no hydrogen 2.756 N/A ASP 66.A N ALA 62.A O no hydrogen 3.083 N/A TRP 67.A N LEU 63.A O no hydrogen 2.926 N/A LEU 68.A N GLY 64.A O no hydrogen 2.860 N/A ARG 70.A NE.A ASP 66.A O no hydrogen 2.979 N/A SER 74.A N SER 71.A O no hydrogen 3.110 N/A SER 74.A OG GLY 69.A O no hydrogen 3.366 N/A VAL 76.A N SER 74.A OG no hydrogen 3.039 N/A GLN 78.A N GLU 89.A OE1 no hydrogen 3.049 N/A ALA 80.A N ALA 88.A O no hydrogen 2.710 N/A GLY 81.A N ALA 88.A O no hydrogen 3.200 N/A ASP 83.A N THR 86.A O no hydrogen 2.895 N/A ARG 85.A N ASP 83.A OD1 no hydrogen 2.772 N/A ARG 85.A NH1 ALA 51.A O no hydrogen 2.767 N/A ARG 85.A NH2 PRO 48.A O no hydrogen 2.652 N/A ARG 85.A NH2 ALA 51.A O no hydrogen 2.672 N/A THR 86.A N ASP 83.A O no hydrogen 3.406 N/A THR 86.A OG1 ASP 83.A OD1 no hydrogen 3.266 N/A LEU 87.A N LYS 45.A O no hydrogen 2.900 N/A ALA 88.A N GLY 81.A O no hydrogen 2.899 N/A GLU 89.A N GLN 78.A O no hydrogen 2.876 N/A TRP 90.A N PRO 41.A O no hydrogen 3.427 N/A TRP 90.A NE1 ASP 92.A OD1 no hydrogen 2.939 N/A ARG 94.A N TRP 199.A O no hydrogen 2.852 N/A ARG 94.A NE ASP 201.A OD1 no hydrogen 2.912 N/A ARG 94.A NH2 ASP 201.A OD1 no hydrogen 3.436 N/A ALA 100.A N THR 97.A OG1 no hydrogen 3.264 N/A ALA 101.A N THR 97.A O no hydrogen 2.993 N/A GLU 102.A N PRO 98.A O no hydrogen 3.067 N/A ARG 103.A N GLU 99.A O no hydrogen 3.238 N/A ARG 103.A NE ASP 202.A O no hydrogen 2.886 N/A PHE 104.A N ALA 100.A O no hydrogen 2.793 N/A GLY 105.A N ALA 101.A O no hydrogen 3.015 N/A HIS 106.A N GLU 102.A O no hydrogen 3.365 N/A HIS 106.A NE2 GLU 239.A OE1 no hydrogen 3.098 N/A GLN 107.A N ARG 103.A O no hydrogen 3.034 N/A GLN 107.A NE2 GLY 73.A O no hydrogen 2.860 N/A GLN 107.A NE2 ALA 204.A O no hydrogen 3.525 N/A LEU 108.A N PHE 104.A O no hydrogen 2.916 N/A ALA 109.A N GLY 105.A O no hydrogen 3.127 N/A ALA 110.A N HIS 106.A O no hydrogen 3.101 N/A HIS 111.A ND1 TYR 237.A OH no hydrogen 2.749 N/A HIS 111.A NE2 ASP 219.A OD2 no hydrogen 2.802 N/A LEU 112.A N ALA 109.A O no hydrogen 2.981 N/A ALA 113.A N ALA 110.A O no hydrogen 3.149 N/A GLY 114.A N HIS 111.A O no hydrogen 3.107 N/A ALA 115.A N PRO 185.A O no hydrogen 3.233 N/A SER 117.A OG PHE 118.A O no hydrogen 2.997 N/A PHE 118.A N ARG 135.A O no hydrogen 2.972 N/A GLY 119.A N GLY 213.A O no hydrogen 2.826 N/A ALA 120.A N ASN 132.A O no hydrogen 2.855 N/A TYR 125.A OH ASP 55.A O.A no hydrogen 2.821 N/A TYR 125.A OH ASP 55.A O.B no hydrogen 2.505 N/A ILE 126.A N LEU 129.A O no hydrogen 2.822 N/A LEU 129.A N ILE 126.A O no hydrogen 2.973 N/A ASN 132.A ND2 TRP 122.A O no hydrogen 3.098 N/A THR 133.A N ASP 131.A OD1 no hydrogen 3.023 N/A THR 133.A OG1 ASP 131.A OD1 no hydrogen 2.617 N/A ARG 135.A N PHE 118.A O no hydrogen 3.081 N/A ARG 135.A NH1 GLU 144.A OE1 no hydrogen 2.847 N/A ARG 135.A NH1 GLN 145.A OE1 no hydrogen 2.961 N/A ARG 135.A NH2 GLU 144.A OE1 no hydrogen 3.228 N/A THR 137.A OG1 GLU 140.A OE1 no hydrogen 2.559 N/A PHE 141.A N THR 137.A O no hydrogen 3.331 N/A TYR 142.A N TRP 138.A O no hydrogen 2.749 N/A TYR 142.A OH LEU 253.A O no hydrogen 2.718 N/A ALA 143.A N PRO 139.A O no hydrogen 2.984 N/A GLU 144.A N GLU 140.A O no hydrogen 3.002 N/A GLN 145.A N PHE 141.A O no hydrogen 2.879 N/A GLN 145.A NE2 ASP 131.A O no hydrogen 2.995 N/A GLN 145.A NE2 THR 133.A O no hydrogen 2.837 N/A ARG 146.A N TYR 142.A O no hydrogen 2.864 N/A ARG 146.A NE HIS 212.A NE2 no hydrogen 3.307 N/A ARG 146.A NH1 ASP 131.A O no hydrogen 2.691 N/A ARG 146.A NH1 GLN 145.A O no hydrogen 2.965 N/A ARG 146.A NH2 ASP 131.A O no hydrogen 3.540 N/A ARG 146.A NH2 ASN 132.A OD1 no hydrogen 2.893 N/A LEU 148.A N ALA 143.A O no hydrogen 2.838 N/A TYR 150.A N ILE 147.A O no hydrogen 3.211 N/A TYR 150.A OH PRO 130.A O no hydrogen 2.755 N/A LEU 151.A N ILE 147.A O no hydrogen 2.984 N/A ARG 152.A N.A LEU 148.A O no hydrogen 2.926 N/A ARG 152.A N.B LEU 148.A O no hydrogen 2.926 N/A ARG 152.A NH1.A GLU 169.A OE2 no hydrogen 3.172 N/A ARG 152.A NH2.A GLU 169.A OE2 no hydrogen 2.832 N/A ARG 153.A N PRO 149.A O no hydrogen 3.103 N/A ALA 154.A N TYR 150.A O no hydrogen 2.945 N/A ALA 155.A N LEU 151.A O no hydrogen 2.951 N/A ASP 156.A N.A ARG 152.A O.A no hydrogen 2.883 N/A ASP 156.A N.A ARG 152.A O.B no hydrogen 2.943 N/A ASP 156.A N.B ARG 152.A O.A no hydrogen 2.878 N/A ASP 156.A N.B ARG 152.A O.B no hydrogen 2.938 N/A ARG 157.A N ARG 153.A O no hydrogen 3.048 N/A GLY 158.A N ALA 155.A O no hydrogen 2.964 N/A ALA 159.A N ALA 154.A O no hydrogen 2.967 N/A THR 161.A N ASP 164.A OD2 no hydrogen 2.869 N/A ASP 164.A N THR 161.A OG1 no hydrogen 3.012 N/A VAL 165.A N THR 161.A O no hydrogen 2.986 N/A ARG 166.A N PRO 162.A O no hydrogen 2.903 N/A LEU 167.A N GLY 163.A O no hydrogen 2.929 N/A VAL 168.A N ASP 164.A O no hydrogen 3.025 N/A GLU 169.A N VAL 165.A O no hydrogen 2.889 N/A LYS 170.A N ARG 166.A O no hydrogen 2.930 N/A VAL 171.A N LEU 167.A O no hydrogen 3.462 N/A LEU 172.A N VAL 168.A O no hydrogen 3.182 N/A ASP 173.A N GLU 169.A O no hydrogen 2.939 N/A ALA 174.A N LYS 170.A O no hydrogen 3.121 N/A ALA 174.A N VAL 171.A O no hydrogen 2.994 N/A LEU 175.A N LEU 172.A O no hydrogen 3.118 N/A HIS 177.A N.A ALA 174.A O no hydrogen 3.033 N/A HIS 177.A N.B ASP 176.A OD1.B no hydrogen 2.677 N/A LEU 178.A N ALA 174.A O no hydrogen 2.945 N/A ALA 179.A N LEU 175.A O no hydrogen 2.807 N/A GLY 180.A N HIS 177.A O.A no hydrogen 3.496 N/A ALA 186.A N GLY 214.A O no hydrogen 2.819 N/A ARG 187.A N HIS 111.A O no hydrogen 3.174 N/A ARG 187.A NE GLY 114.A O no hydrogen 2.664 N/A ARG 187.A NH1 TRP 67.A O no hydrogen 2.860 N/A ARG 187.A NH2 GLY 114.A O no hydrogen 3.441 N/A ILE 188.A N HIS 212.A O no hydrogen 3.005 N/A HIS 189.A N ASP 219.A OD2 no hydrogen 2.817 N/A HIS 189.A NE2 ILE 207.A O no hydrogen 2.705 N/A GLY 190.A N ASP 219.A OD1 no hydrogen 3.039 N/A ASP 191.A N HIS 189.A ND1 no hydrogen 3.083 N/A TRP 193.A N ASP 191.A O no hydrogen 3.045 N/A ASN 194.A ND2 GLY 226.A O no hydrogen 3.088 N/A ASN 196.A N TRP 193.A O no hydrogen 2.853 N/A ASN 196.A ND2 ASP 191.A O no hydrogen 2.783 N/A VAL 197.A N ASN 194.A O no hydrogen 3.105 N/A LEU 198.A N VAL 205.A O no hydrogen 2.724 N/A GLN 200.A N GLY 203.A O no hydrogen 2.914 N/A GLN 200.A NE2 ASP 92.A O no hydrogen 2.818 N/A GLN 200.A NE2 TRP 199.A O no hydrogen 2.809 N/A ALA 204.A N GLN 107.A OE1 no hydrogen 3.024 N/A VAL 205.A N LEU 198.A O no hydrogen 2.787 N/A VAL 206.A N PRO 75.A O no hydrogen 2.842 N/A ILE 207.A N ASN 196.A O no hydrogen 2.925 N/A ALA 210.A N HIS 189.A O no hydrogen 2.766 N/A HIS 212.A N ILE 188.A O no hydrogen 3.216 N/A HIS 212.A ND1 ALA 210.A O no hydrogen 2.799 N/A GLY 213.A N GLY 119.A O no hydrogen 2.773 N/A GLY 214.A N ALA 186.A O no hydrogen 2.985 N/A ARG 216.A NE GLU 183.A OE2 no hydrogen 2.891 N/A ARG 216.A NH1 TYR 237.A OH no hydrogen 3.005 N/A ARG 216.A NH1 ALA 241.A O no hydrogen 2.867 N/A ARG 216.A NH2 ALA 241.A O no hydrogen 3.484 N/A ARG 216.A NH2 PRO 242.A O no hydrogen 2.833 N/A GLU 217.A N HIS 215.A ND1 no hydrogen 3.153 N/A ALA 218.A N HIS 215.A O no hydrogen 2.892 N/A ASP 219.A N ARG 216.A O no hydrogen 3.236 N/A ALA 221.A N GLU 217.A O no hydrogen 2.828 N/A LEU 222.A N LEU 192.A O no hydrogen 3.181 N/A ALA 223.A N LEU 220.A O.A no hydrogen 3.152 N/A ALA 223.A N LEU 220.A O.B no hydrogen 3.142 N/A LEU 224.A N ALA 221.A O no hydrogen 2.838 N/A GLY 226.A N ALA 223.A O no hydrogen 3.184 N/A LEU 230.A N LEU 227.A O no hydrogen 3.192 N/A VAL 233.A N TYR 229.A O no hydrogen 3.059 N/A ARG 234.A N LEU 230.A O no hydrogen 2.933 N/A ARG 234.A NH2 ASP 231.A OD1 no hydrogen 2.902 N/A ASP 235.A N ASP 231.A O no hydrogen 2.782 N/A ALA 236.A N ARG 232.A O no hydrogen 3.050 N/A TYR 237.A N VAL 233.A O no hydrogen 2.883 N/A TYR 237.A OH HIS 111.A ND1 no hydrogen 2.749 N/A ASN 238.A N ARG 234.A O no hydrogen 2.860 N/A GLU 239.A N ASP 235.A O no hydrogen 3.041 N/A GLU 239.A N ALA 236.A O no hydrogen 3.125 N/A VAL 240.A N TYR 237.A O no hydrogen 3.152 N/A ALA 241.A N TYR 237.A O no hydrogen 2.868 N/A LEU 243.A N ASN 238.A OD1 no hydrogen 2.878 N/A TRP 247.A N ALA 244.A O no hydrogen 3.245 N/A ARG 250.A N GLY 246.A O no hydrogen 3.364 N/A ARG 250.A N TRP 247.A O no hydrogen 3.069 N/A ARG 250.A NE GLU 217.A OE1 no hydrogen 2.956 N/A ARG 250.A NH1 GLU 245.A O no hydrogen 2.905 N/A ARG 250.A NH2 GLU 217.A OE1 no hydrogen 3.561 N/A ARG 250.A NH2 GLU 217.A OE2 no hydrogen 2.832 N/A ARG 250.A NH2 ALA 244.A O no hydrogen 3.185 N/A ARG 250.A NH2 GLU 245.A O no hydrogen 3.384 N/A ILE 251.A N ARG 248.A O.A no hydrogen 3.164 N/A ILE 251.A N ARG 248.A O.B no hydrogen 3.307 N/A HIS 254.A N ARG 250.A O no hydrogen 3.321 N/A GLN 255.A N ILE 251.A O no hydrogen 3.210 N/A GLN 255.A N PRO 252.A O no hydrogen 2.965 N/A GLN 255.A NE2 ALA 221.A O no hydrogen 2.992 N/A LEU 256.A N LEU 253.A O no hydrogen 3.293 N/A HIS 257.A N TYR 142.A OH no hydrogen 3.094 N/A HIS 257.A ND1 ARG 146.A O no hydrogen 2.686 N/A LEU 259.A N GLN 255.A O no hydrogen 3.064 N/A LEU 260.A N LEU 256.A O no hydrogen 2.971 N/A VAL 261.A N HIS 257.A O no hydrogen 3.060 N/A HIS 262.A N PRO 258.A O no hydrogen 2.954 N/A VAL 263.A N LEU 259.A O no hydrogen 3.002 N/A CYS 264.A N LEU 260.A O no hydrogen 2.942 N/A CYS 264.A SG TYR 150.A O no hydrogen 3.212 N/A CYS 264.A SG LEU 260.A O no hydrogen 3.327 N/A LEU 265.A N VAL 261.A O no hydrogen 2.881 N/A PHE 266.A N HIS 262.A O no hydrogen 2.689 N/A GLY 267.A N VAL 263.A O no hydrogen 3.017 N/A TYR 270.A N GLY 267.A O no hydrogen 3.505 N/A ARG 271.A N ALA 268.A O no hydrogen 2.817 N/A ARG 271.A NE ASP 164.A OD2 no hydrogen 2.815 N/A ARG 271.A NH2 ASP 164.A OD2 no hydrogen 3.349 N/A LEU 274.A N TYR 270.A O no hydrogen 3.025 N/A VAL 275.A N ARG 271.A O no hydrogen 2.904 N/A ASP 276.A N THR 272.A O no hydrogen 2.831 N/A THR 277.A N THR 273.A O no hydrogen 2.846 N/A THR 277.A OG1 THR 273.A O no hydrogen 2.703 N/A ALA 278.A N LEU 274.A O no hydrogen 2.936 N/A ARG 279.A N VAL 275.A O no hydrogen 2.972 N/A ALA 280.A N ASP 276.A O no hydrogen 2.968 N/A ALA 281.A N THR 277.A O no hydrogen 2.793 N/A LEU 282.A N ALA 278.A O no hydrogen 2.992 N/A ARG 283.A N ARG 279.A O no hydrogen 3.284 N/A ARG 283.A N ALA 280.A O no hydrogen 3.256 N/A ALA 284.A N ALA 281.A O no hydrogen 3.167 N/A