Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3fdj_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A NE ASP 70.A OD2 no hydrogen 2.598 N/A ARG 2.A NH1 ALA 66.A O no hydrogen 2.897 N/A ARG 2.A NH2 ASP 70.A OD2 no hydrogen 3.174 N/A LEU 3.A N VAL 17.A O no hydrogen 2.951 N/A VAL 4.A N PHE 74.A O no hydrogen 2.827 N/A ALA 5.A N LYS 19.A O no hydrogen 3.079 N/A ASP 6.A N VAL 76.A O no hydrogen 3.289 N/A SER 7.A N VAL 21.A O no hydrogen 2.919 N/A SER 7.A OG ASP 34.A OD2 no hydrogen 2.724 N/A ALA 8.A N ASP 6.A OD1 no hydrogen 2.855 N/A CYS 9.A N ASP 6.A O no hydrogen 3.061 N/A CYS 9.A SG ASP 6.A O no hydrogen 3.282 N/A CYS 9.A SG ILE 11.A O no hydrogen 3.562 N/A ASP 10.A N SER 7.A O no hydrogen 3.076 N/A LYS 19.A N LEU 3.A O no hydrogen 3.035 N/A VAL 21.A N ALA 5.A O no hydrogen 2.795 N/A LEU 23.A N SER 7.A OG no hydrogen 3.039 N/A THR 24.A N.A ALA 56.A O no hydrogen 3.219 N/A THR 24.A N.B ALA 56.A O no hydrogen 3.218 N/A ILE 25.A N PHE 32.A O no hydrogen 2.843 N/A SER 26.A N.A TYR 54.A O no hydrogen 2.792 N/A SER 26.A N.B TYR 54.A O no hydrogen 2.774 N/A THR 27.A N GLU 30.A O no hydrogen 2.990 N/A THR 27.A OG1 GLU 30.A O no hydrogen 3.550 N/A ASN 29.A N THR 27.A OG1 no hydrogen 3.142 N/A GLU 30.A N THR 27.A OG1 no hydrogen 3.121 N/A PHE 32.A N ILE 25.A O no hydrogen 2.684 N/A CYS 33.A SG ASP 35.A OD2 no hydrogen 3.580 N/A ASP 34.A N LEU 23.A O no hydrogen 2.915 N/A ASP 35.A N CYS 33.A O no hydrogen 2.837 N/A GLN 37.A N ASP 35.A OD1 no hydrogen 2.791 N/A LEU 38.A N ASP 35.A O no hydrogen 3.362 N/A HIS 41.A ND1 GLU 222.A OE2 no hydrogen 2.653 N/A ARG 42.A N ASP 39.A OD1 no hydrogen 2.983 N/A ARG 42.A NH1 GLU 30.A OE2 no hydrogen 3.017 N/A ARG 42.A NH2 GLU 30.A OE1 no hydrogen 3.265 N/A ASP 44.A N HIS 41.A O no hydrogen 3.057 N/A ILE 45.A N ARG 42.A O no hydrogen 2.917 N/A GLU 47.A N.A LEU 43.A O no hydrogen 2.928 N/A GLU 47.A N.B LEU 43.A O no hydrogen 2.931 N/A LYS 48.A N ILE 45.A O no hydrogen 3.345 N/A HIS 49.A N LEU 46.A O no hydrogen 3.104 N/A ARG 52.A NE.B GLN 157.A OE1 no hydrogen 3.283 N/A ARG 52.A NH1.A TYR 54.A OH no hydrogen 2.214 N/A ARG 52.A NH1.B SER 53.A O no hydrogen 2.893 N/A ARG 52.A NH1.B ASN 158.A OD1 no hydrogen 2.721 N/A SER 53.A N GLN 157.A OE1 no hydrogen 3.210 N/A SER 53.A OG TYR 253.A OH no hydrogen 2.546 N/A TYR 54.A N SER 26.A O.A no hydrogen 2.831 N/A TYR 54.A N SER 26.A O.B no hydrogen 2.837 N/A THR 55.A OG1 TYR 254.A OH no hydrogen 2.633 N/A ALA 56.A N THR 24.A O.A no hydrogen 2.848 N/A ALA 56.A N THR 24.A O.B no hydrogen 2.925 N/A CYS 57.A SG PRO 58.A O no hydrogen 3.783 N/A ALA 62.A N ASP 61.A OD1.B no hydrogen 3.214 N/A TRP 63.A N GLY 59.A O no hydrogen 3.233 N/A TRP 63.A NE1 SER 87.A OG no hydrogen 2.819 N/A LEU 64.A N ILE 60.A O no hydrogen 2.977 N/A GLU 65.A N ASP 61.A O.A no hydrogen 2.978 N/A GLU 65.A N ASP 61.A O.B no hydrogen 3.017 N/A ALA 66.A N ALA 62.A O no hydrogen 3.094 N/A PHE 67.A N TRP 63.A O no hydrogen 2.963 N/A PHE 67.A N LEU 64.A O no hydrogen 3.232 N/A GLY 68.A N LEU 64.A O no hydrogen 3.299 N/A GLY 68.A N GLU 65.A O no hydrogen 3.206 N/A ASP 70.A N PHE 67.A O no hydrogen 3.499 N/A ILE 73.A N LYS 102.A O no hydrogen 2.963 N/A PHE 74.A N ARG 2.A O no hydrogen 2.987 N/A VAL 75.A N ARG 104.A O no hydrogen 2.831 N/A VAL 76.A N VAL 4.A O no hydrogen 2.761 N/A THR 77.A N ILE 106.A O no hydrogen 2.891 N/A THR 77.A OG1 ILE 78.A O.A no hydrogen 3.102 N/A THR 77.A OG1 ILE 78.A O.B no hydrogen 3.015 N/A THR 77.A OG1 ILE 106.A O no hydrogen 3.539 N/A ILE 78.A N.A ASP 6.A OD2 no hydrogen 2.782 N/A ILE 78.A N.B ASP 6.A OD2 no hydrogen 2.788 N/A THR 79.A N SER 110.A O no hydrogen 2.871 N/A THR 79.A OG1 GLY 184.A O no hydrogen 2.609 N/A ALA 80.A N ASP 107.A OD1 no hydrogen 3.051 N/A GLY 81.A N THR 79.A OG1 no hydrogen 2.863 N/A SER 82.A OG THR 84.A OG1 no hydrogen 2.756 N/A THR 84.A N SER 82.A OG no hydrogen 3.042 N/A THR 84.A OG1 SER 82.A OG no hydrogen 2.756 N/A SER 87.A N GLY 83.A O no hydrogen 3.015 N/A SER 87.A OG THR 84.A O no hydrogen 2.690 N/A ALA 88.A N THR 84.A O no hydrogen 2.934 N/A ALA 90.A N SER 87.A O no hydrogen 2.966 N/A ARG 91.A N ALA 88.A O no hydrogen 2.871 N/A ARG 91.A NE VAL 103.A O no hydrogen 2.797 N/A VAL 93.A N ALA 89.A O no hydrogen 3.292 N/A TYR 94.A N ALA 90.A O no hydrogen 2.870 N/A TYR 94.A OH ASP 70.A O no hydrogen 2.701 N/A LEU 95.A N ARG 91.A O no hydrogen 2.887 N/A GLU 96.A N VAL 93.A O no hydrogen 3.015 N/A GLU 97.A N TYR 94.A O no hydrogen 2.887 N/A ALA 101.A N HIS 98.A O no hydrogen 3.109 N/A LYS 102.A N ASP 71.A O no hydrogen 2.806 N/A LYS 102.A NZ GLU 131.A OE2 no hydrogen 2.553 N/A ARG 104.A N ILE 73.A O no hydrogen 2.954 N/A ARG 104.A NE VAL 105.A O no hydrogen 2.920 N/A ARG 104.A NH1 ASP 138.A OD1 no hydrogen 2.826 N/A ARG 104.A NH1 ASP 138.A OD2 no hydrogen 3.520 N/A ARG 104.A NH2 ASP 134.A OD1 no hydrogen 2.735 N/A ARG 104.A NH2 ASP 138.A OD2 no hydrogen 2.823 N/A ILE 106.A N VAL 75.A O no hydrogen 2.662 N/A SER 108.A N THR 77.A O no hydrogen 3.066 N/A SER 108.A OG THR 77.A O no hydrogen 2.682 N/A LYS 109.A N ASP 107.A OD1 no hydrogen 2.900 N/A SER 110.A N SER 108.A OG no hydrogen 3.079 N/A SER 110.A OG GLN 114.A OE1 no hydrogen 2.663 N/A GLN 114.A N THR 111.A O no hydrogen 3.128 N/A GLN 114.A NE2 THR 143.A OG1 no hydrogen 2.721 N/A ARG 115.A NE GLU 119.A OE2 no hydrogen 2.853 N/A ILE 116.A N PRO 113.A O no hydrogen 2.934 N/A ILE 117.A N GLN 114.A O no hydrogen 3.003 N/A GLU 119.A N ARG 115.A O no hydrogen 2.883 N/A GLN 120.A N ILE 116.A O no hydrogen 3.025 N/A LEU 121.A N ILE 117.A O no hydrogen 2.952 N/A GLN 122.A N LEU 118.A O no hydrogen 2.947 N/A GLN 122.A NE2 ARG 15.A O no hydrogen 2.949 N/A GLN 122.A NE2 GLU 125.A OE2 no hydrogen 3.087 N/A GLN 123.A N GLU 119.A O no hydrogen 2.941 N/A GLN 123.A NE2 GLU 126.A OE2 no hydrogen 3.070 N/A GLU 125.A N GLN 122.A O no hydrogen 2.879 N/A GLU 126.A N GLN 123.A O no hydrogen 2.899 N/A GLY 127.A N ILE 124.A O no hydrogen 3.033 N/A LYS 128.A NZ GLU 126.A OE1 no hydrogen 2.991 N/A LYS 129.A N GLU 132.A OE1 no hydrogen 2.959 N/A LYS 129.A NZ GLU 131.A OE1 no hydrogen 3.360 N/A ILE 133.A N LYS 129.A O no hydrogen 2.994 N/A ASP 134.A N PHE 130.A O no hydrogen 2.809 N/A GLY 135.A N GLU 131.A O no hydrogen 3.220 N/A ALA 136.A N GLU 132.A O no hydrogen 3.044 N/A ILE 137.A N ILE 133.A O no hydrogen 2.970 N/A TYR 140.A N ALA 136.A O no hydrogen 3.062 N/A TYR 140.A OH GLU 265.A OE2 no hydrogen 2.508 N/A LYS 142.A N TYR 140.A O no hydrogen 2.948 N/A ARG 144.A N CYS 264.A O no hydrogen 2.983 N/A ARG 144.A NH2 THR 179.A OG1 no hydrogen 3.007 N/A PHE 146.A N LEU 262.A O no hydrogen 2.891 N/A CYS 147.A N GLY 178.A O no hydrogen 2.922 N/A SER 148.A N ILE 260.A O.A no hydrogen 3.027 N/A SER 148.A N ILE 260.A O.B no hydrogen 2.932 N/A LEU 149.A N VAL 176.A O no hydrogen 2.859 N/A SER 151.A OG GLU 256.A OE1 no hydrogen 2.956 N/A SER 151.A OG GLU 256.A OE2 no hydrogen 3.315 N/A HIS 153.A N SER 151.A OG no hydrogen 3.409 N/A ASN 154.A N GLU 256.A OE2 no hydrogen 2.847 N/A ASN 154.A ND2 TYR 253.A O no hydrogen 2.821 N/A ALA 156.A N LEU 152.A O no hydrogen 2.897 N/A GLN 157.A N HIS 153.A O no hydrogen 2.798 N/A GLN 157.A NE2 ASN 154.A OD1 no hydrogen 2.966 N/A ASN 158.A N ASN 154.A O no hydrogen 3.221 N/A ASN 158.A N LEU 155.A O no hydrogen 3.273 N/A ASN 158.A ND2 SER 53.A O no hydrogen 3.408 N/A ASN 158.A ND2 ASN 154.A O no hydrogen 2.909 N/A ASN 158.A ND2 TYR 253.A OH no hydrogen 3.065 N/A GLY 159.A N ALA 156.A O no hydrogen 3.057 N/A ARG 160.A N LEU 155.A O no hydrogen 2.810 N/A VAL 165.A N SER 162.A OG no hydrogen 3.243 N/A ALA 166.A N SER 162.A O no hydrogen 3.044 N/A SER 167.A N LYS 163.A O no hydrogen 2.837 N/A SER 167.A OG VAL 164.A O no hydrogen 2.733 N/A ALA 169.A N ALA 166.A O no hydrogen 3.136 N/A GLU 170.A N SER 167.A O no hydrogen 3.075 N/A VAL 171.A N ALA 168.A O no hydrogen 3.389 N/A ILE 174.A N VAL 171.A O no hydrogen 3.125 N/A SER 175.A N CYS 192.A O no hydrogen 2.923 N/A VAL 176.A N LEU 149.A O no hydrogen 2.889 N/A ILE 177.A N GLY 190.A O no hydrogen 2.734 N/A GLY 178.A N CYS 147.A O no hydrogen 2.933 N/A THR 179.A N GLU 187.A O no hydrogen 2.887 N/A THR 179.A OG1 LEU 145.A O no hydrogen 2.660 N/A ALA 180.A N LEU 145.A O no hydrogen 3.335 N/A SER 181.A N THR 185.A O no hydrogen 2.785 N/A SER 181.A OG THR 185.A O no hydrogen 3.354 N/A SER 181.A OG THR 185.A OG1 no hydrogen 2.801 N/A HIS 183.A N SER 181.A OG no hydrogen 2.999 N/A GLY 184.A N SER 181.A O no hydrogen 2.944 N/A THR 185.A N SER 181.A OG no hydrogen 3.030 N/A THR 185.A OG1 SER 181.A OG no hydrogen 2.801 N/A GLU 187.A N THR 179.A O no hydrogen 2.875 N/A ILE 189.A N ILE 177.A O no hydrogen 2.693 N/A GLY 190.A N ILE 177.A O no hydrogen 3.334 N/A CYS 192.A N SER 175.A O no hydrogen 2.776 N/A CYS 192.A SG GLY 194.A O no hydrogen 3.774 N/A ARG 193.A NH1 LEU 172.A O no hydrogen 3.009 N/A LYS 197.A NZ ARG 193.A O no hydrogen 3.321 N/A LEU 198.A N GLY 194.A O no hydrogen 3.151 N/A LEU 199.A N ASP 195.A O no hydrogen 2.965 N/A VAL 200.A N LYS 196.A O no hydrogen 3.225 N/A LYS 201.A N LYS 197.A O no hydrogen 3.008 N/A LEU 202.A N LEU 198.A O no hydrogen 2.840 N/A GLN 203.A N LEU 199.A O no hydrogen 3.028 N/A ALA 204.A N VAL 200.A O no hydrogen 3.116 N/A LEU 205.A N LYS 201.A O no hydrogen 2.947 N/A LEU 206.A N LEU 202.A O no hydrogen 2.794 N/A ASP 207.A N GLN 203.A O no hydrogen 2.995 N/A ASP 208.A N ALA 204.A O no hydrogen 3.028 N/A ALA 209.A N LEU 205.A O no hydrogen 2.836 N/A GLY 210.A N ASP 207.A O no hydrogen 3.184 N/A TYR 211.A N LEU 206.A O no hydrogen 3.003 N/A TYR 211.A OH GLY 214.A O no hydrogen 2.644 N/A TYR 211.A OH THR 239.A OG1 no hydrogen 2.749 N/A LYS 215.A N GLU 265.A OE1 no hydrogen 3.059 N/A LYS 215.A NZ GLU 119.A OE1 no hydrogen 2.860 N/A LEU 216.A N ASP 241.A O no hydrogen 2.974 N/A ARG 217.A N SER 263.A O no hydrogen 2.909 N/A ARG 217.A NE GLU 119.A OE2 no hydrogen 2.922 N/A ARG 217.A NH1 LEU 216.A O no hydrogen 2.918 N/A ARG 217.A NH1 ASP 241.A O no hydrogen 3.176 N/A ARG 217.A NH1 ASP 241.A OD1 no hydrogen 2.979 N/A ARG 217.A NH2 GLU 119.A OE1 no hydrogen 2.739 N/A ARG 217.A NH2 ASP 241.A OD1 no hydrogen 2.953 N/A ILE 218.A N CYS 243.A O no hydrogen 2.932 N/A CYS 219.A N ILE 261.A O no hydrogen 2.889 N/A CYS 219.A SG ASP 10.A OD2 no hydrogen 3.521 N/A HIS 220.A N TYR 245.A O no hydrogen 3.146 N/A VAL 221.A N GLY 259.A O no hydrogen 2.919 N/A ASN 223.A N HIS 220.A ND1 no hydrogen 3.038 N/A ASN 223.A ND2 GLY 258.A O no hydrogen 2.944 N/A LEU 226.A N ASN 223.A OD1 no hydrogen 3.230 N/A ALA 227.A N ASN 223.A O no hydrogen 3.176 N/A ASP 228.A N GLU 224.A O no hydrogen 2.874 N/A LYS 229.A N ALA 225.A O no hydrogen 3.078 N/A LYS 229.A NZ ASP 195.A OD2 no hydrogen 2.888 N/A ILE 230.A N LEU 226.A O no hydrogen 2.966 N/A ALA 231.A N ALA 227.A O no hydrogen 2.962 N/A ASP 232.A N ASP 228.A O no hydrogen 2.933 N/A LYS 234.A N ALA 231.A O no hydrogen 2.996 N/A GLN 235.A N ASP 232.A O no hydrogen 3.056 N/A TYR 237.A N ILE 233.A O no hydrogen 2.889 N/A TYR 237.A OH ASP 207.A OD1 no hydrogen 2.412 N/A GLY 238.A N LYS 234.A O no hydrogen 2.890 N/A THR 239.A OG1 TYR 211.A OH no hydrogen 2.749 N/A CYS 243.A N LEU 216.A O no hydrogen 3.162 N/A TYR 245.A N ILE 218.A O no hydrogen 2.920 N/A ALA 247.A N HIS 220.A O no hydrogen 2.910 N/A GLY 248.A N ASP 10.A OD1 no hydrogen 2.818 N/A GLY 249.A N ASP 34.A OD1 no hydrogen 2.799 N/A LEU 250.A N ASP 34.A OD2 no hydrogen 2.978 N/A CYS 251.A SG ALA 8.A O no hydrogen 3.265 N/A CYS 251.A SG THR 111.A OG1 no hydrogen 3.653 N/A SER 252.A N GLY 248.A O no hydrogen 2.884 N/A SER 252.A OG GLY 248.A O no hydrogen 2.705 N/A TYR 253.A N GLY 249.A O no hydrogen 2.902 N/A TYR 253.A OH SER 53.A OG no hydrogen 2.546 N/A TYR 254.A N LEU 250.A O no hydrogen 3.163 N/A TYR 254.A OH THR 55.A OG1 no hydrogen 2.633 N/A ALA 255.A N CYS 251.A O no hydrogen 2.801 N/A GLU 256.A N SER 252.A O no hydrogen 2.995 N/A ARG 257.A NE GLU 222.A OE1 no hydrogen 2.589 N/A ARG 257.A NH1 ASP 44.A OD1 no hydrogen 2.909 N/A ARG 257.A NH1 GLU 47.A OE1.A no hydrogen 2.677 N/A ARG 257.A NH2 HIS 41.A O no hydrogen 3.426 N/A ARG 257.A NH2 ASP 44.A OD1 no hydrogen 2.921 N/A ARG 257.A NH2 GLU 222.A OE1 no hydrogen 3.040 N/A GLY 258.A N VAL 221.A O no hydrogen 2.834 N/A GLY 259.A N GLU 256.A O no hydrogen 2.950 N/A ILE 260.A N.A SER 148.A O no hydrogen 3.014 N/A ILE 260.A N.B SER 148.A O no hydrogen 3.040 N/A ILE 261.A N CYS 219.A O no hydrogen 2.948 N/A LEU 262.A N PHE 146.A O no hydrogen 2.758 N/A SER 263.A N ARG 217.A O no hydrogen 2.857 N/A SER 263.A OG ARG 144.A O no hydrogen 2.770 N/A CYS 264.A N ARG 144.A O no hydrogen 3.027 N/A GLU 265.A N LYS 215.A O no hydrogen 3.084 N/A THR 266.A N LYS 142.A O no hydrogen 2.789 N/A THR 266.A OG1 LYS 267.A O no hydrogen 3.288 N/A LYS 267.A N GLY 210.A O no hydrogen 2.926 N/A