Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3i3s_R.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 2.A OG1 GLU 49.A OE2.B no hydrogen 3.565 N/A TYR 4.A N LEU 52.A O no hydrogen 2.862 N/A TYR 4.A OH GLU 49.A OE1.B no hydrogen 2.722 N/A LYS 5.A N GLU 76.A OE2 no hydrogen 2.906 N/A LYS 5.A NZ GLU 3.A OE2 no hydrogen 3.395 N/A LEU 6.A N ASP 54.A O no hydrogen 2.820 N/A VAL 7.A N GLY 77.A O no hydrogen 2.955 N/A VAL 8.A N LEU 56.A O no hydrogen 2.904 N/A VAL 9.A N LEU 79.A O no hydrogen 2.925 N/A VAL 14.A N ALA 11.A O no hydrogen 3.431 N/A LYS 16.A NZ GLY 10.A O no hydrogen 2.989 N/A LYS 16.A NZ ALA 11.A O no hydrogen 2.905 N/A SER 17.A OG THR 35.A OG1 no hydrogen 2.771 N/A SER 17.A OG ASP 57.A OD1 no hydrogen 3.400 N/A SER 17.A OG ASP 57.A OD2 no hydrogen 2.564 N/A LEU 19.A N GLY 15.A O no hydrogen 2.895 N/A THR 20.A N LYS 16.A O no hydrogen 3.119 N/A THR 20.A OG1 LYS 16.A O no hydrogen 2.980 N/A ILE 21.A N SER 17.A O no hydrogen 2.852 N/A GLN 22.A N ALA 18.A O no hydrogen 2.931 N/A GLN 22.A NE2 ALA 146.A O no hydrogen 2.829 N/A LEU 23.A N LEU 19.A O no hydrogen 3.009 N/A ILE 24.A N THR 20.A O no hydrogen 2.936 N/A GLN 25.A N ILE 21.A O no hydrogen 2.741 N/A ASN 26.A N GLN 22.A O no hydrogen 2.977 N/A HIS 27.A NE2 GLN 25.A OE1 no hydrogen 2.957 N/A THR 35.A OG1 SER 17.A OG no hydrogen 2.771 N/A ASP 38.A N ASP 57.A O no hydrogen 3.030 N/A TYR 40.A N ILE 55.A O no hydrogen 2.906 N/A ARG 41.A NH2 ASP 54.A OD2.A no hydrogen 3.268 N/A LYS 42.A N LEU 53.A O no hydrogen 2.993 N/A LYS 42.A NZ ILE 24.A O no hydrogen 2.970 N/A VAL 44.A N CYS 51.A O no hydrogen 2.870 N/A ILE 46.A N GLU 49.A O no hydrogen 2.941 N/A GLU 49.A N ILE 46.A O no hydrogen 3.141 N/A CYS 51.A N VAL 44.A O no hydrogen 2.788 N/A CYS 51.A SG GLU 49.A O no hydrogen 3.522 N/A CYS 51.A SG GLU 49.A OE1.B no hydrogen 3.506 N/A LEU 52.A N THR 2.A O no hydrogen 2.877 N/A LEU 53.A N LYS 42.A O no hydrogen 2.900 N/A ASP 54.A N TYR 4.A O no hydrogen 2.940 N/A ILE 55.A N TYR 40.A O no hydrogen 2.786 N/A LEU 56.A N LEU 6.A O no hydrogen 2.843 N/A ASP 57.A N ASP 38.A O no hydrogen 2.782 N/A THR 58.A N VAL 8.A O no hydrogen 3.386 N/A THR 58.A OG1 VAL 8.A O no hydrogen 2.715 N/A ALA 59.A N GLU 37.A OE2.A no hydrogen 3.416 N/A GLN 61.A NE2 TYR 32.A OH.B no hydrogen 3.188 N/A GLU 62.A N GLU 62.A OE1 no hydrogen 2.655 N/A TYR 64.A N GLN 61.A O no hydrogen 2.973 N/A SER 65.A N GLU 62.A O no hydrogen 3.123 N/A SER 65.A OG GLU 62.A O no hydrogen 2.664 N/A ARG 68.A N SER 65.A O no hydrogen 3.324 N/A ARG 68.A NE GLN 99.A OE1 no hydrogen 3.158 N/A ARG 68.A NH1 ALA 59.A O no hydrogen 2.871 N/A ARG 68.A NH2 GLN 99.A OE1 no hydrogen 3.124 N/A GLN 70.A N MET 67.A O no hydrogen 3.211 N/A TYR 71.A N MET 67.A O no hydrogen 3.482 N/A MET 72.A N ARG 68.A O no hydrogen 3.097 N/A ARG 73.A N GLN 70.A O no hydrogen 3.289 N/A GLY 75.A N MET 72.A O no hydrogen 2.885 N/A GLU 76.A N LYS 5.A O no hydrogen 2.835 N/A GLY 77.A N LYS 5.A O no hydrogen 3.277 N/A PHE 78.A N PRO 110.A O no hydrogen 3.020 N/A LEU 79.A N VAL 7.A O no hydrogen 2.853 N/A CYS 80.A N VAL 112.A O no hydrogen 2.935 N/A VAL 81.A N VAL 9.A O no hydrogen 2.883 N/A PHE 82.A N VAL 114.A O no hydrogen 2.951 N/A ALA 83.A N SER 89.A OG no hydrogen 3.016 N/A ILE 84.A N ASN 116.A O no hydrogen 2.954 N/A ASN 86.A N ALA 83.A O no hydrogen 3.009 N/A THR 87.A OG1 THR 124.A OG1 no hydrogen 2.844 N/A LYS 88.A NZ ASP 92.A OD1 no hydrogen 3.357 N/A SER 89.A OG ASN 86.A O no hydrogen 2.734 N/A PHE 90.A N ASN 86.A O no hydrogen 3.398 N/A GLU 91.A N THR 87.A O no hydrogen 2.971 N/A ASP 92.A N LYS 88.A O no hydrogen 2.874 N/A ILE 93.A N PHE 90.A O no hydrogen 3.124 N/A HIS 94.A ND1.A GLU 98.A OE2 no hydrogen 2.777 N/A GLN 95.A N ASP 92.A O no hydrogen 2.946 N/A TYR 96.A N ILE 93.A O no hydrogen 2.942 N/A ARG 97.A N ILE 93.A O no hydrogen 2.997 N/A GLU 98.A N HIS 94.A O.A no hydrogen 2.876 N/A GLU 98.A N HIS 94.A O.B no hydrogen 3.015 N/A GLN 99.A N GLN 95.A O no hydrogen 2.999 N/A GLN 99.A NE2 ASP 69.A OD1 no hydrogen 2.335 N/A ILE 100.A N TYR 96.A O no hydrogen 2.957 N/A LYS 101.A N ARG 97.A O no hydrogen 3.048 N/A ARG 102.A N.A GLU 98.A O no hydrogen 3.013 N/A ARG 102.A N.B GLU 98.A O no hydrogen 3.013 N/A VAL 103.A N GLN 99.A O no hydrogen 2.898 N/A LYS 104.A N ILE 100.A O no hydrogen 2.928 N/A LYS 104.A NZ ARG 73.A O no hydrogen 2.863 N/A LYS 104.A NZ GLY 75.A O no hydrogen 2.699 N/A ASP 105.A N ARG 102.A O.B no hydrogen 3.229 N/A SER 106.A N LYS 101.A O no hydrogen 3.262 N/A ASP 108.A N SER 106.A OG no hydrogen 2.996 N/A VAL 112.A N PHE 78.A O no hydrogen 3.088 N/A LEU 113.A N PRO 140.A O no hydrogen 2.949 N/A VAL 114.A N CYS 80.A O no hydrogen 2.885 N/A GLY 115.A N ILE 142.A O no hydrogen 3.057 N/A ASN 116.A N PHE 82.A O no hydrogen 2.837 N/A ASN 116.A ND2 VAL 14.A O no hydrogen 2.872 N/A LYS 117.A NZ GLY 13.A O no hydrogen 2.854 N/A CYS 118.A N THR 144.A O no hydrogen 2.985 N/A CYS 118.A SG.A GLN 150.A OE1.A no hydrogen 3.467 N/A CYS 118.A SG.B GLY 115.A O no hydrogen 3.171 N/A CYS 118.A SG.B GLU 143.A OE1 no hydrogen 3.107 N/A CYS 118.A SG.B THR 144.A O no hydrogen 3.816 N/A LEU 120.A N LYS 117.A O no hydrogen 3.000 N/A ARG 123.A NH1 VAL 125.A O no hydrogen 3.036 N/A ARG 123.A NH1 GLU 143.A OE2 no hydrogen 2.883 N/A ARG 123.A NH2 GLU 143.A OE1 no hydrogen 2.818 N/A ARG 123.A NH2 GLU 143.A OE2 no hydrogen 3.533 N/A THR 124.A N ILE 84.A O no hydrogen 2.859 N/A THR 124.A OG1 THR 87.A OG1 no hydrogen 2.844 N/A VAL 125.A N ILE 84.A O no hydrogen 3.067 N/A GLU 126.A N GLN 129.A OE1.B no hydrogen 2.798 N/A ARG 128.A NE ASP 132.A OD2 no hydrogen 3.138 N/A ALA 130.A N GLU 126.A O no hydrogen 3.373 N/A GLN 131.A N SER 127.A O no hydrogen 2.855 N/A GLN 131.A NE2.A SER 127.A OG no hydrogen 2.760 N/A GLN 131.A NE2.B SER 127.A OG no hydrogen 3.110 N/A ASP 132.A N ARG 128.A O no hydrogen 3.033 N/A LEU 133.A N GLN 129.A O no hydrogen 3.214 N/A ALA 134.A N ALA 130.A O no hydrogen 2.930 N/A ARG 135.A N GLN 131.A O no hydrogen 2.864 N/A ARG 135.A NH1.B ASP 132.A OD2 no hydrogen 2.870 N/A ARG 135.A NH2.B ASP 132.A OD2 no hydrogen 2.879 N/A SER 136.A N ASP 132.A O no hydrogen 3.184 N/A SER 136.A OG LEU 133.A O no hydrogen 2.681 N/A TYR 137.A N LEU 133.A O no hydrogen 3.238 N/A TYR 137.A N ALA 134.A O no hydrogen 3.051 N/A GLY 138.A N ARG 135.A O no hydrogen 3.089 N/A ILE 139.A N ALA 134.A O no hydrogen 3.047 N/A TYR 141.A OH GLU 143.A OE2 no hydrogen 2.643 N/A ILE 142.A N LEU 113.A O no hydrogen 2.978 N/A THR 144.A N GLY 115.A O no hydrogen 2.921 N/A THR 144.A OG1 ASN 116.A OD1 no hydrogen 2.768 N/A SER 145.A N GLN 150.A O no hydrogen 2.856 N/A SER 145.A OG ASP 119.A OD1 no hydrogen 2.713 N/A SER 145.A OG THR 148.A OG1 no hydrogen 3.380 N/A THR 148.A N SER 145.A OG no hydrogen 3.035 N/A ARG 149.A N SER 145.A O no hydrogen 2.859 N/A ARG 149.A NH2 GLN 22.A O no hydrogen 3.040 N/A ARG 149.A NH2 GLN 22.A OE1 no hydrogen 3.010 N/A GLN 150.A N THR 148.A OG1 no hydrogen 3.187 N/A VAL 152.A N ARG 149.A O no hydrogen 3.172 N/A ALA 155.A N GLY 151.A O no hydrogen 2.845 N/A PHE 156.A N VAL 152.A O no hydrogen 3.282 N/A TYR 157.A N.A GLU 153.A O no hydrogen 2.813 N/A TYR 157.A N.B GLU 153.A O no hydrogen 2.803 N/A THR 158.A N.A ASP 154.A O no hydrogen 2.767 N/A THR 158.A N.B ASP 154.A O no hydrogen 3.007 N/A THR 158.A OG1.A ASP 154.A O no hydrogen 2.828 N/A THR 158.A OG1.A ASP 154.A OD1.A no hydrogen 3.059 N/A THR 158.A OG1.B ASP 154.A O no hydrogen 2.524 N/A THR 158.A OG1.B ASP 154.A OD1.A no hydrogen 2.979 N/A LEU 159.A N.A ALA 155.A O no hydrogen 3.031 N/A LEU 159.A N.B ALA 155.A O no hydrogen 3.186 N/A LEU 159.A N.B PHE 156.A O no hydrogen 3.137 N/A VAL 160.A N.A PHE 156.A O no hydrogen 2.999 N/A VAL 160.A N.B TYR 157.A O.A no hydrogen 3.048 N/A VAL 160.A N.B TYR 157.A O.B no hydrogen 2.884 N/A ARG 161.A N.A TYR 157.A O.A no hydrogen 3.103 N/A ARG 161.A N.A TYR 157.A O.B no hydrogen 3.063 N/A ARG 161.A N.B TYR 157.A O.A no hydrogen 2.923 N/A ARG 161.A N.B TYR 157.A O.B no hydrogen 3.066 N/A ARG 161.A NE.A ASP 47.A OD2.A no hydrogen 1.708 N/A ARG 161.A NE.A ASP 47.A OD2.B no hydrogen 2.753 N/A ARG 161.A NE.B ASP 47.A OD2.A no hydrogen 2.813 N/A ARG 161.A NH2.A ASP 47.A OD1.A no hydrogen 1.908 N/A ARG 161.A NH2.A ASP 47.A OD1.B no hydrogen 2.848 N/A ARG 161.A NH2.A ASP 47.A OD2.B no hydrogen 3.554 N/A ARG 161.A NH2.B ASP 47.A OD1.A no hydrogen 2.950 N/A ARG 161.A NH2.B ASP 47.A OD2.A no hydrogen 3.355 N/A GLU 162.A N.A THR 158.A O.A no hydrogen 2.731 N/A GLU 162.A N.A THR 158.A O.B no hydrogen 2.898 N/A GLU 162.A N.B THR 158.A O.A no hydrogen 2.969 N/A GLU 162.A N.B LEU 159.A O.A no hydrogen 2.781 N/A ILE 163.A N.A LEU 159.A O.A no hydrogen 3.005 N/A ILE 163.A N.A LEU 159.A O.B no hydrogen 3.389 N/A ILE 163.A N.B LEU 159.A O.A no hydrogen 2.862 N/A ILE 163.A N.B LEU 159.A O.B no hydrogen 3.048 N/A ARG 164.A N.A VAL 160.A O.B no hydrogen 2.918 N/A ARG 164.A N.B VAL 160.A O.A no hydrogen 2.823 N/A ARG 164.A N.B VAL 160.A O.B no hydrogen 2.865 N/A ARG 164.A NE.B TYR 4.A OH no hydrogen 3.278 N/A ARG 164.A NH1.A ASP 47.A OD2.A no hydrogen 3.398 N/A ARG 164.A NH1.A ASP 47.A OD2.B no hydrogen 2.607 N/A ARG 164.A NH1.B ASP 47.A OD2.A no hydrogen 2.834 N/A ARG 164.A NH2.A ASP 47.A OD2.B no hydrogen 3.103 N/A ARG 164.A NH2.B ILE 46.A O no hydrogen 3.084 N/A ARG 164.A NH2.B GLU 49.A OE1.B no hydrogen 3.006 N/A GLN 165.A N.A GLU 162.A O.A no hydrogen 3.054 N/A GLN 165.A N.A GLU 162.A O.B no hydrogen 3.208 N/A GLN 165.A NE2.A ARG 161.A O.A no hydrogen 3.606 N/A GLN 165.A NE2.A ARG 161.A O.B no hydrogen 2.993 N/A HIS 166.A N.A ILE 163.A O.A no hydrogen 3.140 N/A HIS 166.A N.B GLU 162.A O.B no hydrogen 3.137 N/A HIS 166.A N.B ILE 163.A O.A no hydrogen 2.018 N/A HIS 166.A N.B ILE 163.A O.B no hydrogen 3.249 N/A HIS 166.A ND1.A GLU 162.A O.A no hydrogen 2.569 N/A HIS 166.A ND1.A GLU 162.A O.B no hydrogen 2.826 N/A HIS 166.A NE2.B ASP 108.A O no hydrogen 3.167 N/A