Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4itc_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 2.A N ASP 70.A O no hydrogen 2.759 N/A LEU 4.A N ILE 166.A O no hydrogen 2.943 N/A GLU 6.A N VAL 164.A O no hydrogen 2.856 N/A SER 7.A OG GLU 163.A OE1 no hydrogen 3.468 N/A SER 7.A OG GLU 163.A OE2 no hydrogen 2.680 N/A PHE 8.A N GLU 6.A OE2 no hydrogen 2.766 N/A TRP 16.A N PRO 13.A O no hydrogen 2.956 N/A LYS 17.A N ILE 65.A O no hydrogen 2.907 N/A LYS 17.A NZ ASN 102.A O no hydrogen 2.950 N/A LYS 17.A NZ ASP 103.A OD1 no hydrogen 2.944 N/A ILE 19.A N TYR 63.A O no hydrogen 2.967 N/A ALA 21.A N ASP 61.A O no hydrogen 2.856 N/A GLY 23.A N ASP 20.A O no hydrogen 3.197 N/A GLY 23.A N ASP 20.A OD1 no hydrogen 3.220 N/A ASP 24.A N ASP 22.A OD2 no hydrogen 3.219 N/A GLY 25.A N ASP 20.A OD2 no hydrogen 2.800 N/A HIS 26.A N ASP 24.A OD1 no hydrogen 2.912 N/A TRP 28.A NE1 ASN 62.A O no hydrogen 2.982 N/A LYS 29.A N TYR 46.A O no hydrogen 2.824 N/A LYS 29.A NZ GLU 48.A OE2 no hydrogen 2.690 N/A GLY 31.A N CYS 44.A O no hydrogen 2.865 N/A ASN 32.A ND2 ALA 33.A O no hydrogen 3.108 N/A ALA 33.A N ASN 42.A O.A no hydrogen 2.793 N/A ALA 33.A N ASN 42.A O.B no hydrogen 2.969 N/A ILE 36.A N ASN 32.A O no hydrogen 2.839 N/A GLY 38.A N ASN 42.A O.B no hydrogen 3.088 N/A TYR 39.A N ASP 162.A OD2 no hydrogen 2.769 N/A SER 41.A OG GLU 9.A OE2 no hydrogen 2.985 N/A SER 41.A OG TYR 39.A O no hydrogen 2.820 N/A SER 41.A OG GLU 163.A OE1 no hydrogen 3.199 N/A ASN 42.A N.A GLU 9.A OE1 no hydrogen 3.122 N/A GLY 43.A N GLU 9.A OE1 no hydrogen 3.027 N/A CYS 44.A N GLY 31.A O no hydrogen 2.871 N/A CYS 44.A SG ILE 36.A O no hydrogen 3.613 N/A CYS 44.A SG ALA 37.A O no hydrogen 3.954 N/A CYS 44.A SG VAL 45.A O no hydrogen 3.880 N/A VAL 45.A N LEU 161.A O.A no hydrogen 2.973 N/A VAL 45.A N LEU 161.A O.B no hydrogen 3.050 N/A TYR 46.A N LYS 29.A O no hydrogen 2.884 N/A SER 47.A N ILE 159.A O no hydrogen 2.932 N/A SER 47.A OG HIS 150.A ND1 no hydrogen 2.701 N/A SER 49.A N PHE 157.A O no hydrogen 2.792 N/A SER 49.A OG GLU 91.A OE1 no hydrogen 3.262 N/A SER 49.A OG GLU 91.A OE2 no hydrogen 2.643 N/A SER 49.A OG PHE 157.A O no hydrogen 3.485 N/A GLY 51.A N GLY 56.A O no hydrogen 2.870 N/A ILE 55.A N LEU 52.A O no hydrogen 3.368 N/A GLY 56.A N GLY 51.A O no hydrogen 3.018 N/A LEU 58.A N SER 49.A O no hydrogen 3.003 N/A ASP 61.A N ASP 22.A OD1 no hydrogen 2.808 N/A ASN 62.A N HIS 150.A O no hydrogen 2.942 N/A ASN 62.A ND2 SER 47.A OG no hydrogen 2.817 N/A TYR 63.A N ILE 19.A O no hydrogen 2.845 N/A LEU 64.A N PHE 148.A O no hydrogen 2.876 N/A ILE 65.A N LYS 17.A O no hydrogen 2.788 N/A THR 66.A N VAL 146.A O no hydrogen 2.956 N/A THR 66.A OG1 PRO 67.A O no hydrogen 2.851 N/A LEU 69.A N LYS 144.A O.A no hydrogen 2.681 N/A LEU 69.A N LYS 144.A O.B no hydrogen 2.827 N/A ASP 70.A N THR 2.A OG1 no hydrogen 2.809 N/A GLY 74.A N LEU 71.A O no hydrogen 3.026 N/A GLY 75.A N LEU 139.A O no hydrogen 3.210 N/A LYS 76.A N LYS 167.A O no hydrogen 2.839 N/A LEU 77.A N VAL 137.A O no hydrogen 2.870 N/A THR 78.A N GLU 165.A O no hydrogen 2.868 N/A PHE 79.A N LYS 135.A O no hydrogen 3.121 N/A TRP 80.A N ASP 162.A O no hydrogen 2.935 N/A VAL 81.A N ARG 133.A O no hydrogen 2.909 N/A CYS 82.A N.A ASP 160.A O no hydrogen 3.027 N/A CYS 82.A N.B ASP 160.A O no hydrogen 3.034 N/A CYS 82.A SG.A ASP 160.A OD2 no hydrogen 3.411 N/A CYS 82.A SG.B ALA 83.A O no hydrogen 3.251 N/A CYS 82.A SG.B GLY 130.A O no hydrogen 2.392 N/A GLN 84.A N TYR 158.A O no hydrogen 3.070 N/A GLN 84.A NE2 GLY 35.A O no hydrogen 3.154 N/A ALA 86.A N ILE 128.A O no hydrogen 2.852 N/A ASN 87.A N ASP 85.A OD1 no hydrogen 2.888 N/A TYR 88.A N ASP 85.A O no hydrogen 2.931 N/A GLU 91.A N ALA 89.A O no hydrogen 2.848 N/A HIS 92.A N SER 153.A OG.A no hydrogen 2.856 N/A HIS 92.A N SER 153.A OG.B no hydrogen 2.946 N/A HIS 92.A ND1 THR 115.A OG1 no hydrogen 2.772 N/A HIS 92.A NE2 GLU 113.A OE2 no hydrogen 2.697 N/A TYR 93.A N GLU 114.A O no hydrogen 2.996 N/A TYR 93.A OH GLU 114.A OE1 no hydrogen 2.822 N/A ALA 94.A N ARG 149.A O no hydrogen 2.953 N/A VAL 95.A N LEU 112.A O no hydrogen 2.890 N/A TYR 96.A N ALA 147.A O no hydrogen 2.907 N/A ALA 97.A N ASN 109.A O no hydrogen 3.254 N/A SER 98.A N TYR 145.A O no hydrogen 2.877 N/A SER 98.A OG THR 100.A OG1 no hydrogen 3.403 N/A SER 98.A OG GLY 101.A O no hydrogen 2.730 N/A SER 99.A OG.B GLY 142.A O no hydrogen 2.851 N/A THR 100.A N SER 98.A OG no hydrogen 3.011 N/A THR 100.A OG1 SER 98.A OG no hydrogen 3.403 N/A ASP 103.A N ASN 106.A OD1 no hydrogen 2.971 N/A ASN 106.A N ASP 103.A O no hydrogen 2.963 N/A PHE 107.A N ALA 104.A O no hydrogen 3.110 N/A LEU 111.A N VAL 95.A O no hydrogen 2.741 N/A LEU 112.A N VAL 95.A O no hydrogen 3.461 N/A GLU 114.A N TYR 93.A O no hydrogen 3.025 N/A THR 115.A OG1 HIS 92.A ND1 no hydrogen 2.772 N/A ILE 116.A N GLU 91.A O no hydrogen 2.818 N/A GLY 130.A N ALA 83.A O no hydrogen 2.832 N/A ARG 133.A N VAL 81.A O no hydrogen 2.951 N/A LYS 135.A N PHE 79.A O no hydrogen 2.824 N/A LYS 135.A NZ GLU 114.A OE1 no hydrogen 2.868 N/A LYS 135.A NZ GLU 114.A OE2 no hydrogen 3.524 N/A VAL 137.A N LEU 77.A O no hydrogen 2.791 N/A LEU 139.A N GLY 75.A O no hydrogen 2.821 N/A GLY 142.A N LEU 71.A O no hydrogen 2.896 N/A THR 143.A N PRO 140.A O no hydrogen 3.166 N/A THR 143.A OG1 PRO 140.A O no hydrogen 2.690 N/A LYS 144.A N.A SER 98.A O no hydrogen 2.802 N/A LYS 144.A N.B SER 98.A O no hydrogen 2.782 N/A LYS 144.A NZ.A TYR 145.A OH no hydrogen 3.434 N/A TYR 145.A N SER 98.A O no hydrogen 3.078 N/A VAL 146.A N THR 66.A OG1 no hydrogen 3.115 N/A ALA 147.A N TYR 96.A O no hydrogen 2.915 N/A PHE 148.A N LEU 64.A O no hydrogen 2.816 N/A ARG 149.A N ALA 94.A O no hydrogen 2.866 N/A ARG 149.A NE ASP 61.A OD1 no hydrogen 2.822 N/A ARG 149.A NH1 TYR 96.A OH no hydrogen 3.002 N/A ARG 149.A NH2 ASP 61.A OD1 no hydrogen 3.288 N/A ARG 149.A NH2 ASP 61.A OD2 no hydrogen 3.151 N/A HIS 150.A N ASN 62.A O no hydrogen 2.840 N/A HIS 150.A ND1 SER 47.A OG no hydrogen 2.701 N/A HIS 150.A NE2 GLU 91.A OE1 no hydrogen 2.777 N/A PHE 151.A N HIS 92.A O no hydrogen 3.363 N/A SER 153.A OG.A HIS 92.A O no hydrogen 3.001 N/A SER 153.A OG.A PHE 151.A O no hydrogen 2.943 N/A SER 153.A OG.B GLU 91.A OE1 no hydrogen 2.660 N/A THR 154.A OG1 LEU 58.A O no hydrogen 2.777 N/A ASP 155.A N SER 49.A O no hydrogen 3.031 N/A MET 156.A N SER 49.A OG no hydrogen 2.897 N/A PHE 157.A N GLU 91.A OE2 no hydrogen 2.853 N/A ILE 159.A N SER 47.A O no hydrogen 2.959 N/A ASP 160.A N CYS 82.A O.A no hydrogen 2.888 N/A ASP 160.A N CYS 82.A O.B no hydrogen 2.820 N/A LEU 161.A N.A VAL 45.A O no hydrogen 2.849 N/A LEU 161.A N.B VAL 45.A O no hydrogen 2.874 N/A ASP 162.A N TRP 80.A O no hydrogen 2.905 N/A GLU 163.A N ASP 162.A OD1 no hydrogen 2.865 N/A VAL 164.A N GLU 6.A O no hydrogen 2.989 N/A GLU 165.A N THR 78.A O no hydrogen 2.921 N/A ILE 166.A N LEU 4.A O no hydrogen 2.840 N/A LYS 167.A N LYS 76.A O no hydrogen 2.856 N/A ASN 169.A N GLY 74.A O no hydrogen 2.970 N/A ASN 169.A ND2 ASN 73.A O.A no hydrogen 2.871 N/A ASN 169.A ND2 ASN 73.A O.B no hydrogen 2.907 N/A