Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4e41_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 3.A NH1 ARG 1.A O no hydrogen 3.162 N/A GLN 7.A N ILE 28.A O no hydrogen 2.634 N/A LYS 9.A N ARG 26.A O no hydrogen 2.890 N/A GLU 11.A N LEU 24.A O no hydrogen 2.643 N/A HIS 13.A N ARG 22.A O no hydrogen 2.872 N/A HIS 13.A NE2 GLU 11.A OE1 no hydrogen 2.766 N/A PHE 15.A N ARG 20.A O no hydrogen 2.882 N/A ASN 16.A ND2 GLU 19.A OE1 no hydrogen 3.124 N/A GLU 19.A N ASN 16.A O no hydrogen 3.207 N/A ARG 20.A N PHE 15.A O no hydrogen 3.314 N/A ARG 22.A N HIS 13.A O no hydrogen 3.016 N/A ARG 22.A NE ASP 38.A OD1 no hydrogen 2.802 N/A ARG 22.A NH2 ASP 38.A OD2 no hydrogen 2.507 N/A LEU 23.A N SER 39.A OG no hydrogen 2.761 N/A LEU 24.A N GLU 11.A O no hydrogen 2.852 N/A GLU 25.A N PHE 37.A O no hydrogen 2.852 N/A ARG 26.A N LYS 9.A O no hydrogen 2.759 N/A ARG 26.A NE GLU 11.A OE2 no hydrogen 2.929 N/A ARG 26.A NH1 GLU 33.A OE2 no hydrogen 3.234 N/A ARG 26.A NH2 GLU 11.A OE2 no hydrogen 3.099 N/A CYS 27.A N VAL 35.A O no hydrogen 3.021 N/A ILE 28.A N GLN 7.A O no hydrogen 2.784 N/A TYR 29.A N GLU 32.A O no hydrogen 2.966 N/A ASN 30.A N LEU 5.A O no hydrogen 2.866 N/A GLU 32.A N TYR 29.A O no hydrogen 2.804 N/A SER 34.A N CYS 27.A O no hydrogen 2.924 N/A SER 34.A OG CYS 27.A O no hydrogen 3.456 N/A ARG 36.A N ARG 45.A O no hydrogen 3.156 N/A ARG 36.A NE GLU 33.A OE2 no hydrogen 3.236 N/A ARG 36.A NH2 GLU 33.A OE2 no hydrogen 3.287 N/A PHE 37.A N GLU 25.A O no hydrogen 2.829 N/A SER 39.A N LEU 23.A O no hydrogen 2.867 N/A ASP 40.A N ASP 38.A OD1 no hydrogen 2.924 N/A VAL 41.A N ASP 38.A O no hydrogen 2.801 N/A GLY 42.A N ASP 38.A O no hydrogen 2.878 N/A TYR 44.A N ASN 59.A OD1 no hydrogen 2.821 N/A TYR 44.A OH GLU 25.A OE1 no hydrogen 2.565 N/A TYR 44.A OH GLU 25.A OE2 no hydrogen 2.652 N/A ARG 45.A N ARG 36.A O no hydrogen 2.868 N/A VAL 47.A N SER 34.A O no hydrogen 2.769 N/A THR 48.A N SER 34.A O no hydrogen 3.324 N/A THR 48.A OG1 GLU 32.A OE1 no hydrogen 3.151 N/A GLY 51.A N THR 48.A O no hydrogen 3.001 N/A ARG 52.A N GLU 49.A O no hydrogen 3.105 N/A ARG 52.A NE GLU 49.A OE1 no hydrogen 2.775 N/A ALA 55.A N GLY 51.A O no hydrogen 3.099 N/A GLU 56.A N ARG 52.A O no hydrogen 3.201 N/A TYR 57.A N PRO 53.A O no hydrogen 2.989 N/A TRP 58.A N ASP 54.A O no hydrogen 3.002 N/A ASN 59.A N ALA 55.A O no hydrogen 2.988 N/A ASN 59.A ND2 TYR 44.A O no hydrogen 2.771 N/A SER 60.A N TYR 57.A O no hydrogen 3.099 N/A SER 60.A OG TYR 57.A O no hydrogen 2.562 N/A GLN 61.A N TRP 58.A O no hydrogen 3.198 N/A LEU 65.A N GLN 61.A O no hydrogen 3.372 N/A GLU 66.A N LYS 62.A O no hydrogen 3.034 N/A GLN 67.A N ASP 63.A O no hydrogen 2.941 N/A ARG 68.A N LEU 64.A O no hydrogen 2.940 N/A ARG 68.A NE GLU 25.A OE1 no hydrogen 2.698 N/A ARG 68.A NH2 GLU 25.A OE1 no hydrogen 3.519 N/A ARG 68.A NH2 GLU 25.A OE2 no hydrogen 3.287 N/A ARG 69.A N LEU 65.A O no hydrogen 2.793 N/A ARG 69.A NE GLY 42.A O no hydrogen 2.858 N/A ARG 69.A NH2 GLY 42.A O no hydrogen 3.004 N/A ALA 70.A N GLN 67.A O no hydrogen 3.197 N/A ALA 71.A N ARG 68.A O no hydrogen 3.073 N/A ASP 73.A N ALA 70.A O no hydrogen 2.972 N/A THR 74.A N ALA 70.A O no hydrogen 2.910 N/A THR 74.A OG1 ALA 70.A O no hydrogen 3.237 N/A TYR 75.A N ALA 71.A O no hydrogen 2.709 N/A CYS 76.A N ALA 71.A O no hydrogen 2.878 N/A ARG 77.A N VAL 72.A O no hydrogen 3.298 N/A ARG 77.A NE THR 18.A O no hydrogen 2.840 N/A ARG 77.A NH1 VAL 72.A O no hydrogen 3.500 N/A ARG 77.A NH2 THR 18.A O no hydrogen 2.758 N/A ASN 79.A N TYR 75.A O no hydrogen 2.906 N/A TYR 80.A N CYS 76.A O no hydrogen 3.063 N/A GLY 81.A N ARG 77.A O no hydrogen 3.199 N/A VAL 82.A N HIS 78.A O no hydrogen 3.033 N/A GLY 83.A N ASN 79.A O no hydrogen 2.877 N/A GLU 84.A N GLY 81.A O no hydrogen 3.505 N/A PHE 86.A N GLY 83.A O no hydrogen 3.387 N/A THR 87.A N GLY 83.A O no hydrogen 2.988 N/A THR 87.A N GLU 84.A O no hydrogen 3.329 N/A THR 87.A OG1 GLY 83.A O no hydrogen 2.636 N/A GLN 89.A N GLU 84.A O no hydrogen 3.061 N/A GLN 89.A NE2 GLU 84.A OE2 no hydrogen 2.486 N/A ARG 90.A N THR 87.A O no hydrogen 3.160 N/A ARG 90.A NE TRP 142.A O no hydrogen 3.420 N/A ARG 90.A NH2 TRP 142.A O no hydrogen 2.907 N/A ARG 91.A NH1 VAL 88.A O no hydrogen 2.979 N/A ARG 91.A NH1 ARG 90.A O no hydrogen 2.596 N/A ARG 91.A NH2 VAL 88.A O no hydrogen 3.334 N/A VAL 92.A N TYR 112.A O no hydrogen 2.738 N/A LYS 95.A N SER 109.A O no hydrogen 2.780 N/A THR 97.A N SER 107.A O no hydrogen 3.062 N/A TYR 99.A N VAL 105.A O no hydrogen 2.902 N/A SER 101.A N LEU 103.A O no hydrogen 2.763 N/A LEU 104.A N LEU 150.A O no hydrogen 2.938 N/A VAL 105.A N TYR 99.A O no hydrogen 2.696 N/A CYS 106.A N VAL 148.A O no hydrogen 2.805 N/A CYS 106.A SG THR 97.A O no hydrogen 4.002 N/A SER 107.A N THR 97.A O no hydrogen 2.816 N/A VAL 108.A N THR 146.A O no hydrogen 2.919 N/A SER 109.A N LYS 95.A O no hydrogen 3.125 N/A PHE 111.A N PHE 144.A O no hydrogen 3.144 N/A TYR 112.A N VAL 92.A O no hydrogen 3.102 N/A GLU 117.A N GLU 165.A O no hydrogen 3.022 N/A ARG 119.A N GLN 163.A O no hydrogen 2.677 N/A PHE 121.A N THR 161.A O no hydrogen 2.870 N/A ARG 122.A N GLN 125.A O no hydrogen 2.926 N/A ARG 122.A NE TYR 160.A OH no hydrogen 3.046 N/A ASN 123.A N VAL 159.A O no hydrogen 2.882 N/A GLN 125.A N ARG 122.A O no hydrogen 3.356 N/A GLN 125.A NE2 ASN 123.A O no hydrogen 3.295 N/A GLU 127.A N TRP 120.A O no hydrogen 3.254 N/A GLU 127.A N GLU 126.A OE1 no hydrogen 3.304 N/A VAL 132.A N MET 149.A O no hydrogen 2.680 N/A THR 134.A N LEU 147.A O no hydrogen 3.217 N/A THR 134.A OG1 GLY 135.A O no hydrogen 2.562 N/A GLY 135.A N SER 133.A OG no hydrogen 3.052 N/A ILE 137.A N GLN 145.A O no hydrogen 2.877 N/A ASN 139.A N THR 143.A O no hydrogen 3.066 N/A ASN 139.A ND2 GLN 145.A OE1 no hydrogen 2.933 N/A THR 143.A OG1 ASN 139.A OD1 no hydrogen 3.052 N/A THR 143.A OG1 ASP 141.A OD1 no hydrogen 2.792 N/A PHE 144.A N PHE 111.A O no hydrogen 2.760 N/A GLN 145.A N ILE 137.A O no hydrogen 2.958 N/A THR 146.A N VAL 108.A O no hydrogen 2.832 N/A THR 146.A OG1 GLY 135.A O no hydrogen 3.063 N/A VAL 148.A N CYS 106.A O no hydrogen 2.919 N/A MET 149.A N VAL 132.A O no hydrogen 2.540 N/A LEU 150.A N LEU 104.A O no hydrogen 2.890 N/A GLU 151.A N GLY 130.A O no hydrogen 3.005 N/A ARG 155.A N GLU 158.A OE2 no hydrogen 2.980 N/A GLU 158.A N ARG 155.A O no hydrogen 3.202 N/A VAL 159.A N ASN 123.A OD1 no hydrogen 3.161 N/A TYR 160.A N TRP 177.A O no hydrogen 2.913 N/A TYR 160.A OH GLU 158.A OE2 no hydrogen 2.906 N/A THR 161.A N PHE 121.A O no hydrogen 2.863 N/A CYS 162.A N VAL 175.A O no hydrogen 2.815 N/A GLN 163.A N ARG 119.A O no hydrogen 2.641 N/A VAL 164.A N LEU 173.A O no hydrogen 2.713 N/A GLU 165.A N GLU 117.A O no hydrogen 2.811 N/A HIS 166.A ND1 SER 168.A OG no hydrogen 2.825 N/A HIS 166.A NE2 PRO 113.A O no hydrogen 3.207 N/A SER 168.A N HIS 166.A ND1 no hydrogen 3.274 N/A SER 168.A OG VAL 92.A O no hydrogen 3.563 N/A SER 168.A OG HIS 166.A ND1 no hydrogen 2.825 N/A VAL 169.A N HIS 166.A O no hydrogen 2.877 N/A LEU 173.A N VAL 164.A O no hydrogen 2.984 N/A VAL 175.A N CYS 162.A O no hydrogen 3.028 N/A TRP 177.A N TYR 160.A O no hydrogen 2.811 N/A