Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4xf3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 4.A NZ ALA 35.A O no hydrogen 2.919 N/A LYS 4.A NZ GLU 37.A OE2.A no hydrogen 3.253 N/A ARG 6.A N ASP 10.A OD2 no hydrogen 3.209 N/A ARG 6.A NE ASP 10.A OD2 no hydrogen 3.225 N/A ARG 6.A NH1 ASP 10.A OD1 no hydrogen 2.919 N/A LEU 8.A N GLU 42.A OE1 no hydrogen 2.964 N/A ASP 10.A N THR 7.A OG1 no hydrogen 3.068 N/A LEU 11.A N THR 7.A O no hydrogen 2.898 N/A ILE 12.A N LEU 8.A O no hydrogen 2.971 N/A ARG 13.A N ALA 9.A O no hydrogen 3.152 N/A ARG 13.A NH1 GLU 17.A OE2 no hydrogen 3.102 N/A ARG 13.A NH2 ASP 10.A OD1 no hydrogen 2.794 N/A ILE 14.A N ASP 10.A O no hydrogen 2.966 N/A LEU 15.A N LEU 11.A O no hydrogen 2.946 N/A HIS 16.A N ILE 12.A O no hydrogen 3.076 N/A HIS 16.A NE2 ASP 60.A OD2 no hydrogen 2.940 N/A GLU 17.A N ARG 13.A O no hydrogen 3.194 N/A LEU 18.A N ILE 14.A O no hydrogen 2.927 N/A PHE 19.A N LEU 15.A O no hydrogen 2.909 N/A ALA 20.A N GLU 17.A O no hydrogen 2.872 N/A GLU 28.A N ASN 25.A OD1 no hydrogen 3.163 N/A VAL 29.A N ASN 25.A O no hydrogen 3.052 N/A GLN 30.A N VAL 26.A O no hydrogen 2.864 N/A GLN 30.A NE2 CYS 126.A O no hydrogen 2.888 N/A ALA 31.A N GLU 27.A O no hydrogen 2.973 N/A VAL 32.A N GLU 28.A O no hydrogen 3.049 N/A LEU 33.A N VAL 29.A O no hydrogen 2.997 N/A GLU 34.A N GLN 30.A O no hydrogen 2.950 N/A ALA 35.A N ALA 31.A O no hydrogen 2.954 N/A TYR 36.A N VAL 32.A O no hydrogen 3.266 N/A TYR 36.A N LEU 33.A O no hydrogen 3.266 N/A TYR 36.A OH GLU 42.A OE1 no hydrogen 2.606 N/A SER 38.A N ASN 124.A OD1 no hydrogen 2.809 N/A SER 38.A OG LEU 94.A O no hydrogen 2.763 N/A ASN 39.A N TYR 36.A OH no hydrogen 3.357 N/A ALA 41.A N ASN 39.A OD1 no hydrogen 3.227 N/A GLU 42.A N ASN 39.A O no hydrogen 2.876 N/A TRP 43.A NE1 SER 38.A OG no hydrogen 2.895 N/A TYR 46.A N TRP 43.A O no hydrogen 2.869 N/A ALA 47.A N ALA 44.A O no hydrogen 3.008 N/A LYS 48.A N TYR 46.A O no hydrogen 2.918 N/A LYS 48.A NZ LEU 45.A O no hydrogen 2.982 N/A LYS 48.A NZ GLY 182.A O no hydrogen 2.789 N/A TYR 52.A N ASP 50.A OD2 no hydrogen 2.963 N/A ARG 53.A N ASP 50.A OD2 no hydrogen 3.371 N/A ARG 53.A NE TYR 54.A O no hydrogen 2.573 N/A ARG 53.A NH2 TYR 54.A O no hydrogen 3.002 N/A THR 55.A N CYS 72.A O no hydrogen 3.020 N/A THR 55.A OG1 LYS 48.A O no hydrogen 2.619 N/A ARG 56.A NH1 THR 176.A O no hydrogen 3.104 N/A ASN 57.A N ILE 70.A O no hydrogen 2.795 N/A ASN 57.A ND2 THR 55.A OG1 no hydrogen 3.264 N/A ASN 57.A ND2 ILE 70.A O no hydrogen 3.025 N/A LEU 58.A N SER 179.A O no hydrogen 2.839 N/A VAL 59.A N LEU 68.A O no hydrogen 2.828 N/A ASP 60.A N LEU 68.A O no hydrogen 3.158 N/A GLY 62.A N ASP 60.A OD2 no hydrogen 2.782 N/A ASN 63.A ND2 PHE 19.A O no hydrogen 2.931 N/A LYS 65.A N ASN 63.A OD1 no hydrogen 3.072 N/A LYS 65.A NZ PHE 19.A O no hydrogen 2.790 N/A LYS 65.A NZ GLY 21.A O no hydrogen 2.616 N/A ASN 67.A N PHE 153.A O no hydrogen 2.943 N/A LEU 68.A N ASP 60.A O no hydrogen 2.975 N/A MET 69.A N HIS 151.A O no hydrogen 2.755 N/A ILE 70.A N ASN 57.A O no hydrogen 2.740 N/A LEU 71.A N SER 149.A O no hydrogen 2.746 N/A CYS 72.A N THR 55.A O no hydrogen 3.075 N/A CYS 72.A SG LYS 48.A O no hydrogen 3.835 N/A TRP 73.A N ALA 147.A O no hydrogen 2.787 N/A TRP 73.A NE1 SER 149.A OG no hydrogen 2.879 N/A GLY 74.A N HIS 77.A ND1 no hydrogen 2.890 N/A GLU 75.A N GLU 75.A OE1 no hydrogen 2.653 N/A HIS 77.A N GLY 74.A O no hydrogen 2.941 N/A HIS 77.A NE2 GLN 51.A O no hydrogen 3.075 N/A SER 79.A N VAL 138.A O no hydrogen 2.755 N/A SER 79.A OG SER 80.A O no hydrogen 2.725 N/A SER 79.A OG VAL 138.A O no hydrogen 3.320 N/A SER 80.A OG ILE 81.A O no hydrogen 3.458 N/A HIS 82.A N HIS 136.A O no hydrogen 2.912 N/A HIS 82.A ND1 SER 80.A O no hydrogen 2.835 N/A ASP 83.A N HIS 161.A O no hydrogen 3.387 N/A HIS 84.A N ASP 131.A OD1 no hydrogen 2.942 N/A THR 85.A OG1 THR 159.A O no hydrogen 2.580 N/A ASP 86.A N ASP 131.A OD2 no hydrogen 2.909 N/A SER 87.A N HIS 84.A O no hydrogen 2.861 N/A SER 87.A OG PRO 155.A O no hydrogen 2.681 N/A HIS 88.A N SER 154.A O no hydrogen 2.840 N/A HIS 88.A ND1 TYR 128.A OH no hydrogen 2.791 N/A CYS 89.A N ILE 129.A O no hydrogen 3.019 N/A CYS 89.A SG.B SER 87.A O no hydrogen 3.733 N/A PHE 90.A N LEU 152.A O no hydrogen 2.842 N/A LEU 91.A N ALA 127.A O no hydrogen 2.810 N/A LYS 92.A N LEU 150.A O no hydrogen 2.661 N/A LYS 92.A NZ LEU 33.A O no hydrogen 2.904 N/A LYS 92.A NZ TYR 36.A O no hydrogen 2.555 N/A LYS 92.A NZ ASN 124.A O no hydrogen 2.797 N/A LYS 92.A NZ ASN 124.A OD1 no hydrogen 3.389 N/A LEU 93.A N GLN 125.A O no hydrogen 2.957 N/A LEU 94.A N VAL 148.A O no hydrogen 2.726 N/A GLN 95.A N VAL 148.A O no hydrogen 3.075 N/A GLN 95.A NE2 PRO 146.A O no hydrogen 3.472 N/A GLY 96.A N GLU 123.A OE2.B no hydrogen 3.046 N/A LEU 98.A N LEU 121.A O no hydrogen 3.089 N/A LYS 99.A N GLU 139.A O no hydrogen 2.764 N/A GLU 100.A N ARG 119.A O no hydrogen 2.909 N/A THR 101.A N ARG 137.A O.A no hydrogen 2.780 N/A THR 101.A N ARG 137.A O.B no hydrogen 2.704 N/A LEU 102.A N SER 117.A O no hydrogen 2.843 N/A PHE 103.A N LEU 135.A O no hydrogen 2.944 N/A TRP 105.A NE1 ASP 131.A O no hydrogen 2.795 N/A ASN 111.A N THR 167.A O no hydrogen 3.142 N/A MET 113.A N GLN 165.A O no hydrogen 2.646 N/A LYS 116.A N LEU 102.A O no hydrogen 2.752 N/A ARG 119.A N GLU 100.A O no hydrogen 3.022 N/A ARG 119.A NE GLU 100.A OE1 no hydrogen 2.936 N/A ARG 119.A NH2 GLU 100.A OE1 no hydrogen 3.071 N/A LEU 121.A N LEU 98.A O no hydrogen 2.744 N/A ASN 124.A N LEU 93.A O no hydrogen 2.786 N/A GLN 125.A N ARG 122.A O no hydrogen 3.078 N/A CYS 126.A N GLU 34.A OE1 no hydrogen 2.873 N/A CYS 126.A SG LEU 91.A O no hydrogen 3.710 N/A CYS 126.A SG ALA 127.A O no hydrogen 3.662 N/A ALA 127.A N LEU 91.A O no hydrogen 2.755 N/A TYR 128.A OH HIS 88.A ND1 no hydrogen 2.791 N/A ILE 129.A N CYS 89.A O no hydrogen 2.853 N/A ASN 130.A ND2.A TYR 128.A OH no hydrogen 2.695 N/A SER 132.A N ASN 130.A OD1.B no hydrogen 2.933 N/A SER 132.A OG ASN 130.A OD1.A no hydrogen 2.511 N/A ILE 133.A N ASN 130.A O no hydrogen 2.990 N/A ILE 133.A N ASN 130.A OD1.A no hydrogen 3.086 N/A GLY 134.A N ASN 130.A O no hydrogen 3.195 N/A LEU 135.A N PHE 103.A O no hydrogen 2.905 N/A HIS 136.A N HIS 82.A O no hydrogen 3.056 N/A HIS 136.A ND1 GLU 100.A OE2 no hydrogen 2.760 N/A HIS 136.A NE2 HIS 82.A NE2 no hydrogen 2.967 N/A ARG 137.A N.A THR 101.A O no hydrogen 2.811 N/A ARG 137.A N.B THR 101.A O no hydrogen 2.832 N/A ARG 137.A NH1.A SER 79.A O no hydrogen 2.689 N/A ARG 137.A NH1.B GLN 165.A OE1 no hydrogen 2.612 N/A ARG 137.A NH2.A GLN 165.A OE1 no hydrogen 3.353 N/A ARG 137.A NH2.B GLN 165.A OE1 no hydrogen 3.393 N/A VAL 138.A N SER 79.A OG no hydrogen 2.867 N/A GLU 139.A N LYS 99.A O no hydrogen 2.798 N/A ASN 140.A N HIS 77.A O no hydrogen 2.650 N/A ASN 140.A ND2 TRP 73.A O no hydrogen 3.103 N/A ASN 140.A ND2 GLY 74.A O no hydrogen 3.069 N/A ASN 140.A ND2 GLU 145.A O no hydrogen 2.832 N/A SER 142.A N ASN 140.A OD1 no hydrogen 3.156 N/A THR 144.A N SER 142.A OG no hydrogen 3.133 N/A GLU 145.A N SER 142.A OG no hydrogen 2.899 N/A ALA 147.A N TRP 73.A O no hydrogen 2.849 N/A VAL 148.A N GLN 95.A O no hydrogen 2.796 N/A SER 149.A N LEU 71.A O no hydrogen 2.775 N/A SER 149.A OG LEU 71.A O no hydrogen 3.530 N/A SER 149.A OG HIS 151.A NE2 no hydrogen 2.745 N/A LEU 150.A N LYS 92.A O no hydrogen 2.661 N/A HIS 151.A N MET 69.A O no hydrogen 2.689 N/A HIS 151.A NE2 SER 149.A OG no hydrogen 2.745 N/A LEU 152.A N PHE 90.A O no hydrogen 2.954 N/A PHE 153.A N ASN 67.A O no hydrogen 2.958 N/A SER 154.A N HIS 88.A O no hydrogen 2.959 N/A SER 154.A OG LYS 65.A O no hydrogen 2.589 N/A CYS 160.A N VAL 173.A O no hydrogen 2.963 N/A HIS 161.A N ASP 83.A OD1 no hydrogen 2.607 N/A HIS 161.A ND1 ASP 83.A OD2 no hydrogen 3.123 N/A ALA 162.A N ASN 171.A O no hydrogen 2.828 N/A PHE 163.A N ILE 81.A O no hydrogen 2.782 N/A ASP 164.A N HIS 169.A O no hydrogen 2.950 N/A ARG 166.A N ASP 164.A OD1 no hydrogen 3.263 N/A ARG 166.A NE GLU 112.A OE1 no hydrogen 2.784 N/A ARG 166.A NE GLU 112.A OE2 no hydrogen 3.323 N/A ARG 166.A NH2 GLU 112.A OE2 no hydrogen 2.635 N/A THR 167.A N ASP 164.A O no hydrogen 3.044 N/A THR 167.A OG1 ASP 164.A OD2 no hydrogen 2.609 N/A GLY 168.A N ASP 164.A O no hydrogen 2.644 N/A HIS 169.A N THR 167.A OG1 no hydrogen 3.048 N/A ASN 171.A N ALA 162.A O no hydrogen 2.832 N/A VAL 173.A N CYS 160.A O no hydrogen 2.654 N/A MET 175.A N ASP 158.A O no hydrogen 2.877 N/A HIS 178.A N ARG 56.A O no hydrogen 2.675 N/A SER 179.A OG ASN 57.A OD1 no hydrogen 2.573 N/A LYS 180.A N ILE 183.A O no hydrogen 2.958 N/A PHE 181.A N LEU 58.A O no hydrogen 2.848 N/A ILE 183.A N LYS 180.A O no hydrogen 3.016 N/A ARG 184.A NH1 HIS 178.A O no hydrogen 2.902 N/A THR 185.A N HIS 178.A O no hydrogen 2.863 N/A THR 185.A OG1 PHE 177.A O no hydrogen 3.108 N/A THR 185.A OG1 THR 185.A O no hydrogen 2.658 N/A