Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4ww5_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N GLU 131.A OE2 no hydrogen 3.146 N/A VAL 2.A N LEU 16.A O no hydrogen 2.891 N/A SER 4.A N VAL 14.A O no hydrogen 2.826 N/A SER 4.A OG TYR 52.A OH no hydrogen 2.906 N/A PHE 9.A N ILE 6.A O no hydrogen 2.754 N/A ILE 12.A N PHE 9.A O no hydrogen 3.227 N/A LYS 13.A N HIS 108.A O no hydrogen 3.048 N/A LYS 13.A NZ ASN 110.A O no hydrogen 3.469 N/A VAL 14.A N SER 4.A O no hydrogen 2.871 N/A SER 15.A N LYS 106.A O no hydrogen 2.859 N/A SER 15.A OG LYS 106.A O no hydrogen 3.390 N/A SER 15.A OG HIS 108.A NE2 no hydrogen 3.060 N/A LEU 16.A N VAL 2.A O no hydrogen 2.889 N/A ALA 17.A N CYS 104.A O no hydrogen 2.964 N/A PHE 19.A N LEU 102.A O no hydrogen 2.897 N/A GLU 20.A N GLN 130.A O no hydrogen 2.842 N/A VAL 22.A N SER 100.A O no hydrogen 2.881 N/A LYS 23.A N LYS 128.A O no hydrogen 2.695 N/A LYS 23.A NZ GLN 21.A OE1 no hydrogen 3.283 N/A ASN 24.A ND2 GLU 27.A OE1 no hydrogen 2.821 N/A ASN 24.A ND2 ILE 126.A O no hydrogen 3.012 N/A ILE 28.A N ASN 24.A O no hydrogen 2.835 N/A ARG 29.A N ALA 25.A O no hydrogen 2.879 N/A ARG 29.A NH1 ASP 97.A OD1 no hydrogen 2.786 N/A SER 30.A N LYS 26.A O no hydrogen 3.108 N/A SER 30.A OG GLU 27.A O no hydrogen 2.868 N/A LYS 31.A N GLU 27.A O no hydrogen 3.183 N/A LYS 31.A N ILE 28.A O no hydrogen 3.195 N/A MET 32.A N ARG 29.A O no hydrogen 3.354 N/A LEU 35.A N LYS 31.A O no hydrogen 3.122 N/A ALA 38.A N LEU 105.A O no hydrogen 2.846 N/A ILE 40.A N ILE 103.A O no hydrogen 2.838 N/A ASP 41.A N PHE 93.A O no hydrogen 2.828 N/A ARG 43.A N ASP 41.A OD1 no hydrogen 3.017 N/A LEU 44.A N ASP 41.A O no hydrogen 3.222 N/A VAL 45.A N PRO 42.A O no hydrogen 3.048 N/A CYS 46.A N GLN 50.A OE1 no hydrogen 2.842 N/A CYS 46.A SG GLN 50.A OE1 no hydrogen 3.594 N/A SER 47.A OG SER 167.A OG no hydrogen 2.591 N/A GLY 48.A N ASP 136.A OD1 no hydrogen 2.768 N/A GLN 50.A N SER 47.A OG no hydrogen 3.028 N/A GLN 50.A NE2 LEU 44.A O no hydrogen 2.877 N/A GLN 50.A NE2 TYR 152.A OH no hydrogen 3.031 N/A MET 51.A N SER 47.A O no hydrogen 3.300 N/A TYR 52.A N GLY 48.A O no hydrogen 2.822 N/A TYR 52.A OH SER 4.A OG no hydrogen 2.906 N/A SER 53.A N GLU 49.A O no hydrogen 2.950 N/A SER 53.A OG GLN 50.A O no hydrogen 2.866 N/A ALA 54.A N GLN 50.A O no hydrogen 3.176 N/A ILE 55.A N MET 51.A O no hydrogen 3.018 N/A TYR 56.A N TYR 52.A O no hydrogen 2.855 N/A LYS 57.A N SER 53.A O no hydrogen 2.982 N/A LYS 57.A NZ GLN 175.A O no hydrogen 2.807 N/A THR 58.A N ALA 54.A O no hydrogen 2.926 N/A THR 58.A OG1 ALA 54.A O no hydrogen 2.901 N/A LEU 59.A N ILE 55.A O no hydrogen 3.160 N/A ILE 60.A N TYR 56.A O no hydrogen 3.010 N/A GLU 61.A N LYS 57.A O no hydrogen 2.832 N/A VAL 62.A N THR 58.A O no hydrogen 3.044 N/A LYS 63.A N LEU 59.A O no hydrogen 2.998 N/A TYR 64.A N ILE 60.A O no hydrogen 2.838 N/A ASN 65.A N GLU 61.A O no hydrogen 2.730 N/A ARG 68.A N GLU 75.A OE1 no hydrogen 3.183 N/A ARG 68.A N GLU 75.A OE2 no hydrogen 2.803 N/A THR 69.A N GLU 75.A OE1 no hydrogen 2.805 N/A THR 69.A OG1 ASN 71.A O no hydrogen 3.381 N/A THR 69.A OG1 SER 74.A OG no hydrogen 2.842 N/A THR 69.A OG1 GLU 75.A OE1 no hydrogen 2.565 N/A ASN 71.A N SER 74.A OG no hydrogen 3.193 N/A ASN 71.A ND2 SER 36.A OG no hydrogen 2.940 N/A ASN 73.A ND2 SER 36.A OG no hydrogen 3.328 N/A SER 74.A N ASN 71.A OD1 no hydrogen 3.001 N/A SER 74.A OG THR 69.A OG1 no hydrogen 2.842 N/A SER 74.A OG ASN 71.A O no hydrogen 3.070 N/A SER 74.A OG ASN 71.A OD1 no hydrogen 3.195 N/A GLU 75.A N ASN 71.A O no hydrogen 2.928 N/A CYS 76.A N LEU 72.A O no hydrogen 2.986 N/A VAL 77.A N ASN 73.A O no hydrogen 3.473 N/A LEU 78.A N SER 74.A O no hydrogen 3.126 N/A CYS 79.A N GLU 75.A O no hydrogen 2.882 N/A CYS 79.A SG THR 58.A OG1 no hydrogen 3.737 N/A CYS 79.A SG GLU 75.A O no hydrogen 3.444 N/A LEU 80.A N CYS 76.A O no hydrogen 2.933 N/A SER 81.A N LEU 78.A O no hydrogen 3.029 N/A SER 81.A OG LEU 78.A O no hydrogen 2.710 N/A SER 81.A OG THR 83.A O no hydrogen 3.074 N/A THR 83.A N SER 81.A OG no hydrogen 3.243 N/A ASN 85.A N THR 83.A OG1 no hydrogen 3.001 N/A ASP 88.A N ASN 85.A OD1 no hydrogen 2.821 N/A ALA 89.A N ASN 85.A O no hydrogen 3.122 N/A PHE 90.A N ILE 86.A O no hydrogen 2.955 N/A LEU 91.A N SER 87.A O no hydrogen 3.025 N/A LYS 92.A N ASP 88.A O no hydrogen 2.969 N/A LYS 92.A NZ ASP 88.A OD1 no hydrogen 3.216 N/A LYS 92.A NZ ASP 88.A OD2 no hydrogen 2.938 N/A PHE 93.A N ALA 89.A O no hydrogen 2.801 N/A GLY 94.A N PHE 90.A O no hydrogen 2.945 N/A ILE 95.A N PHE 39.A O no hydrogen 3.019 N/A LYS 96.A N SER 99.A OG no hydrogen 2.691 N/A LYS 96.A NZ ASP 41.A OD2 no hydrogen 2.676 N/A LYS 96.A NZ LEU 91.A O no hydrogen 3.380 N/A LYS 96.A NZ LYS 92.A O no hydrogen 2.849 N/A LYS 96.A NZ GLY 94.A O no hydrogen 2.852 N/A SER 99.A N LYS 96.A O no hydrogen 2.981 N/A SER 99.A OG LYS 96.A O no hydrogen 3.310 N/A LEU 102.A N PHE 19.A O no hydrogen 3.113 N/A ILE 103.A N ILE 40.A O no hydrogen 2.878 N/A CYS 104.A N ALA 17.A O no hydrogen 2.827 N/A LEU 105.A N ALA 38.A O no hydrogen 2.872 N/A LYS 106.A N SER 15.A O no hydrogen 2.951 N/A LYS 106.A NZ SER 36.A O no hydrogen 2.844 N/A PHE 107.A N ASN 73.A OD1 no hydrogen 2.835 N/A HIS 108.A N LYS 13.A O no hydrogen 2.672 N/A HIS 108.A NE2 SER 15.A OG no hydrogen 3.060 N/A GLN 118.A N ASP 115.A OD1 no hydrogen 3.372 N/A LEU 119.A N ASP 115.A O no hydrogen 2.908 N/A ARG 120.A N LYS 116.A O no hydrogen 2.877 N/A THR 121.A N GLU 117.A O no hydrogen 3.068 N/A THR 121.A OG1 GLU 117.A O no hydrogen 2.911 N/A ILE 122.A N GLN 118.A O no hydrogen 2.928 N/A MET 123.A N LEU 119.A O no hydrogen 2.931 N/A THR 124.A N ARG 120.A O no hydrogen 3.140 N/A THR 124.A OG1 ARG 120.A O no hydrogen 2.797 N/A THR 124.A OG1 THR 121.A O no hydrogen 3.181 N/A SER 125.A N THR 121.A O no hydrogen 3.021 N/A SER 125.A N ILE 122.A O no hydrogen 3.072 N/A SER 125.A OG ILE 122.A O no hydrogen 2.848 N/A ILE 126.A N ILE 122.A O no hydrogen 3.122 N/A ILE 126.A N MET 123.A O no hydrogen 3.141 N/A VAL 127.A N MET 123.A O no hydrogen 2.801 N/A LYS 128.A N ASN 24.A OD1 no hydrogen 2.850 N/A GLN 130.A N GLU 20.A O no hydrogen 2.835 N/A ILE 132.A N LEU 18.A O no hydrogen 2.904 N/A ASN 138.A N ASN 135.A OD1 no hydrogen 2.899 N/A ASN 138.A ND2 GLU 133.A O no hydrogen 2.740 N/A LEU 139.A N ASN 135.A O no hydrogen 3.012 N/A SER 140.A N ASP 136.A O no hydrogen 2.915 N/A SER 140.A OG ASP 136.A O no hydrogen 3.494 N/A SER 140.A OG ASP 137.A O no hydrogen 2.935 N/A ARG 141.A N ASN 138.A O no hydrogen 3.141 N/A ARG 141.A NE ASN 138.A OD1 no hydrogen 2.955 N/A PHE 142.A N LEU 139.A O no hydrogen 3.241 N/A ASP 144.A N ARG 43.A O no hydrogen 2.772 N/A LEU 147.A N ASP 144.A OD1 no hydrogen 3.150 N/A ILE 148.A N ASP 144.A O no hydrogen 2.932 N/A ARG 149.A N GLU 145.A O no hydrogen 2.825 N/A ARG 149.A NE GLU 145.A OE2 no hydrogen 3.012 N/A ARG 149.A NH1 SER 155.A O no hydrogen 3.190 N/A ARG 149.A NH1 PHE 158.A O no hydrogen 3.070 N/A ARG 149.A NH2 GLU 145.A OE2 no hydrogen 3.072 N/A ARG 149.A NH2 PHE 158.A O no hydrogen 2.667 N/A LYS 150.A N ALA 146.A O no hydrogen 3.143 N/A ILE 151.A N LEU 147.A O no hydrogen 2.865 N/A TYR 152.A N ILE 148.A O no hydrogen 2.856 N/A TYR 152.A OH LEU 80.A O no hydrogen 2.622 N/A LYS 153.A N LYS 150.A O no hydrogen 3.310 N/A LEU 154.A N ARG 149.A O no hydrogen 2.904 N/A ASP 157.A N SER 155.A OG no hydrogen 2.941 N/A PHE 158.A N SER 155.A O no hydrogen 2.996 N/A GLY 165.A N ASP 162.A OD1 no hydrogen 2.876 N/A LEU 166.A N ASP 162.A O no hydrogen 3.215 N/A SER 167.A N VAL 163.A O no hydrogen 2.724 N/A SER 167.A OG SER 47.A OG no hydrogen 2.591 N/A SER 167.A OG GLU 49.A OE1 no hydrogen 2.844 N/A ARG 168.A N ASN 164.A O no hydrogen 3.060 N/A LEU 170.A N LEU 166.A O no hydrogen 3.271 N/A VAL 171.A N SER 167.A O no hydrogen 2.932 N/A ASP 172.A N ARG 168.A O no hydrogen 3.097 N/A ALA 173.A N ALA 169.A O no hydrogen 3.205 N/A ILE 174.A N LEU 170.A O no hydrogen 2.865 N/A GLN 175.A N VAL 171.A O no hydrogen 2.761 N/A GLN 175.A NE2 SER 53.A O no hydrogen 3.010 N/A LEU 176.A N ASP 172.A O no hydrogen 3.035 N/A ARG 177.A N ILE 174.A O no hydrogen 3.382 N/A ARG 177.A NH1 THR 83.A O no hydrogen 3.038 N/A ARG 177.A NH2 SER 81.A O no hydrogen 2.725 N/A ARG 177.A NH2 THR 83.A O no hydrogen 2.784 N/A