Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4aqu_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 4.A N GLN 89.A OE1 no hydrogen 2.792 N/A TYR 4.A OH ILE 61.A O no hydrogen 2.569 N/A PHE 8.A N ASN 5.A OD1 no hydrogen 3.013 N/A LEU 9.A N ASN 5.A O no hydrogen 3.005 N/A LEU 10.A N LYS 6.A O no hydrogen 2.863 N/A TYR 11.A N GLU 7.A O no hydrogen 3.067 N/A LEU 12.A N PHE 8.A O no hydrogen 2.837 N/A ALA 13.A N LEU 9.A O no hydrogen 2.734 N/A GLY 14.A N LEU 10.A O no hydrogen 3.304 N/A PHE 15.A N TYR 11.A O no hydrogen 3.056 N/A VAL 16.A N LEU 12.A O no hydrogen 2.691 N/A ASP 17.A N ALA 13.A O no hydrogen 2.907 N/A GLY 18.A N GLY 14.A O no hydrogen 3.063 N/A ASP 19.A N PHE 15.A O no hydrogen 2.832 N/A GLY 20.A N VAL 16.A O no hydrogen 2.843 N/A SER 21.A N GLN 43.A O no hydrogen 2.805 N/A ILE 23.A N THR 41.A O no hydrogen 2.848 N/A GLN 25.A N SER 39.A O no hydrogen 2.800 N/A LYS 27.A N GLN 37.A O no hydrogen 2.756 N/A ASN 29.A N LYS 35.A O no hydrogen 3.042 N/A SER 31.A N ASN 29.A OD1 no hydrogen 3.222 N/A SER 31.A OG ASN 29.A OD1 no hydrogen 3.041 N/A TYR 32.A N ASN 29.A O no hydrogen 3.238 N/A LYS 33.A NZ LYS 115.A O no hydrogen 3.471 N/A LYS 35.A N TYR 32.A O no hydrogen 2.896 N/A HIS 36.A ND1 PHE 34.A O no hydrogen 2.877 N/A GLN 37.A N LYS 27.A O no hydrogen 2.707 N/A SER 39.A N GLN 25.A O no hydrogen 2.943 N/A THR 41.A N ILE 23.A O no hydrogen 2.818 N/A PHE 42.A N LEU 77.A O no hydrogen 2.897 N/A GLN 43.A N SER 21.A O no hydrogen 2.953 N/A VAL 44.A N TYR 75.A O no hydrogen 2.971 N/A THR 45.A N ASP 19.A O no hydrogen 3.334 N/A THR 45.A OG1 ASP 74.A OD2 no hydrogen 2.591 N/A GLN 46.A N SER 73.A O no hydrogen 2.869 N/A GLN 46.A NE2 ASP 19.A OD2 no hydrogen 3.062 N/A GLN 46.A NE2 THR 45.A O no hydrogen 2.918 N/A LYS 47.A NZ GLN 49.A OE1 no hydrogen 3.473 N/A THR 48.A N SER 71.A O no hydrogen 2.819 N/A THR 48.A OG1 GLY 70.A O no hydrogen 3.159 N/A THR 48.A OG1 SER 73.A OG no hydrogen 3.006 N/A ARG 50.A N LYS 47.A O no hydrogen 2.819 N/A ARG 50.A NE GLN 46.A OE1 no hydrogen 2.922 N/A ARG 50.A NH2 GLN 46.A OE1 no hydrogen 3.472 N/A ARG 51.A N THR 48.A O no hydrogen 2.854 N/A ARG 51.A NE ASP 55.A OD1 no hydrogen 3.245 N/A ARG 51.A NE ASP 55.A OD2 no hydrogen 3.386 N/A PHE 53.A N ARG 50.A O no hydrogen 2.832 N/A ASP 55.A N ARG 51.A O no hydrogen 2.820 N/A LYS 56.A N TRP 52.A O no hydrogen 2.991 N/A LEU 57.A N PHE 53.A O no hydrogen 3.302 N/A VAL 58.A N LEU 54.A O no hydrogen 3.230 N/A ASP 59.A N ASP 55.A O no hydrogen 3.236 N/A GLU 60.A N LYS 56.A O no hydrogen 2.733 N/A ILE 61.A N LEU 57.A O no hydrogen 2.795 N/A GLY 62.A N VAL 58.A O no hydrogen 2.769 N/A TYR 65.A N ILE 76.A O no hydrogen 3.149 N/A ARG 67.A N ASP 74.A O no hydrogen 2.930 N/A ARG 67.A NE ASP 74.A OD1 no hydrogen 2.981 N/A ARG 69.A N VAL 72.A O no hydrogen 2.856 N/A ARG 69.A NE ASP 74.A OD1 no hydrogen 2.730 N/A ARG 69.A NH2 ASP 74.A OD1 no hydrogen 3.509 N/A ARG 69.A NH2 ASP 74.A OD2 no hydrogen 2.817 N/A SER 73.A N GLN 46.A O no hydrogen 2.793 N/A SER 73.A OG THR 48.A OG1 no hydrogen 3.006 N/A SER 73.A OG ASP 68.A OD1 no hydrogen 2.975 N/A ASP 74.A N ARG 67.A O no hydrogen 2.970 N/A TYR 75.A N VAL 44.A O no hydrogen 2.730 N/A TYR 75.A OH VAL 63.A O no hydrogen 2.643 N/A ILE 76.A N TYR 65.A O no hydrogen 2.712 N/A LEU 77.A N PHE 42.A O no hydrogen 2.870 N/A SER 78.A OG LEU 40.A O no hydrogen 3.204 N/A LEU 83.A N GLU 79.A O no hydrogen 3.014 N/A HIS 84.A N ILE 80.A O no hydrogen 3.047 N/A ASN 85.A N LYS 81.A O no hydrogen 3.095 N/A ASN 85.A ND2 THR 2.A O no hydrogen 2.993 N/A PHE 86.A N PRO 82.A O no hydrogen 2.846 N/A LEU 87.A N LEU 83.A O no hydrogen 2.806 N/A THR 88.A N HIS 84.A O no hydrogen 2.983 N/A THR 88.A OG1 HIS 84.A O no hydrogen 2.742 N/A GLN 89.A N PHE 86.A O no hydrogen 3.190 N/A GLN 89.A NE2 THR 2.A O no hydrogen 3.118 N/A GLN 89.A NE2 ASN 85.A O no hydrogen 3.382 N/A GLN 89.A NE2 ASN 85.A OD1 no hydrogen 2.953 N/A LEU 90.A N PHE 86.A O no hydrogen 2.982 N/A GLN 91.A N LEU 87.A O no hydrogen 2.909 N/A PHE 93.A N LEU 90.A O no hydrogen 2.961 N/A LEU 94.A N GLN 91.A O no hydrogen 3.150 N/A LYS 95.A N ASP 17.A OD2 no hydrogen 2.714 N/A LEU 96.A N ASP 17.A OD1 no hydrogen 3.130 N/A LEU 96.A N ASP 17.A OD2 no hydrogen 3.117 N/A LYS 97.A N ASP 17.A OD1 no hydrogen 2.997 N/A LYS 97.A NZ GLY 20.A O no hydrogen 3.142 N/A GLN 98.A NE2 GLN 91.A O no hydrogen 2.878 N/A GLN 100.A N GLN 100.A OE1 no hydrogen 2.773 N/A GLN 100.A NE2 ASN 135.A OD1 no hydrogen 2.812 N/A ALA 101.A N LYS 97.A O no hydrogen 3.020 N/A ASN 102.A N GLN 98.A O no hydrogen 2.998 N/A LEU 103.A N LYS 99.A O no hydrogen 3.019 N/A VAL 104.A N GLN 100.A O no hydrogen 2.940 N/A LEU 105.A N ALA 101.A O no hydrogen 2.966 N/A LYS 106.A N ASN 102.A O no hydrogen 2.903 N/A ILE 107.A N LEU 103.A O no hydrogen 2.854 N/A ILE 108.A N VAL 104.A O no hydrogen 2.962 N/A GLU 109.A N LEU 105.A O no hydrogen 3.176 N/A GLN 110.A N LYS 106.A O no hydrogen 3.147 N/A LEU 111.A N ILE 108.A O no hydrogen 3.186 N/A SER 113.A OG GLN 110.A O no hydrogen 3.145 N/A ALA 114.A N GLN 110.A O no hydrogen 2.792 N/A LYS 115.A N LEU 111.A O no hydrogen 3.235 N/A LYS 115.A N PRO 112.A O no hydrogen 3.229 N/A GLU 116.A N SER 113.A O no hydrogen 3.104 N/A SER 117.A N SER 113.A O no hydrogen 3.421 N/A SER 117.A OG SER 113.A O no hydrogen 3.500 N/A LYS 120.A NZ GLN 110.A OE1 no hydrogen 2.422 N/A PHE 121.A N SER 117.A O no hydrogen 2.870 N/A LEU 122.A N PRO 118.A O no hydrogen 2.867 N/A GLU 123.A N ASP 119.A O no hydrogen 2.974 N/A VAL 124.A N LYS 120.A O no hydrogen 3.199 N/A CYS 125.A N PHE 121.A O no hydrogen 3.092 N/A CYS 125.A SG PHE 121.A O no hydrogen 3.291 N/A THR 126.A N LEU 122.A O no hydrogen 2.873 N/A TRP 127.A N GLU 123.A O no hydrogen 3.135 N/A VAL 128.A N VAL 124.A O no hydrogen 2.971 N/A ASP 129.A N CYS 125.A O no hydrogen 2.948 N/A GLN 130.A N THR 126.A O no hydrogen 3.144 N/A ILE 131.A N TRP 127.A O no hydrogen 3.102 N/A ALA 132.A N VAL 128.A O no hydrogen 3.126 N/A ALA 133.A N ASP 129.A O no hydrogen 2.895 N/A LEU 134.A N GLN 130.A O no hydrogen 2.952 N/A ASN 135.A N ILE 131.A O no hydrogen 2.994 N/A ASN 135.A N ALA 132.A O no hydrogen 3.249 N/A ASN 135.A ND2 ILE 22.A O no hydrogen 2.907 N/A LYS 138.A NZ ASP 136.A O no hydrogen 3.012 N/A ARG 140.A NH2 ASP 129.A OD1 no hydrogen 2.476 N/A SER 144.A N ASP 129.A OD1 no hydrogen 3.121 N/A SER 144.A OG ASP 129.A OD2 no hydrogen 2.671 N/A GLU 145.A N THR 143.A OG1 no hydrogen 2.922 N/A THR 146.A N THR 143.A OG1 no hydrogen 3.256 N/A VAL 147.A N THR 143.A O no hydrogen 3.227 N/A ARG 148.A N SER 144.A O no hydrogen 3.368 N/A ARG 148.A NH1 GLU 145.A OE2 no hydrogen 2.891 N/A ALA 149.A N GLU 145.A O no hydrogen 3.339 N/A VAL 150.A N VAL 147.A O no hydrogen 2.914 N/A LEU 151.A N VAL 147.A O no hydrogen 2.791 N/A