Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6xwk_BBB.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 2.A N SER 102.A OG no hydrogen 2.946 N/A ASP 3.A N THR 6.A OG1 no hydrogen 2.961 N/A ALA 4.A N THR 98.A O no hydrogen 2.888 N/A THR 6.A N ASP 3.A OD1 no hydrogen 2.894 N/A THR 6.A OG1 ASP 3.A OD1 no hydrogen 3.377 N/A LYS 7.A N ASP 3.A O no hydrogen 2.836 N/A LYS 7.A NZ.A ASP 100.A OD1 no hydrogen 3.382 N/A VAL 8.A N ALA 4.A O no hydrogen 3.388 N/A VAL 9.A N PHE 5.A O no hydrogen 3.039 N/A SER 10.A N.A THR 6.A O no hydrogen 2.857 N/A SER 10.A N.B THR 6.A O no hydrogen 2.833 N/A SER 10.A OG.A THR 6.A O no hydrogen 3.436 N/A SER 10.A OG.A LYS 7.A O no hydrogen 2.792 N/A GLN 11.A N LYS 7.A O no hydrogen 3.081 N/A ALA 12.A N VAL 8.A O no hydrogen 3.000 N/A ASP 13.A N VAL 9.A O no hydrogen 2.815 N/A ALA 14.A N SER 10.A O.A no hydrogen 3.228 N/A ALA 14.A N SER 10.A O.B no hydrogen 3.350 N/A ARG 15.A N ALA 12.A O no hydrogen 3.011 N/A ARG 15.A NE GLN 11.A O no hydrogen 3.327 N/A GLY 16.A N ASP 13.A O no hydrogen 2.919 N/A ALA 17.A N ALA 12.A O no hydrogen 2.995 N/A THR 20.A N GLN 23.A OE1 no hydrogen 2.930 N/A THR 20.A OG1 GLN 23.A OE1 no hydrogen 3.357 N/A GLN 23.A N THR 20.A OG1 no hydrogen 3.080 N/A ILE 24.A N.A THR 20.A O no hydrogen 2.866 N/A ILE 24.A N.B THR 20.A O no hydrogen 2.888 N/A GLY 25.A N ASN 21.A O no hydrogen 2.841 N/A ALA 26.A N ASP 22.A O no hydrogen 3.016 N/A LEU 27.A N GLN 23.A O no hydrogen 2.945 N/A ASN 28.A N ILE 24.A O.A no hydrogen 2.817 N/A ASN 28.A N ILE 24.A O.B no hydrogen 2.905 N/A ASN 28.A ND2 ILE 24.A O.A no hydrogen 3.619 N/A ASN 28.A ND2 ILE 24.A O.B no hydrogen 3.391 N/A GLN 29.A N GLY 25.A O no hydrogen 3.020 N/A LEU 30.A N ALA 26.A O no hydrogen 3.064 N/A VAL 31.A N LEU 27.A O no hydrogen 2.917 N/A SER 32.A N.A ASN 28.A O no hydrogen 2.951 N/A SER 32.A N.B ASN 28.A O no hydrogen 2.945 N/A SER 32.A OG.A ASN 28.A O no hydrogen 3.221 N/A SER 32.A OG.B GLN 29.A O no hydrogen 2.744 N/A ASP 33.A N GLN 29.A O no hydrogen 3.075 N/A ASP 33.A N LEU 30.A O no hydrogen 3.110 N/A GLY 34.A N VAL 31.A O no hydrogen 2.958 N/A LYS 36.A NZ ASP 33.A OD1 no hydrogen 3.067 N/A LYS 36.A NZ ASP 151.A O no hydrogen 2.795 N/A ARG 37.A N ASP 33.A O no hydrogen 3.019 N/A ARG 37.A NH1 ILE 96.A O no hydrogen 2.779 N/A ARG 37.A NH1 GLU 158.A OE1 no hydrogen 3.426 N/A ARG 37.A NH1 GLU 158.A OE2 no hydrogen 2.886 N/A ARG 37.A NH2 GLU 158.A OE1 no hydrogen 2.848 N/A ILE 38.A N GLY 34.A O no hydrogen 3.069 N/A ASP 39.A N ASN 35.A O no hydrogen 2.929 N/A VAL 40.A N LYS 36.A O no hydrogen 2.993 N/A VAL 41.A N ARG 37.A O no hydrogen 3.040 N/A ASN 42.A N ILE 38.A O no hydrogen 2.826 N/A ARG 43.A N ASP 39.A O no hydrogen 2.817 N/A ARG 43.A NH1 ALA 141.A O no hydrogen 2.928 N/A ARG 43.A NH1 ASP 143.A O no hydrogen 2.720 N/A ARG 43.A NH2 ASP 143.A O no hydrogen 3.320 N/A ILE 44.A N VAL 40.A O no hydrogen 3.024 N/A THR 45.A N VAL 41.A O no hydrogen 2.920 N/A THR 45.A OG1 VAL 41.A O no hydrogen 2.724 N/A SER 46.A N ASN 42.A O no hydrogen 2.857 N/A SER 46.A OG ASN 42.A O no hydrogen 2.776 N/A SER 46.A OG ASN 42.A OD1 no hydrogen 3.379 N/A ASN 47.A N ARG 43.A O no hydrogen 3.275 N/A ASN 47.A N ILE 44.A O no hydrogen 3.183 N/A ASN 47.A ND2 ARG 43.A O no hydrogen 2.830 N/A ALA 48.A N THR 45.A O no hydrogen 3.170 N/A THR 50.A OG1.A ASN 47.A O no hydrogen 3.230 N/A ILE 51.A N ASN 47.A O no hydrogen 2.986 N/A VAL 52.A N ALA 48.A O no hydrogen 3.001 N/A ALA 53.A N SER 49.A O no hydrogen 2.965 N/A ASP 54.A N THR 50.A O no hydrogen 2.849 N/A ALA 55.A N ILE 51.A O no hydrogen 3.064 N/A ALA 56.A N VAL 52.A O no hydrogen 2.891 N/A ARG 57.A N ALA 53.A O no hydrogen 2.923 N/A ARG 57.A NH1 ASP 54.A OD1 no hydrogen 2.886 N/A SER 58.A N ASP 54.A O no hydrogen 3.112 N/A LEU 59.A N ALA 55.A O no hydrogen 2.857 N/A PHE 60.A N ALA 56.A O no hydrogen 2.957 N/A ALA 61.A N ARG 57.A O no hydrogen 3.022 N/A ASP 62.A N SER 58.A O no hydrogen 3.035 N/A GLN 63.A N LEU 59.A O no hydrogen 2.808 N/A GLN 63.A NE2 GLN 128.A OE1 no hydrogen 2.847 N/A GLN 65.A N GLN 65.A OE1 no hydrogen 2.760 N/A GLN 65.A NE2 GLN 63.A OE1 no hydrogen 2.926 N/A LEU 66.A N GLN 63.A O no hydrogen 2.996 N/A ILE 67.A N PRO 64.A O no hydrogen 3.078 N/A ALA 68.A N PRO 64.A O no hydrogen 3.097 N/A GLY 71.A N ALA 68.A O no hydrogen 2.730 N/A TYR 73.A N GLY 71.A O no hydrogen 3.134 N/A THR 74.A OG1 TYR 73.A O no hydrogen 2.631 N/A ARG 77.A N THR 74.A OG1 no hydrogen 3.346 N/A ARG 77.A NH2.A GLY 71.A O no hydrogen 2.876 N/A MET 78.A N THR 74.A O no hydrogen 2.967 N/A ALA 79.A N SER 75.A O no hydrogen 2.832 N/A ALA 80.A N ARG 76.A O no hydrogen 2.933 N/A CYS 81.A N ARG 77.A O no hydrogen 2.883 N/A LEU 82.A N MET 78.A O no hydrogen 2.907 N/A ARG 83.A N.A ALA 79.A O no hydrogen 2.903 N/A ARG 83.A N.B ALA 79.A O no hydrogen 2.897 N/A ARG 83.A NE.A ASP 84.A OD1 no hydrogen 3.298 N/A ARG 83.A NH1.A ASP 84.A OD1 no hydrogen 2.901 N/A ASP 84.A N ALA 80.A O no hydrogen 2.890 N/A MET 85.A N CYS 81.A O no hydrogen 3.046 N/A GLU 86.A N LEU 82.A O no hydrogen 3.027 N/A ILE 87.A N ARG 83.A O.A no hydrogen 2.794 N/A ILE 87.A N ARG 83.A O.B no hydrogen 2.772 N/A ILE 88.A N ASP 84.A O no hydrogen 2.928 N/A LEU 89.A N MET 85.A O no hydrogen 2.984 N/A ARG 90.A N GLU 86.A O no hydrogen 2.816 N/A ARG 90.A NH1 TYR 94.A OH no hydrogen 2.947 N/A TYR 91.A N ILE 87.A O no hydrogen 2.976 N/A VAL 92.A N ILE 88.A O no hydrogen 2.895 N/A THR 93.A N LEU 89.A O no hydrogen 2.926 N/A THR 93.A OG1 ARG 90.A O no hydrogen 2.694 N/A TYR 94.A N ARG 90.A O no hydrogen 3.046 N/A ALA 95.A N TYR 91.A O no hydrogen 3.011 N/A ILE 96.A N VAL 92.A O no hydrogen 2.953 N/A PHE 97.A N THR 93.A O no hydrogen 2.925 N/A THR 98.A N TYR 94.A O no hydrogen 2.994 N/A THR 98.A OG1 TYR 94.A O no hydrogen 3.113 N/A THR 98.A OG1 ALA 95.A O no hydrogen 3.363 N/A GLY 99.A N ALA 95.A O no hydrogen 2.790 N/A ASP 100.A N THR 98.A OG1 no hydrogen 3.308 N/A SER 102.A N ASP 100.A OD2 no hydrogen 2.889 N/A SER 102.A OG ASP 100.A OD2 no hydrogen 2.747 N/A MET 104.A N.A GLY 101.A O no hydrogen 2.977 N/A MET 104.A N.B GLY 101.A O no hydrogen 3.026 N/A ASP 105.A N GLY 101.A O no hydrogen 3.070 N/A ASP 106.A N SER 102.A O no hydrogen 2.836 N/A ARG 107.A N VAL 103.A O no hydrogen 3.099 N/A CYS 108.A N MET 104.A O.A no hydrogen 3.186 N/A CYS 108.A N MET 104.A O.B no hydrogen 2.916 N/A LEU 109.A N MET 104.A O.A no hydrogen 2.830 N/A LEU 109.A N MET 104.A O.B no hydrogen 2.925 N/A ASN 110.A N ASP 105.A O no hydrogen 2.838 N/A LEU 112.A N LEU 109.A O no hydrogen 2.949 N/A ARG 113.A NE GLU 114.A OE2 no hydrogen 3.042 N/A ARG 113.A NH1 GLU 114.A OE2 no hydrogen 3.057 N/A GLU 114.A N GLU 114.A OE1 no hydrogen 2.840 N/A THR 115.A N GLY 111.A O no hydrogen 2.968 N/A THR 115.A OG1 GLY 111.A O no hydrogen 3.173 N/A TYR 116.A N LEU 112.A O no hydrogen 2.903 N/A TYR 116.A OH ASP 84.A OD2 no hydrogen 2.709 N/A VAL 117.A N ARG 113.A O no hydrogen 3.019 N/A ALA 118.A N GLU 114.A O no hydrogen 3.015 N/A LEU 119.A N THR 115.A O no hydrogen 3.081 N/A GLY 120.A N VAL 117.A O no hydrogen 3.236 N/A VAL 121.A N TYR 116.A O no hydrogen 2.983 N/A SER 125.A N PRO 122.A O no hydrogen 3.020 N/A VAL 126.A N PRO 122.A O no hydrogen 3.139 N/A ALA 127.A N GLY 123.A O no hydrogen 2.840 N/A GLN 128.A N ALA 124.A O no hydrogen 3.070 N/A GLY 129.A N SER 125.A O no hydrogen 2.946 N/A VAL 130.A N VAL 126.A O no hydrogen 2.855 N/A SER 131.A N.A ALA 127.A O no hydrogen 2.902 N/A SER 131.A N.B ALA 127.A O no hydrogen 2.887 N/A SER 131.A OG.A ALA 127.A O no hydrogen 3.184 N/A LYS 132.A N GLN 128.A O no hydrogen 2.943 N/A LYS 132.A NZ SER 58.A OG no hydrogen 2.867 N/A LYS 132.A NZ ASP 62.A OD2 no hydrogen 2.800 N/A MET 133.A N GLY 129.A O no hydrogen 2.926 N/A LYS 134.A N VAL 130.A O no hydrogen 2.846 N/A LYS 134.A NZ ASP 164.A OD1 no hydrogen 2.773 N/A GLN 135.A N SER 131.A O.A no hydrogen 3.111 N/A GLN 135.A N SER 131.A O.B no hydrogen 3.081 N/A ALA 136.A N LYS 132.A O no hydrogen 3.194 N/A ALA 137.A N MET 133.A O no hydrogen 2.771 N/A ILE 138.A N LYS 134.A O no hydrogen 2.937 N/A ALA 139.A N GLN 135.A O no hydrogen 3.090 N/A ILE 140.A N ALA 136.A O no hydrogen 2.998 N/A ALA 141.A N ALA 137.A O no hydrogen 2.789 N/A ASN 142.A N ILE 138.A O no hydrogen 2.830 N/A ASP 143.A N ILE 140.A O no hydrogen 3.365 N/A GLY 145.A N ASP 143.A OD2 no hydrogen 3.092 N/A GLN 149.A NE2 ARG 144.A O no hydrogen 2.873 N/A GLN 149.A NE2 ILE 147.A O no hydrogen 2.821 N/A SER 153.A N ASP 151.A OD1 no hydrogen 3.142 N/A SER 153.A OG ASP 151.A OD1 no hydrogen 3.122 N/A SER 153.A OG ASP 151.A OD2 no hydrogen 2.932 N/A MET 156.A N.A CYS 152.A O no hydrogen 2.965 N/A MET 156.A N.B CYS 152.A O no hydrogen 2.967 N/A SER 157.A N SER 153.A O no hydrogen 2.944 N/A SER 157.A OG.B SER 153.A O no hydrogen 3.391 N/A GLU 158.A N SER 154.A O no hydrogen 2.972 N/A LEU 159.A N LEU 155.A O no hydrogen 2.824 N/A SER 160.A N MET 156.A O.A no hydrogen 2.872 N/A SER 160.A N MET 156.A O.B no hydrogen 2.915 N/A SER 160.A OG.A MET 156.A O.A no hydrogen 2.826 N/A SER 160.A OG.A MET 156.A O.B no hydrogen 2.784 N/A GLY 161.A N SER 157.A O no hydrogen 2.967 N/A TYR 162.A N GLU 158.A O no hydrogen 3.152 N/A TYR 162.A OH GLU 158.A OE2 no hydrogen 2.600 N/A PHE 163.A N LEU 159.A O no hydrogen 3.159 N/A ASP 164.A N SER 160.A O no hydrogen 2.873 N/A ARG 165.A N GLY 161.A O no hydrogen 2.871 N/A ARG 165.A NE ASP 105.A OD1 no hydrogen 2.816 N/A ARG 165.A NE ASP 105.A OD2 no hydrogen 3.283 N/A ARG 165.A NH2 ASP 105.A OD2 no hydrogen 2.898 N/A ALA 166.A N TYR 162.A O no hydrogen 3.076 N/A ALA 167.A N PHE 163.A O no hydrogen 2.935 N/A ALA 168.A N ASP 164.A O no hydrogen 2.941 N/A ALA 169.A N ARG 165.A O no hydrogen 3.033 N/A ALA 169.A N ALA 166.A O no hydrogen 3.131 N/A