Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8sqr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N GLU 66.A OE2 no hydrogen 3.463 N/A GLY 3.A N LEU 65.A O no hydrogen 2.918 N/A LYS 6.A NZ.A LYS 6.A O.A no hydrogen 3.035 N/A LYS 6.A NZ.A GLU 9.A OE1 no hydrogen 2.874 N/A ILE 8.A N GLU 4.A O no hydrogen 3.036 N/A GLU 9.A N PRO 5.A O no hydrogen 2.929 N/A ARG 10.A N LYS 6.A O.A no hydrogen 3.075 N/A ARG 10.A N LYS 6.A O.B no hydrogen 3.144 N/A ARG 10.A NE SER 103.A OG no hydrogen 2.645 N/A ARG 10.A NH2 SER 99.A O no hydrogen 3.130 N/A ARG 10.A NH2 SER 103.A OG no hydrogen 3.068 N/A LEU 11.A N VAL 7.A O no hydrogen 2.854 N/A ASN 12.A N ILE 8.A O no hydrogen 2.851 N/A ASN 12.A ND2 PHE 68.A O no hydrogen 3.085 N/A GLU 13.A N.A GLU 9.A O no hydrogen 2.891 N/A GLU 13.A N.B GLU 9.A O no hydrogen 2.902 N/A ALA 14.A N ARG 10.A O no hydrogen 2.988 N/A LEU 15.A N LEU 11.A O no hydrogen 2.883 N/A LEU 16.A N ASN 12.A O no hydrogen 3.039 N/A LEU 17.A N GLU 13.A O.A no hydrogen 3.134 N/A LEU 17.A N GLU 13.A O.B no hydrogen 3.174 N/A GLU 18.A N ALA 14.A O no hydrogen 2.820 N/A LEU 19.A N LEU 15.A O no hydrogen 2.850 N/A GLY 20.A N LEU 16.A O no hydrogen 2.956 N/A ALA 21.A N LEU 17.A O no hydrogen 2.971 N/A VAL 22.A N GLU 18.A O no hydrogen 2.842 N/A ASN 23.A N LEU 19.A O no hydrogen 3.103 N/A GLN 24.A N GLY 20.A O no hydrogen 2.888 N/A GLN 24.A NE2 ALA 88.A O no hydrogen 3.279 N/A TYR 25.A N ALA 21.A O no hydrogen 2.839 N/A TYR 25.A OH GLU 93.A OE2 no hydrogen 2.665 N/A TRP 26.A N VAL 22.A O no hydrogen 2.996 N/A LEU 27.A N ASN 23.A O no hydrogen 2.939 N/A HIS 28.A N GLN 24.A O no hydrogen 2.888 N/A HIS 28.A ND1 ASP 89.A OD1 no hydrogen 2.760 N/A TYR 29.A N TYR 25.A O no hydrogen 2.839 N/A ARG 30.A N TRP 26.A O no hydrogen 3.049 N/A LEU 31.A N.A LEU 27.A O no hydrogen 2.818 N/A LEU 31.A N.B LEU 27.A O no hydrogen 2.818 N/A LEU 32.A N HIS 28.A O no hydrogen 2.825 N/A ASN 33.A N TYR 29.A O no hydrogen 2.978 N/A ASP 34.A N ARG 30.A O no hydrogen 3.074 N/A TRP 35.A N LEU 31.A O.A no hydrogen 2.947 N/A TRP 35.A N LEU 31.A O.B no hydrogen 3.036 N/A GLY 36.A N ASN 33.A O no hydrogen 3.078 N/A TYR 37.A N LEU 32.A O no hydrogen 2.936 N/A ARG 39.A N ASN 152.A O no hydrogen 2.897 N/A ARG 39.A NE ALA 153.A O no hydrogen 3.136 N/A LEU 40.A N ASN 152.A O no hydrogen 3.442 N/A ALA 41.A N TYR 37.A O no hydrogen 2.933 N/A LYS 42.A N THR 38.A O no hydrogen 3.085 N/A LYS 43.A N ARG 39.A O no hydrogen 3.273 N/A LYS 43.A NZ GLU 46.A OE2 no hydrogen 3.460 N/A GLU 44.A N LEU 40.A O no hydrogen 2.953 N/A ARG 45.A N.A ALA 41.A O no hydrogen 2.928 N/A ARG 45.A N.B ALA 41.A O no hydrogen 2.923 N/A GLU 46.A N LYS 42.A O no hydrogen 3.007 N/A GLU 47.A N LYS 43.A O no hydrogen 2.904 N/A SER 48.A N GLU 44.A O no hydrogen 2.822 N/A SER 48.A OG VAL 22.A O no hydrogen 2.945 N/A ILE 49.A N ARG 45.A O.A no hydrogen 3.066 N/A ILE 49.A N ARG 45.A O.B no hydrogen 3.067 N/A GLU 50.A N GLU 46.A O no hydrogen 3.074 N/A GLU 51.A N GLU 47.A O no hydrogen 3.006 N/A MET 52.A N SER 48.A O no hydrogen 2.931 N/A HIS 53.A N ILE 49.A O no hydrogen 3.186 N/A HIS 54.A N GLU 50.A O no hydrogen 3.120 N/A HIS 54.A ND1 GLU 51.A OE1 no hydrogen 3.053 N/A HIS 54.A NE2 ASP 125.A OD2.B no hydrogen 3.134 N/A ALA 55.A N GLU 51.A O no hydrogen 2.891 N/A ASP 56.A N MET 52.A O no hydrogen 2.958 N/A LYS 57.A N HIS 53.A O no hydrogen 3.017 N/A LEU 58.A N HIS 54.A O no hydrogen 3.036 N/A ILE 59.A N ALA 55.A O no hydrogen 2.917 N/A ASP 60.A N ASP 56.A O no hydrogen 2.966 N/A ARG 61.A N LYS 57.A O no hydrogen 3.044 N/A ARG 61.A NE SER 115.A OG no hydrogen 2.855 N/A ARG 61.A NH2 ASP 112.A OD1 no hydrogen 3.002 N/A ARG 61.A NH2 SER 115.A OG no hydrogen 3.265 N/A ILE 62.A N LEU 58.A O no hydrogen 2.916 N/A ILE 63.A N ILE 59.A O no hydrogen 2.985 N/A PHE 64.A N ASP 60.A O no hydrogen 2.943 N/A LEU 65.A N ARG 61.A O no hydrogen 3.007 N/A GLU 66.A N ILE 63.A O no hydrogen 2.876 N/A GLY 67.A N ILE 62.A O no hydrogen 2.924 N/A ASN 70.A N ASN 12.A OD1 no hydrogen 2.928 N/A ASN 70.A ND2 GLN 72.A OE1 no hydrogen 3.159 N/A ARG 77.A N GLN 24.A OE1 no hydrogen 2.604 N/A GLN 80.A N GLU 84.A OE1 no hydrogen 2.847 N/A GLU 84.A N ASN 81.A OD1 no hydrogen 2.849 N/A VAL 85.A N ASN 81.A O no hydrogen 3.019 N/A LEU 86.A N VAL 82.A O.A no hydrogen 2.972 N/A LEU 86.A N VAL 82.A O.B no hydrogen 3.099 N/A GLU 87.A N LYS 83.A O no hydrogen 2.926 N/A ALA 88.A N GLU 84.A O no hydrogen 2.916 N/A ASP 89.A N VAL 85.A O no hydrogen 3.025 N/A LEU 90.A N LEU 86.A O no hydrogen 2.925 N/A LYS 91.A N GLU 87.A O no hydrogen 2.910 N/A GLY 92.A N ALA 88.A O no hydrogen 3.140 N/A GLU 93.A N ASP 89.A O no hydrogen 3.037 N/A TYR 94.A N LEU 90.A O no hydrogen 2.983 N/A TYR 94.A OH GLU 134.A OE2 no hydrogen 2.296 N/A ASP 95.A N LYS 91.A O no hydrogen 3.009 N/A ALA 96.A N GLY 92.A O no hydrogen 2.988 N/A ARG 97.A N GLU 93.A O no hydrogen 2.841 N/A ARG 97.A NE GLU 127.A OE2 no hydrogen 2.807 N/A ARG 97.A NH2 GLU 127.A OE2 no hydrogen 3.370 N/A ALA 98.A N TYR 94.A O no hydrogen 3.047 N/A SER 99.A N ASP 95.A O no hydrogen 3.117 N/A SER 99.A OG GLU 13.A OE2.A no hydrogen 2.812 N/A TYR 100.A N ALA 96.A O no hydrogen 2.838 N/A TYR 100.A OH GLU 18.A OE2 no hydrogen 2.632 N/A LYS 101.A N ARG 97.A O no hydrogen 2.994 N/A GLU 102.A N ALA 98.A O no hydrogen 3.212 N/A SER 103.A N SER 99.A O no hydrogen 2.920 N/A SER 103.A OG SER 99.A O no hydrogen 3.018 N/A ARG 104.A N TYR 100.A O no hydrogen 2.867 N/A ARG 104.A NE ASP 120.A OD1 no hydrogen 2.816 N/A ARG 104.A NH1 GLU 105.A OE2 no hydrogen 3.014 N/A ARG 104.A NH2 ASP 120.A OD1 no hydrogen 3.523 N/A ARG 104.A NH2 ASP 120.A OD2 no hydrogen 2.964 N/A GLU 105.A N LYS 101.A O no hydrogen 3.355 N/A ILE 106.A N GLU 102.A O no hydrogen 3.066 N/A CYS 107.A N SER 103.A O no hydrogen 2.938 N/A CYS 107.A SG SER 103.A O no hydrogen 3.376 N/A ASP 108.A N ARG 104.A O no hydrogen 2.945 N/A LYS 109.A N GLU 105.A O no hydrogen 2.974 N/A LEU 110.A N ILE 106.A O no hydrogen 3.000 N/A GLY 111.A N ASP 108.A O no hydrogen 3.073 N/A ASP 112.A N CYS 107.A O no hydrogen 2.917 N/A SER 115.A N ASP 112.A OD1 no hydrogen 3.000 N/A SER 115.A OG ASP 112.A OD1 no hydrogen 3.263 N/A SER 115.A OG ASP 112.A OD2 no hydrogen 2.690 N/A LYS 116.A N ASP 112.A O no hydrogen 2.977 N/A LYS 116.A NZ ASP 120.A OD2 no hydrogen 3.200 N/A GLN 117.A N TYR 113.A O no hydrogen 2.916 N/A LEU 118.A N VAL 114.A O no hydrogen 3.091 N/A PHE 119.A N SER 115.A O no hydrogen 3.075 N/A ASP 120.A N LYS 116.A O no hydrogen 2.870 N/A GLU 121.A N GLN 117.A O no hydrogen 2.973 N/A LEU 122.A N LEU 118.A O no hydrogen 2.987 N/A LEU 123.A N PHE 119.A O no hydrogen 2.787 N/A ALA 124.A N ASP 120.A O no hydrogen 3.007 N/A ASP 125.A N.A GLU 121.A O no hydrogen 3.021 N/A ASP 125.A N.B GLU 121.A O no hydrogen 3.039 N/A GLU 126.A N LEU 122.A O no hydrogen 2.833 N/A GLU 127.A N LEU 123.A O no hydrogen 2.974 N/A GLY 128.A N ALA 124.A O no hydrogen 3.043 N/A HIS 129.A N ASP 125.A O.A no hydrogen 2.965 N/A HIS 129.A N ASP 125.A O.B no hydrogen 3.001 N/A ILE 130.A N GLU 126.A O no hydrogen 2.814 N/A ASP 131.A N GLU 127.A O no hydrogen 2.868 N/A PHE 132.A N GLY 128.A O no hydrogen 3.038 N/A LEU 133.A N HIS 129.A O no hydrogen 2.881 N/A GLU 134.A N ILE 130.A O no hydrogen 2.797 N/A THR 135.A N ASP 131.A O no hydrogen 3.096 N/A THR 135.A OG1 ASP 131.A O no hydrogen 3.207 N/A GLN 136.A N PHE 132.A O no hydrogen 2.958 N/A LEU 137.A N LEU 133.A O no hydrogen 2.916 N/A ASP 138.A N GLU 134.A O no hydrogen 2.848 N/A LEU 139.A N THR 135.A O no hydrogen 2.833 N/A LEU 140.A N GLN 136.A O no hydrogen 2.897 N/A ALA 141.A N LEU 137.A O no hydrogen 2.973 N/A LYS 142.A N ASP 138.A O no hydrogen 2.996 N/A LYS 142.A NZ ASP 138.A OD1 no hydrogen 3.163 N/A LYS 142.A NZ ASP 138.A OD2 no hydrogen 3.272 N/A ILE 143.A N LEU 139.A O no hydrogen 2.869 N/A GLY 144.A N LEU 140.A O no hydrogen 2.835 N/A GLU 146.A N GLU 146.A OE1 no hydrogen 2.827 N/A ARG 147.A NE ILE 143.A O no hydrogen 2.794 N/A ARG 147.A NH2 ILE 143.A O no hydrogen 3.194 N/A TYR 148.A N GLY 144.A O no hydrogen 2.950 N/A TYR 148.A OH GLN 136.A OE1 no hydrogen 2.669 N/A GLY 149.A N GLY 145.A O no hydrogen 2.842 N/A GLN 150.A N GLU 146.A O no hydrogen 2.897 N/A LEU 151.A N ARG 147.A O no hydrogen 2.850 N/A ASN 152.A N TYR 148.A O no hydrogen 3.193 N/A ASN 152.A N GLY 149.A O no hydrogen 2.971 N/A ASN 152.A ND2 TYR 148.A O no hydrogen 3.031 N/A ALA 153.A N GLN 150.A O no hydrogen 3.181 N/A ALA 154.A N THR 38.A OG1 no hydrogen 3.221 N/A GLU 158.A N PRO 155.A O no hydrogen 3.135 N/A