Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2ffx_J.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 5.A N SER 2.A O no hydrogen 3.405 N/A ARG 5.A NE TYR 8.A O no hydrogen 2.946 N/A ARG 5.A NH1 GLU 13.A OE2 no hydrogen 2.846 N/A ARG 5.A NH2 TYR 8.A O no hydrogen 3.023 N/A ARG 5.A NH2 GLU 13.A OE2 no hydrogen 2.729 N/A ASN 7.A ND2 THR 121.A O no hydrogen 3.123 N/A TYR 8.A OH GLN 69.A OE1 no hydrogen 2.655 N/A ASP 11.A N SER 9.A OG no hydrogen 2.952 N/A GLU 13.A N SER 9.A O no hydrogen 3.040 N/A ALA 14.A N THR 10.A O no hydrogen 3.052 N/A ALA 15.A N ASP 11.A O no hydrogen 2.916 N/A VAL 16.A N VAL 12.A O no hydrogen 2.763 N/A ASN 17.A N GLU 13.A O no hydrogen 3.152 N/A ASN 17.A ND2 ARG 75.A O no hydrogen 3.091 N/A SER 18.A N.A ALA 14.A O no hydrogen 3.006 N/A SER 18.A N.B ALA 14.A O no hydrogen 3.010 N/A SER 18.A OG.B ALA 14.A O no hydrogen 3.232 N/A LEU 19.A N ALA 15.A O no hydrogen 2.862 N/A VAL 20.A N VAL 16.A O no hydrogen 2.875 N/A ASN 21.A N ASN 17.A O no hydrogen 3.137 N/A ASN 21.A ND2 ASP 80.A O no hydrogen 3.051 N/A LEU 22.A N SER 18.A O.A no hydrogen 2.983 N/A LEU 22.A N SER 18.A O.B no hydrogen 2.988 N/A TYR 23.A N LEU 19.A O no hydrogen 2.890 N/A LEU 24.A N VAL 20.A O no hydrogen 2.925 N/A GLN 25.A N ASN 21.A O no hydrogen 3.008 N/A ALA 26.A N LEU 22.A O no hydrogen 2.958 N/A SER 27.A N TYR 23.A O no hydrogen 2.872 N/A SER 27.A OG ALA 55.A O no hydrogen 2.919 N/A TYR 28.A N LEU 24.A O no hydrogen 3.088 N/A THR 29.A N GLN 25.A O no hydrogen 2.991 N/A THR 29.A OG1 GLN 25.A O no hydrogen 3.252 N/A TYR 30.A N ALA 26.A O no hydrogen 3.029 N/A TYR 30.A OH GLU 103.A OE2 no hydrogen 2.472 N/A LEU 31.A N SER 27.A O no hydrogen 2.965 N/A SER 32.A N TYR 28.A O no hydrogen 3.069 N/A LEU 33.A N THR 29.A O no hydrogen 2.917 N/A GLY 34.A N TYR 30.A O no hydrogen 2.770 N/A PHE 35.A N LEU 31.A O no hydrogen 3.091 N/A TYR 36.A N SER 32.A O no hydrogen 3.014 N/A TYR 36.A OH GLY 90.A O no hydrogen 2.816 N/A PHE 37.A N LEU 33.A O no hydrogen 3.283 N/A ASP 38.A N PHE 35.A O no hydrogen 2.997 N/A ARG 39.A N TYR 36.A O no hydrogen 3.101 N/A ARG 39.A NE ASP 41.A OD2 no hydrogen 2.870 N/A ARG 39.A NH1 GLU 88.A OE1 no hydrogen 3.107 N/A ARG 39.A NH2 ASP 41.A OD1 no hydrogen 2.754 N/A ARG 39.A NH2 ASP 41.A OD2 no hydrogen 3.181 N/A VAL 42.A N ARG 39.A O no hydrogen 3.101 N/A ALA 43.A N ARG 39.A O no hydrogen 2.744 N/A LEU 44.A N PHE 37.A O no hydrogen 3.078 N/A GLY 46.A N GLU 167.A OE1 no hydrogen 2.828 N/A SER 48.A N LEU 44.A O no hydrogen 2.950 N/A SER 48.A OG GLY 34.A O no hydrogen 2.713 N/A HIS 49.A N.A GLU 45.A O no hydrogen 2.836 N/A HIS 49.A N.B GLU 45.A O no hydrogen 2.844 N/A PHE 50.A N GLY 46.A O no hydrogen 3.030 N/A PHE 51.A N VAL 47.A O no hydrogen 3.134 N/A ARG 52.A N SER 48.A O no hydrogen 2.933 N/A GLU 53.A N HIS 49.A O.A no hydrogen 2.967 N/A GLU 53.A N HIS 49.A O.B no hydrogen 2.901 N/A LEU 54.A N PHE 50.A O no hydrogen 3.239 N/A ALA 55.A N PHE 51.A O no hydrogen 2.971 N/A GLU 56.A N ARG 52.A O no hydrogen 3.279 N/A GLU 57.A N GLU 53.A O no hydrogen 3.030 N/A LYS 58.A N LEU 54.A O no hydrogen 2.936 N/A LYS 58.A NZ GLU 103.A OE1 no hydrogen 2.732 N/A ARG 59.A N.A ALA 55.A O no hydrogen 3.127 N/A ARG 59.A N.B ALA 55.A O no hydrogen 3.126 N/A ARG 59.A NH2.A GLU 63.A OE1 no hydrogen 2.686 N/A GLU 60.A N GLU 56.A O no hydrogen 3.056 N/A GLY 61.A N GLU 57.A O no hydrogen 3.091 N/A TYR 62.A N LYS 58.A O no hydrogen 3.014 N/A GLU 63.A N ARG 59.A O.A no hydrogen 2.952 N/A GLU 63.A N ARG 59.A O.B no hydrogen 2.968 N/A ARG 64.A N GLU 60.A O no hydrogen 2.979 N/A LEU 65.A N GLY 61.A O no hydrogen 3.058 N/A LEU 66.A N TYR 62.A O no hydrogen 2.913 N/A LYS 67.A N GLU 63.A O no hydrogen 2.980 N/A MET 68.A N ARG 64.A O no hydrogen 3.020 N/A GLN 69.A N LEU 65.A O no hydrogen 2.891 N/A GLN 69.A NE2 GLU 13.A O no hydrogen 3.154 N/A GLN 69.A NE2 ASN 17.A OD1 no hydrogen 3.053 N/A ASN 70.A N LEU 66.A O no hydrogen 3.209 N/A GLN 71.A N LYS 67.A O no hydrogen 2.952 N/A ARG 72.A N MET 68.A O no hydrogen 2.979 N/A ARG 72.A NH1 ASP 122.A OD1 no hydrogen 3.158 N/A ARG 72.A NH1 ASP 122.A OD2 no hydrogen 3.165 N/A ARG 72.A NH2 GLN 6.A O no hydrogen 3.065 N/A ARG 72.A NH2 ASN 7.A O no hydrogen 2.987 N/A ARG 72.A NH2 ASP 122.A OD2 no hydrogen 3.432 N/A GLY 73.A N ASN 70.A O no hydrogen 3.144 N/A GLY 74.A N GLN 69.A O no hydrogen 2.788 N/A ARG 75.A N GLU 13.A OE1 no hydrogen 2.749 N/A ARG 75.A NH1 GLY 74.A O no hydrogen 2.753 N/A LEU 77.A N ASN 17.A OD1 no hydrogen 3.229 N/A TRP 89.A NE1 SER 32.A OG no hydrogen 3.132 N/A LYS 91.A N ASP 94.A OD1 no hydrogen 2.774 N/A THR 92.A N GLU 163.A OE1 no hydrogen 2.777 N/A THR 92.A OG1 GLU 163.A OE1 no hydrogen 2.618 N/A ALA 95.A N LYS 91.A O no hydrogen 3.006 N/A MET 96.A N THR 92.A O no hydrogen 2.899 N/A LYS 97.A N PRO 93.A O no hydrogen 3.029 N/A ALA 98.A N ASP 94.A O no hydrogen 3.114 N/A ALA 99.A N ALA 95.A O no hydrogen 2.893 N/A MET 100.A N MET 96.A O no hydrogen 2.883 N/A ALA 101.A N LYS 97.A O no hydrogen 2.958 N/A LEU 102.A N ALA 98.A O no hydrogen 2.957 N/A GLU 103.A N ALA 99.A O no hydrogen 2.966 N/A LYS 104.A N MET 100.A O no hydrogen 3.017 N/A LYS 105.A N ALA 101.A O no hydrogen 3.050 N/A LEU 106.A N LEU 102.A O no hydrogen 2.930 N/A ASN 107.A N GLU 103.A O no hydrogen 2.793 N/A GLN 108.A N LYS 104.A O no hydrogen 2.966 N/A GLN 108.A NE2 ASP 112.A OD2 no hydrogen 2.750 N/A ALA 109.A N LYS 105.A O no hydrogen 3.023 N/A LEU 110.A N LEU 106.A O no hydrogen 2.923 N/A LEU 111.A N ASN 107.A O no hydrogen 2.918 N/A ASP 112.A N GLN 108.A O no hydrogen 2.847 N/A LEU 113.A N ALA 109.A O no hydrogen 2.967 N/A HIS 114.A N LEU 110.A O no hydrogen 2.905 N/A ALA 115.A N LEU 111.A O no hydrogen 2.946 N/A LEU 116.A N ASP 112.A O no hydrogen 2.951 N/A GLY 117.A N LEU 113.A O no hydrogen 2.871 N/A SER 118.A N HIS 114.A O no hydrogen 2.873 N/A ALA 119.A N ALA 115.A O no hydrogen 2.866 N/A ARG 120.A N.A LEU 116.A O no hydrogen 2.989 N/A ARG 120.A N.A GLY 117.A O no hydrogen 3.196 N/A ARG 120.A N.B LEU 116.A O no hydrogen 3.000 N/A ARG 120.A N.B GLY 117.A O no hydrogen 3.193 N/A ARG 120.A NE.A ASP 11.A OD1 no hydrogen 2.881 N/A ARG 120.A NH1.A ASP 11.A OD1 no hydrogen 2.622 N/A THR 121.A N SER 118.A O no hydrogen 3.063 N/A ASP 122.A N GLY 117.A O no hydrogen 2.858 N/A LEU 125.A N ASP 122.A OD1 no hydrogen 2.913 N/A CYS 126.A N.A ASP 122.A O no hydrogen 3.241 N/A CYS 126.A N.B ASP 122.A O no hydrogen 3.245 N/A CYS 126.A SG.A HIS 114.A NE2 no hydrogen 3.154 N/A CYS 126.A SG.B HIS 114.A O no hydrogen 4.038 N/A CYS 126.A SG.B ASP 122.A O no hydrogen 3.471 N/A ASP 127.A N PRO 123.A O no hydrogen 2.942 N/A PHE 128.A N HIS 124.A O no hydrogen 2.942 N/A LEU 129.A N LEU 125.A O no hydrogen 3.004 N/A GLU 130.A N CYS 126.A O.A no hydrogen 2.974 N/A GLU 130.A N CYS 126.A O.B no hydrogen 3.031 N/A THR 131.A N ASP 127.A O no hydrogen 2.906 N/A THR 131.A OG1 ASP 127.A O no hydrogen 2.769 N/A THR 131.A OG1 ASP 127.A OD1 no hydrogen 3.325 N/A HIS 132.A N PHE 128.A O no hydrogen 3.066 N/A PHE 133.A N LEU 129.A O no hydrogen 2.930 N/A LEU 134.A N LEU 129.A O no hydrogen 2.928 N/A GLU 137.A N PHE 133.A O no hydrogen 3.009 N/A VAL 138.A N LEU 134.A O no hydrogen 3.206 N/A LYS 139.A N ASP 135.A O no hydrogen 2.985 N/A LEU 140.A N GLU 136.A O no hydrogen 3.055 N/A ILE 141.A N GLU 137.A O no hydrogen 2.862 N/A LYS 142.A N VAL 138.A O no hydrogen 2.978 N/A LYS 142.A NZ ASP 146.A OD1 no hydrogen 2.961 N/A LYS 142.A NZ ASP 146.A OD2 no hydrogen 3.042 N/A LYS 143.A N LYS 139.A O no hydrogen 2.955 N/A MET 144.A N LEU 140.A O no hydrogen 2.911 N/A GLY 145.A N ILE 141.A O no hydrogen 2.884 N/A ASP 146.A N LYS 142.A O no hydrogen 2.941 N/A HIS 147.A N LYS 143.A O no hydrogen 2.968 N/A LEU 148.A N MET 144.A O no hydrogen 2.866 N/A THR 149.A N GLY 145.A O no hydrogen 2.992 N/A THR 149.A OG1 GLY 145.A O no hydrogen 3.232 N/A ASN 150.A N ASP 146.A O no hydrogen 3.067 N/A ASN 150.A ND2 ASP 146.A O no hydrogen 2.918 N/A LEU 151.A N HIS 147.A O no hydrogen 2.874 N/A HIS 152.A N LEU 148.A O no hydrogen 2.872 N/A ARG 153.A N THR 149.A O no hydrogen 2.959 N/A ARG 153.A NH1 ASN 150.A OD1 no hydrogen 3.088 N/A LEU 154.A N ASN 150.A O no hydrogen 2.974 N/A LEU 154.A N LEU 151.A O no hydrogen 3.133 N/A GLY 155.A N HIS 152.A O no hydrogen 3.223 N/A GLY 162.A N GLU 158.A O no hydrogen 3.118 N/A GLU 163.A N ALA 159.A O no hydrogen 2.750 N/A TYR 164.A N GLY 160.A O no hydrogen 3.107 N/A LEU 165.A N LEU 161.A O no hydrogen 2.983 N/A PHE 166.A N GLY 162.A O no hydrogen 2.916 N/A GLU 167.A N GLU 163.A O no hydrogen 3.207 N/A ARG 168.A N TYR 164.A O no hydrogen 2.984 N/A ARG 168.A NE GLU 167.A OE2 no hydrogen 2.754 N/A ARG 168.A NH2 GLU 167.A OE1 no hydrogen 2.806 N/A ARG 168.A NH2 GLU 167.A OE2 no hydrogen 3.487 N/A LEU 169.A N LEU 165.A O no hydrogen 2.687 N/A THR 170.A N PHE 166.A O no hydrogen 2.871 N/A LEU 171.A N PHE 166.A O no hydrogen 3.285 N/A HIS 173.A ND1 LEU 171.A O no hydrogen 2.997 N/A