Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8jjk_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N ASP 4.A OD2 no hydrogen 3.245 N/A SER 1.A N GLU 48.A OE2 no hydrogen 2.683 N/A SER 1.A OG GLN 3.A OE1 no hydrogen 3.003 N/A TYR 2.A OH GLU 33.A OE2 no hydrogen 2.604 N/A GLN 3.A N GLN 3.A OE1 no hydrogen 3.017 N/A ASP 4.A N SER 1.A O no hydrogen 3.076 N/A TYR 5.A N TYR 2.A O no hydrogen 2.929 N/A ILE 6.A N TYR 2.A O no hydrogen 3.085 N/A ASN 7.A N LEU 102.A O no hydrogen 2.914 N/A ASN 7.A ND2 ASP 101.A O no hydrogen 3.078 N/A CYS 8.A SG SER 9.A O no hydrogen 3.677 N/A ARG 10.A NE GLU 33.A OE2 no hydrogen 2.871 N/A ARG 10.A NH2 GLU 33.A OE1 no hydrogen 2.877 N/A ALA 12.A N SER 9.A OG no hydrogen 3.056 N/A LEU 13.A N SER 9.A O no hydrogen 2.784 N/A LEU 14.A N ARG 10.A O no hydrogen 2.872 N/A GLU 15.A N GLU 11.A O no hydrogen 3.096 N/A LYS 16.A N ALA 12.A O no hydrogen 3.090 N/A MET 17.A N LEU 13.A O no hydrogen 2.807 N/A ALA 18.A N LEU 14.A O no hydrogen 2.973 N/A GLU 19.A N LYS 16.A O no hydrogen 3.074 N/A LEU 20.A N LYS 16.A O no hydrogen 3.322 N/A LEU 20.A N MET 17.A O no hydrogen 3.036 N/A LEU 21.A N MET 17.A O no hydrogen 2.913 N/A ARG 25.A NH1 ASP 58.A OD2 no hydrogen 3.012 N/A LEU 26.A N PRO 22.A O no hydrogen 3.065 N/A THR 27.A N GLU 23.A O no hydrogen 2.899 N/A THR 27.A OG1 GLU 23.A O no hydrogen 3.168 N/A THR 27.A OG1 GLU 23.A OE1 no hydrogen 3.288 N/A HIS 28.A N LYS 24.A O no hydrogen 3.034 N/A HIS 28.A ND1 GLU 137.A OE2 no hydrogen 2.763 N/A HIS 28.A NE2 HIS 57.A NE2 no hydrogen 3.102 N/A CYS 29.A N ARG 25.A O no hydrogen 2.948 N/A CYS 29.A SG ARG 25.A O no hydrogen 3.473 N/A LEU 30.A N LEU 26.A O no hydrogen 2.894 N/A GLY 31.A N THR 27.A O no hydrogen 2.899 N/A VAL 32.A N HIS 28.A O no hydrogen 2.838 N/A GLU 33.A N CYS 29.A O no hydrogen 2.893 N/A ARG 34.A N.A LEU 30.A O no hydrogen 3.154 N/A ARG 34.A N.B LEU 30.A O no hydrogen 3.152 N/A ALA 35.A N GLY 31.A O no hydrogen 2.943 N/A ALA 36.A N VAL 32.A O no hydrogen 2.760 N/A MET 37.A N.A GLU 33.A O no hydrogen 3.183 N/A MET 37.A N.B GLU 33.A O no hydrogen 3.180 N/A GLU 38.A N ARG 34.A O.A no hydrogen 3.161 N/A GLU 38.A N ARG 34.A O.B no hydrogen 3.152 N/A LEU 39.A N ALA 35.A O no hydrogen 2.982 N/A ALA 40.A N ALA 36.A O no hydrogen 2.846 N/A GLN 41.A N MET 37.A O.A no hydrogen 2.940 N/A GLN 41.A N MET 37.A O.B no hydrogen 2.949 N/A ARG 42.A N GLU 38.A O no hydrogen 3.143 N/A ARG 42.A NH1 ALA 152.A O no hydrogen 3.080 N/A PHE 43.A N LEU 39.A O no hydrogen 2.987 N/A VAL 45.A N ALA 40.A O no hydrogen 3.015 N/A GLU 48.A N ASP 46.A OD1 no hydrogen 2.828 N/A LYS 49.A N ASP 46.A OD1 no hydrogen 3.177 N/A LYS 49.A NZ ASP 106.A OD1 no hydrogen 2.914 N/A LYS 49.A NZ ASP 106.A OD2 no hydrogen 3.048 N/A LYS 49.A NZ GLU 108.A OE1 no hydrogen 2.824 N/A ALA 50.A N ASP 46.A O no hydrogen 3.018 N/A SER 51.A N VAL 47.A O no hydrogen 2.946 N/A SER 51.A OG VAL 47.A O no hydrogen 2.888 N/A LEU 52.A N GLU 48.A O no hydrogen 3.007 N/A ALA 53.A N LYS 49.A O no hydrogen 2.970 N/A GLY 54.A N ALA 50.A O no hydrogen 2.827 N/A LEU 55.A N SER 51.A O no hydrogen 2.907 N/A LEU 56.A N LEU 52.A O no hydrogen 2.968 N/A HIS 57.A N GLY 54.A O no hydrogen 3.523 N/A HIS 57.A ND1 GLY 54.A O no hydrogen 2.735 N/A HIS 57.A NE2 HIS 28.A NE2 no hydrogen 3.102 N/A HIS 57.A NE2 ASP 134.A OD1 no hydrogen 3.013 N/A TYR 59.A N LEU 56.A O no hydrogen 2.948 N/A TYR 59.A OH ASP 101.A OD2 no hydrogen 2.764 N/A LYS 61.A N ASP 58.A O no hydrogen 3.023 N/A LEU 63.A N ALA 60.A O no hydrogen 3.152 N/A SER 64.A N GLU 67.A OE1 no hydrogen 2.825 N/A SER 64.A OG GLU 67.A OE1 no hydrogen 3.113 N/A GLU 67.A N SER 64.A OG no hydrogen 3.157 N/A PHE 68.A N SER 64.A O no hydrogen 3.144 N/A LEU 69.A N ASP 65.A O no hydrogen 2.960 N/A VAL 70.A N GLN 66.A O no hydrogen 2.944 N/A LEU 71.A N GLU 67.A O no hydrogen 3.016 N/A ILE 72.A N PHE 68.A O no hydrogen 2.859 N/A ASP 73.A N LEU 69.A O no hydrogen 3.107 N/A ARG 74.A N VAL 70.A O no hydrogen 2.866 N/A TYR 75.A N LEU 71.A O no hydrogen 3.010 N/A TYR 75.A OH GLU 100.A OE2 no hydrogen 2.422 N/A GLN 76.A N ASP 73.A O no hydrogen 3.033 N/A LEU 77.A N ILE 72.A O no hydrogen 2.905 N/A ASP 80.A N ASP 78.A OD1 no hydrogen 3.002 N/A LEU 81.A N ASP 78.A O no hydrogen 2.986 N/A LYS 82.A N PRO 79.A O no hydrogen 3.121 N/A LYS 82.A NZ ASP 73.A OD1 no hydrogen 2.975 N/A LYS 82.A NZ ASP 73.A OD2 no hydrogen 3.276 N/A ASN 83.A N ASP 80.A O no hydrogen 2.878 N/A ASN 83.A ND2 ASP 80.A OD1 no hydrogen 3.092 N/A TRP 84.A N LEU 81.A O no hydrogen 3.083 N/A TRP 84.A NE1 ASP 80.A OD2 no hydrogen 3.092 N/A ASN 86.A ND2 LYS 61.A O no hydrogen 2.901 N/A TRP 89.A N GLY 85.A O no hydrogen 2.849 N/A TRP 89.A NE1 LEU 81.A O no hydrogen 2.724 N/A HIS 90.A N ASN 86.A O no hydrogen 2.863 N/A HIS 90.A ND1 ASN 86.A O no hydrogen 2.841 N/A MET 92.A N.A VAL 88.A O no hydrogen 3.251 N/A MET 92.A N.B VAL 88.A O no hydrogen 3.245 N/A VAL 93.A N TRP 89.A O no hydrogen 2.761 N/A GLY 94.A N TRP 89.A O no hydrogen 2.886 N/A ILE 95.A N GLY 91.A O no hydrogen 3.437 N/A TYR 96.A N VAL 93.A O no hydrogen 3.113 N/A ILE 98.A N GLY 94.A O no hydrogen 3.033 N/A GLN 99.A N ILE 95.A O no hydrogen 2.905 N/A GLU 100.A N TYR 96.A O no hydrogen 2.984 N/A ASP 101.A N LYS 97.A O no hydrogen 2.896 N/A LEU 102.A N ILE 98.A O no hydrogen 2.905 N/A ASP 103.A N GLN 99.A O no hydrogen 2.947 N/A ILE 109.A N ASP 106.A OD2 no hydrogen 3.003 N/A LEU 110.A N ASP 106.A O no hydrogen 3.006 N/A ARG 111.A N SER 107.A O no hydrogen 2.927 N/A ARG 111.A NH1 GLU 114.A OE1 no hydrogen 3.079 N/A ALA 112.A N GLU 108.A O no hydrogen 3.081 N/A ILE 113.A N ILE 109.A O no hydrogen 3.096 N/A GLU 114.A N LEU 110.A O no hydrogen 2.904 N/A ILE 115.A N ARG 111.A O no hydrogen 3.171 N/A HIS 116.A N ILE 113.A O no hydrogen 3.253 N/A HIS 116.A ND1 ILE 113.A O no hydrogen 2.742 N/A HIS 116.A NE2 HIS 90.A NE2 no hydrogen 3.133 N/A THR 117.A OG1 HIS 116.A NE2 no hydrogen 3.182 N/A GLY 119.A N ILE 115.A O no hydrogen 2.764 N/A GLY 121.A N GLU 184.A OE2 no hydrogen 2.868 N/A THR 124.A N ASP 127.A OD2 no hydrogen 2.893 N/A ASP 127.A N THR 124.A OG1 no hydrogen 3.087 N/A LYS 128.A N THR 124.A O no hydrogen 2.981 N/A LYS 128.A NZ ASN 157.A OD1 no hydrogen 2.702 N/A VAL 129.A N ASP 125.A O no hydrogen 2.816 N/A ILE 130.A N LEU 126.A O no hydrogen 3.097 N/A TYR 131.A N ASP 127.A O no hydrogen 2.992 N/A TYR 131.A OH THR 164.A OG1 no hydrogen 2.677 N/A VAL 132.A N LYS 128.A O no hydrogen 2.950 N/A ALA 133.A N VAL 129.A O no hydrogen 2.781 N/A ASP 134.A N ILE 130.A O no hydrogen 3.022 N/A TYR 135.A N VAL 132.A O no hydrogen 2.883 N/A ILE 136.A N VAL 132.A O no hydrogen 3.112 N/A GLU 137.A N ALA 133.A O no hydrogen 3.027 N/A ASN 139.A N GLU 137.A OE1 no hydrogen 2.740 N/A ASN 139.A ND2 GLU 137.A OE1 no hydrogen 2.870 N/A ARG 140.A N GLU 137.A O no hydrogen 2.886 N/A ARG 140.A NE ASP 134.A O no hydrogen 3.051 N/A ARG 140.A NH2 ASP 134.A O no hydrogen 3.060 N/A VAL 145.A N PHE 142.A O no hydrogen 3.130 N/A ALA 148.A N GLY 144.A O no hydrogen 3.145 N/A ARG 149.A N VAL 145.A O no hydrogen 2.924 N/A ARG 149.A NE ILE 136.A O no hydrogen 3.030 N/A ARG 149.A NH2 ILE 136.A O no hydrogen 3.275 N/A ARG 149.A NH2 GLU 137.A O no hydrogen 2.927 N/A ARG 149.A NH2 ARG 140.A O no hydrogen 3.045 N/A GLU 150.A N ASP 146.A O no hydrogen 3.057 N/A ILE 151.A N VAL 147.A O no hydrogen 2.936 N/A ALA 152.A N ALA 148.A O no hydrogen 2.927 N/A SER 153.A N ARG 149.A O no hydrogen 3.107 N/A SER 153.A N GLU 150.A O no hydrogen 3.095 N/A SER 153.A OG GLU 150.A O no hydrogen 2.633 N/A LEU 154.A N ILE 151.A O no hydrogen 3.019 N/A SER 155.A N ILE 151.A O no hydrogen 2.905 N/A LYS 158.A N SER 155.A OG no hydrogen 3.048 N/A ALA 159.A N SER 155.A O no hydrogen 3.075 N/A VAL 160.A N LEU 156.A O no hydrogen 2.958 N/A ALA 161.A N ASN 157.A O no hydrogen 3.003 N/A TYR 162.A N LYS 158.A O no hydrogen 2.881 N/A GLU 163.A N ALA 159.A O no hydrogen 2.979 N/A THR 164.A N VAL 160.A O no hydrogen 2.961 N/A THR 164.A OG1 TYR 131.A OH no hydrogen 2.677 N/A THR 164.A OG1 VAL 160.A O no hydrogen 2.642 N/A ALA 165.A N ALA 161.A O no hydrogen 2.926 N/A ARG 166.A N TYR 162.A O no hydrogen 2.983 N/A ARG 166.A NE GLU 169.A OE1 no hydrogen 3.090 N/A ARG 166.A NH2 GLU 169.A OE1 no hydrogen 2.853 N/A THR 167.A N GLU 163.A O no hydrogen 2.947 N/A THR 167.A OG1 GLU 163.A O no hydrogen 2.945 N/A VAL 168.A N THR 164.A O no hydrogen 2.938 N/A GLU 169.A N ALA 165.A O no hydrogen 2.937 N/A TYR 170.A N ARG 166.A O no hydrogen 2.872 N/A LEU 171.A N THR 167.A O no hydrogen 2.854 N/A ALA 172.A N VAL 168.A O no hydrogen 3.041 N/A HIS 173.A N GLU 169.A O no hydrogen 2.860 N/A GLN 174.A N TYR 170.A O no hydrogen 2.920 N/A GLY 175.A N ALA 172.A O no hydrogen 3.251 N/A PHE 176.A N LEU 171.A O no hydrogen 3.010 N/A GLN 181.A NE2 GLY 119.A O no hydrogen 2.809 N/A THR 182.A N TYR 179.A O no hydrogen 2.988 N/A LEU 183.A N PRO 180.A O no hydrogen 2.930 N/A GLU 184.A N PRO 180.A O no hydrogen 3.282 N/A THR 185.A N GLN 181.A O no hydrogen 3.095 N/A THR 185.A OG1 VAL 118.A O no hydrogen 2.901 N/A THR 185.A OG1 GLN 181.A O no hydrogen 3.227 N/A TYR 186.A N THR 182.A O no hydrogen 2.875 N/A ASN 187.A N LEU 183.A O no hydrogen 2.840 N/A ALA 188.A N GLU 184.A O no hydrogen 3.084 N/A PHE 189.A N THR 185.A O no hydrogen 2.975 N/A PHE 189.A N TYR 186.A O no hydrogen 3.287 N/A VAL 190.A N TYR 186.A O no hydrogen 2.855 N/A TYR 192.A N PHE 189.A O no hydrogen 2.940 N/A LEU 193.A N VAL 190.A O no hydrogen 3.051 N/A LYS 194.A N HIS 191.A O no hydrogen 3.328 N/A