Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4jj4_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 2.A N ILE 211.A O no hydrogen 2.776 N/A GLY 4.A N GLU 7.A OE1.A no hydrogen 3.004 N/A GLY 6.A N LEU 52.A O no hydrogen 2.946 N/A GLU 7.A N GLY 4.A O no hydrogen 3.090 N/A LYS 8.A N ASP 83.A OD2 no hydrogen 2.706 N/A LYS 8.A NZ GLN 80.A O no hydrogen 2.743 N/A LEU 9.A N ARG 55.A O no hydrogen 2.772 N/A LEU 10.A N TRP 84.A O no hydrogen 2.872 N/A PHE 11.A N VAL 57.A O no hydrogen 2.808 N/A ILE 12.A N SER 86.A O no hydrogen 2.682 N/A ILE 16.A N ASP 14.A OD1 no hydrogen 3.021 N/A THR 17.A N ASP 14.A O no hydrogen 2.996 N/A THR 17.A OG1 TYR 37.A OH no hydrogen 2.641 N/A ASP 18.A N ASP 14.A O no hydrogen 2.920 N/A CYS 19.A N SER 15.A O no hydrogen 2.977 N/A CYS 19.A SG SER 15.A O no hydrogen 3.640 N/A CYS 19.A SG ILE 16.A O no hydrogen 3.245 N/A CYS 19.A SG HIS 200.A NE2 no hydrogen 3.368 N/A GLY 20.A N ASP 18.A OD1 no hydrogen 2.880 N/A ARG 21.A N ASP 18.A O no hydrogen 2.971 N/A ARG 21.A N ASP 18.A OD1 no hydrogen 3.177 N/A ARG 21.A NE GLY 60.A O no hydrogen 2.943 N/A ARG 21.A NH1 ALA 22.A O no hydrogen 2.776 N/A ARG 21.A NH1 PRO 24.A O no hydrogen 2.841 N/A ARG 21.A NH2 GLY 60.A O no hydrogen 3.278 N/A ALA 22.A N ALA 32.A O no hydrogen 2.734 N/A ARG 23.A NH2 ASP 18.A OD2 no hydrogen 2.831 N/A GLY 26.A N ALA 22.A O no hydrogen 2.720 N/A ALA 32.A N SER 29.A O no hydrogen 2.944 N/A GLY 34.A N GLY 31.A O no hydrogen 3.150 N/A THR 35.A N CYS 19.A O no hydrogen 2.921 N/A THR 35.A OG1 CYS 19.A O no hydrogen 3.328 N/A TYR 37.A OH THR 17.A OG1 no hydrogen 2.641 N/A TYR 40.A N GLY 36.A O no hydrogen 3.071 N/A VAL 41.A N TYR 37.A O no hydrogen 2.743 N/A VAL 42.A N VAL 38.A O no hydrogen 3.116 N/A GLY 43.A N ALA 39.A O no hydrogen 2.906 N/A LEU 44.A N TYR 40.A O no hydrogen 2.966 N/A LEU 45.A N VAL 41.A O no hydrogen 2.971 N/A GLN 46.A N VAL 42.A O no hydrogen 2.918 N/A ALA 47.A N GLY 43.A O no hydrogen 2.831 N/A VAL 48.A N LEU 44.A O no hydrogen 3.030 N/A TYR 49.A N LEU 45.A O no hydrogen 2.574 N/A GLU 51.A N GLU 51.A OE1 no hydrogen 2.746 N/A LEU 52.A N TYR 49.A O no hydrogen 2.999 N/A ARG 55.A N GLU 7.A O no hydrogen 2.959 N/A ARG 55.A NE GLU 27.A OE2 no hydrogen 2.492 N/A ARG 55.A NH2 GLU 27.A OE1 no hydrogen 3.221 N/A ARG 55.A NH2 GLU 27.A OE2 no hydrogen 3.132 N/A VAL 57.A N LEU 9.A O no hydrogen 2.885 N/A ASN 58.A N GLY 26.A O no hydrogen 2.719 N/A ASN 58.A ND2 THR 17.A O no hydrogen 2.683 N/A ASN 58.A ND2 LEU 33.A O no hydrogen 2.916 N/A LYS 59.A N PHE 11.A O no hydrogen 2.717 N/A LYS 59.A NZ PRO 24.A O no hydrogen 2.539 N/A GLY 60.A N ASN 58.A OD1 no hydrogen 2.763 N/A ILE 61.A N GLY 13.A O no hydrogen 2.948 N/A SER 62.A N ASP 18.A OD2 no hydrogen 2.845 N/A SER 62.A OG.B ASP 18.A OD2 no hydrogen 3.189 N/A ASN 64.A N ILE 61.A O no hydrogen 3.248 N/A THR 65.A N ASP 68.A OD2 no hydrogen 2.820 N/A THR 65.A OG1 ASP 68.A OD2 no hydrogen 3.203 N/A VAL 66.A N ASP 93.A OD1 no hydrogen 2.919 N/A ARG 67.A NE GLU 112.A OE2 no hydrogen 2.857 N/A ARG 67.A NH1 GLU 105.A O no hydrogen 2.732 N/A ARG 67.A NH2 GLU 105.A O no hydrogen 3.274 N/A ARG 67.A NH2 GLU 112.A OE1 no hydrogen 3.012 N/A ARG 67.A NH2 GLU 112.A OE2 no hydrogen 3.515 N/A ASP 68.A N THR 65.A OG1 no hydrogen 3.377 N/A LEU 69.A N THR 65.A O no hydrogen 3.173 N/A LYS 70.A N VAL 66.A O no hydrogen 2.957 N/A ALA 71.A N ARG 67.A O no hydrogen 3.251 N/A ARG 72.A N LEU 69.A O no hydrogen 3.220 N/A ARG 72.A NH1 LYS 59.A O no hydrogen 2.958 N/A ARG 72.A NH1 ASP 76.A OD2 no hydrogen 2.859 N/A ARG 72.A NH2 LYS 59.A O no hydrogen 2.993 N/A TRP 73.A N LYS 70.A O no hydrogen 3.401 N/A TRP 73.A NE1 THR 124.A OG1 no hydrogen 2.854 N/A ASP 76.A N ARG 72.A O no hydrogen 2.942 N/A VAL 77.A N TRP 73.A O no hydrogen 2.779 N/A ILE 78.A N TRP 73.A O no hydrogen 3.077 N/A ALA 79.A N GLU 74.A O no hydrogen 2.963 N/A GLN 80.A N VAL 77.A O no hydrogen 2.957 N/A LYS 81.A N ILE 78.A O no hydrogen 2.999 N/A ASP 83.A N LYS 8.A O no hydrogen 2.842 N/A TRP 84.A N LYS 8.A O no hydrogen 2.832 N/A TRP 84.A NE1 GLU 7.A OE1.A no hydrogen 2.704 N/A VAL 85.A N GLY 130.A O no hydrogen 3.048 N/A SER 86.A N LEU 10.A O no hydrogen 2.821 N/A ILE 87.A N ILE 132.A O no hydrogen 2.867 N/A MET 88.A N ILE 12.A O no hydrogen 3.067 N/A ASN 92.A ND2 ASN 64.A O no hydrogen 2.887 N/A VAL 94.A N GLY 90.A O no hydrogen 3.033 N/A TRP 95.A N ILE 91.A O no hydrogen 2.734 N/A ARG 96.A N ASN 92.A O no hydrogen 3.035 N/A ARG 96.A NE ASP 99.A OD1 no hydrogen 3.031 N/A ARG 96.A NH1 ASP 99.A OD2 no hydrogen 2.976 N/A ARG 96.A NH2 ASN 92.A OD1 no hydrogen 3.224 N/A GLN 97.A N VAL 94.A O no hydrogen 2.883 N/A GLN 97.A NE2 ASP 93.A O no hydrogen 3.114 N/A GLN 97.A NE2 TYR 154.A OH no hydrogen 2.959 N/A TYR 98.A N TRP 95.A O no hydrogen 2.787 N/A TYR 98.A OH THR 150.A OG1 no hydrogen 2.706 N/A ASP 99.A N TRP 95.A O no hydrogen 2.845 N/A LEU 100.A N ARG 96.A O no hydrogen 3.042 N/A MET 103.A N LEU 100.A O no hydrogen 3.117 N/A LYS 104.A NZ PRO 101.A O no hydrogen 3.334 N/A GLU 105.A N GLU 105.A OE1 no hydrogen 2.905 N/A LYS 106.A N MET 103.A O no hydrogen 2.980 N/A HIS 107.A N LYS 104.A O no hydrogen 3.034 N/A HIS 107.A ND1 TYR 109.A OH no hydrogen 2.666 N/A HIS 107.A NE2 LEU 100.A O no hydrogen 2.866 N/A TYR 113.A N TYR 109.A O no hydrogen 2.859 N/A TYR 113.A OH ILE 89.A O no hydrogen 2.666 N/A GLU 114.A N LEU 110.A O no hydrogen 2.808 N/A ALA 115.A N ASP 111.A O no hydrogen 3.210 N/A THR 116.A N GLU 112.A O no hydrogen 2.924 N/A THR 116.A OG1 GLU 112.A O no hydrogen 2.823 N/A LEU 117.A N TYR 113.A O no hydrogen 2.874 N/A ARG 118.A N GLU 114.A O no hydrogen 2.867 N/A ARG 118.A NE GLU 164.A OE1 no hydrogen 3.090 N/A ARG 118.A NE GLU 164.A OE2 no hydrogen 2.532 N/A ARG 118.A NH2 GLU 164.A OE2 no hydrogen 3.125 N/A SER 119.A N ALA 115.A O no hydrogen 2.927 N/A LEU 120.A N THR 116.A O no hydrogen 2.956 N/A VAL 121.A N LEU 117.A O no hydrogen 2.866 N/A LEU 122.A N ARG 118.A O no hydrogen 2.916 N/A GLU 123.A N SER 119.A O no hydrogen 3.057 N/A THR 124.A N LEU 120.A O no hydrogen 3.117 N/A THR 124.A OG1 LEU 120.A O no hydrogen 2.648 N/A LYS 125.A N VAL 121.A O no hydrogen 2.971 N/A LYS 125.A NZ THR 165.A O no hydrogen 2.824 N/A LEU 127.A N THR 124.A O no hydrogen 2.873 N/A VAL 128.A N LYS 125.A O no hydrogen 3.315 N/A LYS 129.A N ASP 83.A O no hydrogen 2.757 N/A LYS 129.A NZ GLU 7.A OE1.B no hydrogen 2.940 N/A LYS 129.A NZ GLU 7.A OE2.B no hydrogen 3.261 N/A GLY 130.A N ASP 83.A O no hydrogen 3.211 N/A ILE 132.A N VAL 85.A O no hydrogen 2.884 N/A LEU 133.A N LEU 168.A O no hydrogen 2.957 N/A MET 134.A N ILE 87.A O no hydrogen 2.846 N/A THR 135.A N VAL 170.A O no hydrogen 2.859 N/A THR 135.A OG1 PRO 136.A O no hydrogen 2.968 N/A THR 135.A OG1 THR 172.A OG1 no hydrogen 2.821 N/A ILE 139.A N ARG 192.A O no hydrogen 2.914 N/A ASN 142.A N GLU 140.A OE2 no hydrogen 3.073 N/A GLN 144.A N ASN 142.A OD1 no hydrogen 3.192 N/A ASP 145.A N ASN 142.A O no hydrogen 3.012 N/A MET 147.A N ASP 145.A OD2 no hydrogen 3.071 N/A ARG 148.A N ASP 145.A OD2 no hydrogen 3.375 N/A ARG 148.A NE ASP 152.A OD1 no hydrogen 2.858 N/A ARG 148.A NH1 GLU 140.A O no hydrogen 2.896 N/A ARG 148.A NH2 ASP 152.A OD1 no hydrogen 3.500 N/A ARG 149.A N ASP 145.A O no hydrogen 2.831 N/A ARG 149.A NH1.B GLN 144.A OE1 no hydrogen 3.093 N/A THR 150.A N PRO 146.A O no hydrogen 3.020 N/A THR 150.A OG1 TYR 98.A OH no hydrogen 2.706 N/A THR 150.A OG1 PRO 146.A O no hydrogen 2.953 N/A MET 151.A N MET 147.A O no hydrogen 2.795 N/A ASP 152.A N ARG 148.A O no hydrogen 2.744 N/A GLN 153.A N ARG 149.A O no hydrogen 3.146 N/A TYR 154.A N THR 150.A O no hydrogen 3.093 N/A TYR 154.A OH VAL 108.A O no hydrogen 2.622 N/A GLY 155.A N MET 151.A O no hydrogen 2.913 N/A ARG 156.A N ASP 152.A O no hydrogen 2.889 N/A VAL 157.A N GLN 153.A O no hydrogen 3.156 N/A VAL 158.A N TYR 154.A O no hydrogen 3.057 N/A LYS 159.A N GLY 155.A O no hydrogen 2.883 N/A GLN 160.A N ARG 156.A O no hydrogen 3.061 N/A ILE 161.A N VAL 157.A O no hydrogen 2.944 N/A ALA 162.A N VAL 158.A O no hydrogen 2.878 N/A GLU 163.A N LYS 159.A O no hydrogen 3.002 N/A GLU 164.A N GLN 160.A O no hydrogen 2.596 N/A THR 165.A N ILE 161.A O no hydrogen 2.907 N/A THR 165.A OG1 ILE 161.A O no hydrogen 2.621 N/A THR 165.A OG1 ALA 162.A O no hydrogen 3.511 N/A THR 165.A OG1 SER 167.A OG no hydrogen 2.935 N/A ASN 166.A N GLU 163.A O no hydrogen 2.908 N/A SER 167.A N ALA 162.A O no hydrogen 2.802 N/A SER 167.A OG THR 165.A OG1 no hydrogen 2.935 N/A LEU 168.A N ILE 131.A O no hydrogen 2.977 N/A PHE 169.A N GLU 210.A OE2 no hydrogen 3.475 N/A VAL 170.A N LEU 133.A O no hydrogen 2.950 N/A THR 172.A N THR 135.A OG1 no hydrogen 2.969 N/A THR 172.A OG1 THR 135.A O no hydrogen 2.596 N/A THR 172.A OG1 THR 135.A OG1 no hydrogen 2.821 N/A GLN 173.A N ASP 171.A OD1 no hydrogen 3.144 N/A GLN 173.A NE2 TYR 138.A O no hydrogen 3.311 N/A ALA 174.A N ASP 171.A OD1 no hydrogen 3.061 N/A ALA 175.A N ASP 171.A O no hydrogen 3.317 N/A PHE 176.A N THR 172.A O no hydrogen 3.096 N/A ASN 177.A N GLN 173.A O no hydrogen 2.823 N/A GLU 178.A N ALA 174.A O no hydrogen 3.225 N/A LEU 180.A N PHE 176.A O no hydrogen 2.942 N/A LYS 181.A N ASN 177.A O no hydrogen 3.241 N/A LYS 181.A N GLU 178.A O no hydrogen 3.275 N/A LYS 181.A NZ GLU 178.A OE1 no hydrogen 2.616 N/A LYS 181.A NZ GLU 178.A OE2 no hydrogen 3.286 N/A THR 182.A N VAL 179.A O no hydrogen 2.879 N/A LEU 183.A N VAL 179.A O no hydrogen 2.954 N/A ALA 187.A N TYR 184.A O no hydrogen 2.969 N/A LEU 188.A N PRO 185.A O no hydrogen 2.900 N/A TRP 190.A N HIS 194.A O no hydrogen 2.771 N/A ARG 192.A NH1 GLU 140.A OE1 no hydrogen 2.887 N/A ARG 192.A NH1 ASP 145.A OD1 no hydrogen 3.468 N/A VAL 193.A N TRP 190.A O no hydrogen 3.176 N/A HIS 194.A N TRP 190.A O no hydrogen 3.020 N/A SER 196.A N LEU 188.A O no hydrogen 3.035 N/A SER 196.A OG LEU 188.A O no hydrogen 3.009 N/A GLY 199.A N SER 196.A OG no hydrogen 3.095 N/A HIS 200.A N SER 196.A O no hydrogen 2.974 N/A MET 201.A N VAL 197.A O no hydrogen 2.803 N/A ILE 202.A N ALA 198.A O no hydrogen 2.855 N/A LEU 203.A N GLY 199.A O no hydrogen 3.121 N/A ALA 204.A N HIS 200.A O no hydrogen 2.904 N/A ARG 205.A N MET 201.A O no hydrogen 2.968 N/A ALA 206.A N ILE 202.A O no hydrogen 2.917 N/A PHE 207.A N LEU 203.A O no hydrogen 3.094 N/A LEU 208.A N ALA 204.A O no hydrogen 2.862 N/A ARG 209.A N ARG 205.A O no hydrogen 2.909 N/A GLU 210.A N ALA 206.A O no hydrogen 3.366 N/A GLU 210.A N PHE 207.A O no hydrogen 3.035 N/A ILE 211.A N PHE 207.A O no hydrogen 3.086 N/A GLY 212.A N ARG 209.A O no hydrogen 3.372 N/A PHE 213.A N LEU 208.A O no hydrogen 3.052 N/A GLU 214.A N TYR 49.A OH no hydrogen 2.753 N/A ARG 217.A NH1 VAL 48.A O no hydrogen 2.848 N/A ARG 217.A NH1 GLU 51.A OE1 no hydrogen 3.218 N/A ARG 217.A NH1 GLU 51.A OE2 no hydrogen 2.894 N/A ARG 217.A NH2 GLU 51.A OE2 no hydrogen 2.845 N/A SER 218.A OG GLU 214.A OE1 no hydrogen 3.468 N/A SER 218.A OG GLU 214.A OE2 no hydrogen 2.568 N/A