Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8j2k_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 3.A OG.B GLU 26.A OE2 no hydrogen 2.833 N/A THR 4.A N GLY 27.A O no hydrogen 2.889 N/A PHE 6.A N GLY 25.A O no hydrogen 3.026 N/A LYS 7.A N TYR 106.A O no hydrogen 2.835 N/A PHE 8.A N GLY 23.A O no hydrogen 2.882 N/A GLN 9.A N ASN 108.A O no hydrogen 3.054 N/A LEU 10.A N VAL 21.A O no hydrogen 2.849 N/A LYS 11.A N VAL 110.A O no hydrogen 3.049 N/A GLY 12.A N PHE 19.A O no hydrogen 2.892 N/A THR 13.A N PHE 112.A O no hydrogen 3.016 N/A ILE 14.A N LYS 17.A O no hydrogen 2.925 N/A ASN 15.A N GLY 114.A O no hydrogen 2.869 N/A ASN 15.A ND2 PHE 117.A O no hydrogen 3.012 N/A LYS 17.A N ILE 14.A O no hydrogen 2.933 N/A PHE 19.A N GLY 12.A O no hydrogen 2.944 N/A THR 20.A N SER 42.A OG no hydrogen 3.037 N/A THR 20.A OG1 THR 41.A OG1 no hydrogen 2.736 N/A VAL 21.A N LEU 10.A O no hydrogen 2.996 N/A GLU 22.A N VAL 39.A O no hydrogen 3.007 N/A GLY 23.A N PHE 8.A O no hydrogen 2.818 N/A GLU 24.A N LYS 37.A O no hydrogen 3.048 N/A GLY 25.A N PHE 6.A O no hydrogen 3.189 N/A GLU 26.A N LYS 35.A O no hydrogen 3.057 N/A GLY 27.A N THR 4.A O no hydrogen 2.989 N/A ASN 28.A N SER 33.A O no hydrogen 2.854 N/A HIS 30.A N ASN 28.A OD1 no hydrogen 2.828 N/A GLU 31.A N ASN 28.A O no hydrogen 3.316 N/A GLU 31.A N ASN 28.A OD1 no hydrogen 3.170 N/A GLY 32.A N ASN 28.A O no hydrogen 2.897 N/A SER 33.A N ASN 28.A O no hydrogen 3.152 N/A HIS 34.A N GLU 208.A O no hydrogen 3.165 N/A LYS 35.A N GLU 26.A O no hydrogen 2.954 N/A GLY 36.A N GLN 206.A O no hydrogen 3.074 N/A LYS 37.A N GLU 24.A O no hydrogen 3.068 N/A LYS 37.A NZ ASP 196.A OD2 no hydrogen 2.935 N/A LYS 37.A NZ GLU 199.A OE2 no hydrogen 2.731 N/A TYR 38.A N ILE 204.A O no hydrogen 2.849 N/A VAL 39.A N GLU 22.A O no hydrogen 2.810 N/A CYS 40.A N ASP 202.A O no hydrogen 2.915 N/A CYS 40.A SG THR 20.A O no hydrogen 3.529 N/A CYS 40.A SG SER 42.A OG no hydrogen 3.239 N/A CYS 40.A SG GLY 43.A O no hydrogen 3.141 N/A THR 41.A N THR 20.A O no hydrogen 2.934 N/A THR 41.A OG1 THR 20.A OG1 no hydrogen 2.736 N/A LEU 45.A N ASP 202.A OD2 no hydrogen 2.815 N/A SER 48.A N VAL 123.A O no hydrogen 2.796 N/A TRP 49.A NE1 ASP 202.A OD1 no hydrogen 3.249 N/A ALA 51.A N SER 48.A OG no hydrogen 3.082 N/A LEU 52.A N TRP 49.A O no hydrogen 3.156 N/A GLY 53.A N ALA 50.A O no hydrogen 2.975 N/A THR 54.A OG1 GLN 167.A OE1 no hydrogen 3.092 N/A PHE 56.A N LEU 52.A O no hydrogen 3.080 N/A LYS 58.A NZ HIS 138.A NE2 no hydrogen 3.066 N/A TYR 59.A OH HIS 99.A ND1 no hydrogen 2.868 N/A TYR 60.A N MET 57.A O no hydrogen 3.112 N/A TYR 60.A OH THR 4.A O no hydrogen 2.790 N/A THR 61.A N LYS 58.A O no hydrogen 3.056 N/A THR 61.A OG1 LYS 58.A O no hydrogen 2.738 N/A LYS 62.A N LEU 210.A O no hydrogen 3.118 N/A TYR 63.A OH HIS 185.A NE2 no hydrogen 2.691 N/A LEU 67.A N PRO 64.A O no hydrogen 3.141 N/A LYS 68.A NZ ASP 181.A O no hydrogen 2.642 N/A ASN 69.A ND2 LYS 58.A O no hydrogen 3.533 N/A TRP 70.A NE1 PRO 180.A O no hydrogen 2.867 N/A HIS 72.A N ASN 69.A O no hydrogen 3.027 N/A HIS 72.A N ASN 69.A OD1 no hydrogen 3.234 N/A GLU 73.A N ASN 69.A O no hydrogen 2.894 N/A VAL 74.A N TRP 70.A O no hydrogen 3.059 N/A MET 75.A N HIS 72.A O no hydrogen 3.097 N/A GLU 77.A N GLU 77.A OE2.B no hydrogen 2.989 N/A GLY 78.A N VAL 74.A O no hydrogen 2.877 N/A PHE 79.A N HIS 99.A O no hydrogen 2.982 N/A THR 80.A N LYS 172.A O no hydrogen 2.814 N/A THR 80.A OG1 LYS 172.A O no hydrogen 3.352 N/A TYR 81.A N HIS 97.A O no hydrogen 2.995 N/A ASP 82.A N ILE 170.A O no hydrogen 2.830 N/A ARG 83.A N ALA 95.A O no hydrogen 2.873 N/A ARG 83.A NE THR 169.A OG1 no hydrogen 2.755 N/A ARG 83.A NH1 THR 54.A O no hydrogen 2.855 N/A ARG 83.A NH2 THR 169.A OG1 no hydrogen 3.417 N/A HIS 84.A N ASN 168.A O no hydrogen 2.921 N/A ILE 85.A N ILE 93.A O no hydrogen 2.875 N/A GLN 86.A N HIS 166.A O no hydrogen 2.932 N/A GLN 86.A NE2 TYR 87.A O no hydrogen 3.121 N/A GLN 86.A NE2 ASP 90.A O no hydrogen 3.075 N/A TYR 87.A N GLY 91.A O no hydrogen 2.912 N/A LYS 88.A N GLU 164.A O no hydrogen 2.877 N/A ASP 90.A N TYR 87.A O no hydrogen 2.947 N/A GLY 91.A N ASP 90.A OD1 no hydrogen 2.923 N/A SER 92.A N GLN 115.A O no hydrogen 2.956 N/A ILE 93.A N ILE 85.A O no hydrogen 2.836 N/A HIS 94.A N THR 113.A O no hydrogen 2.815 N/A HIS 94.A NE2 ASP 82.A OD1 no hydrogen 2.643 N/A ALA 95.A N ARG 83.A O no hydrogen 2.909 N/A LYS 96.A N GLU 111.A O no hydrogen 2.878 N/A HIS 97.A N TYR 81.A O no hydrogen 3.002 N/A HIS 97.A ND1 ASN 108.A OD1 no hydrogen 2.829 N/A GLN 98.A N ILE 109.A O no hydrogen 2.853 N/A HIS 99.A N PHE 79.A O no hydrogen 2.871 N/A HIS 99.A ND1 TYR 59.A OH no hydrogen 2.868 N/A PHE 100.A N HIS 107.A O no hydrogen 3.170 N/A MET 101.A N PRO 76.A O no hydrogen 3.122 N/A LYS 102.A N THR 105.A O no hydrogen 3.016 N/A THR 105.A N LYS 102.A O no hydrogen 3.028 N/A TYR 106.A N PRO 5.A O no hydrogen 2.958 N/A HIS 107.A N PHE 100.A O no hydrogen 2.825 N/A ASN 108.A N LYS 7.A O no hydrogen 3.008 N/A ASN 108.A ND2 SER 55.A O no hydrogen 3.161 N/A ASN 108.A ND2 PHE 56.A O no hydrogen 3.503 N/A ILE 109.A N GLN 98.A O no hydrogen 2.920 N/A VAL 110.A N GLN 9.A O no hydrogen 2.767 N/A GLU 111.A N LYS 96.A O no hydrogen 2.880 N/A PHE 112.A N LYS 11.A O no hydrogen 2.948 N/A THR 113.A N HIS 94.A O no hydrogen 2.914 N/A GLY 114.A N THR 13.A O no hydrogen 2.846 N/A GLN 115.A N SER 92.A O no hydrogen 2.833 N/A GLN 115.A NE2 ASP 116.A OD2 no hydrogen 3.418 N/A PHE 117.A N ASN 15.A OD1 no hydrogen 3.105 N/A LYS 118.A N ASP 90.A OD1 no hydrogen 2.914 N/A SER 121.A N LYS 118.A O no hydrogen 2.889 N/A SER 121.A OG ASP 90.A OD2 no hydrogen 2.598 N/A VAL 123.A N SER 121.A OG no hydrogen 3.066 N/A LEU 124.A N SER 121.A O no hydrogen 2.909 N/A THR 125.A N SER 121.A O no hydrogen 2.956 N/A THR 125.A OG1 SER 121.A O no hydrogen 3.304 N/A GLY 126.A N PRO 122.A O no hydrogen 2.985 N/A ASP 127.A N THR 125.A OG1 no hydrogen 3.355 N/A ASN 129.A N PRO 154.A O no hydrogen 2.822 N/A VAL 130.A N ASN 129.A OD1 no hydrogen 2.842 N/A SER 131.A N TYR 191.A OH no hydrogen 3.278 N/A SER 131.A OG TYR 191.A OH no hydrogen 2.765 N/A LEU 132.A N LEU 152.A O no hydrogen 2.925 N/A ALA 134.A N LYS 189.A O no hydrogen 3.052 N/A VAL 136.A N ILE 187.A O no hydrogen 2.886 N/A HIS 138.A N HIS 185.A O no hydrogen 2.884 N/A HIS 138.A ND1 VAL 136.A O no hydrogen 3.007 N/A ILE 139.A N GLU 146.A O no hydrogen 2.794 N/A ARG 141.A N GLY 144.A O no hydrogen 2.900 N/A ARG 141.A NE ASP 143.A OD1 no hydrogen 3.300 N/A ARG 141.A NH1 GLU 146.A OE2 no hydrogen 3.076 N/A GLY 144.A N ARG 141.A O no hydrogen 3.256 N/A VAL 145.A N CYS 171.A O no hydrogen 3.097 N/A GLU 146.A N ILE 139.A O no hydrogen 2.857 N/A CYS 147.A N THR 169.A O no hydrogen 2.844 N/A VAL 149.A N GLN 167.A O no hydrogen 2.859 N/A LEU 151.A N ALA 165.A O no hydrogen 2.856 N/A TYR 153.A N VAL 163.A O no hydrogen 2.888 N/A LEU 155.A N LYS 161.A O no hydrogen 2.910 N/A LEU 156.A N ASP 127.A OD1 no hydrogen 3.080 N/A SER 157.A N ASP 127.A OD1 no hydrogen 2.842 N/A SER 157.A OG ASP 127.A OD1 no hydrogen 3.339 N/A SER 157.A OG ASP 127.A OD2 no hydrogen 2.679 N/A SER 160.A N ASP 158.A OD1 no hydrogen 3.060 N/A SER 160.A OG ASP 158.A OD1 no hydrogen 2.789 N/A SER 160.A OG ASP 158.A OD2 no hydrogen 3.460 N/A LYS 161.A N ASP 158.A O no hydrogen 2.971 N/A VAL 163.A N TYR 153.A O no hydrogen 2.931 N/A ALA 165.A N LEU 151.A O no hydrogen 2.908 N/A HIS 166.A N GLN 86.A O no hydrogen 2.869 N/A HIS 166.A NE2.B GLU 164.A OE1 no hydrogen 2.643 N/A GLN 167.A N VAL 149.A O no hydrogen 2.849 N/A ASN 168.A N HIS 84.A O no hydrogen 2.860 N/A ASN 168.A ND2 GLU 146.A OE1 no hydrogen 3.500 N/A THR 169.A N CYS 147.A O no hydrogen 3.279 N/A ILE 170.A N ASP 82.A O no hydrogen 2.922 N/A CYS 171.A N VAL 145.A O no hydrogen 2.849 N/A LYS 172.A N THR 80.A O no hydrogen 3.349 N/A LYS 172.A NZ ASP 143.A OD2 no hydrogen 3.228 N/A LEU 174.A N GLY 78.A O no hydrogen 3.054 N/A HIS 175.A ND1 GLU 77.A OE2.A no hydrogen 2.622 N/A GLN 177.A N HIS 175.A O no hydrogen 2.834 N/A GLN 177.A NE2 ASN 176.A O no hydrogen 2.990 N/A HIS 185.A ND1 PRO 183.A O no hydrogen 2.726 N/A HIS 185.A NE2 TYR 63.A OH no hydrogen 2.691 N/A TRP 186.A N HIS 213.A O no hydrogen 3.070 N/A ILE 187.A N VAL 136.A O no hydrogen 2.989 N/A ARG 188.A N GLU 211.A O no hydrogen 2.824 N/A ARG 188.A NH1 GLU 135.A OE2 no hydrogen 2.954 N/A LYS 189.A N ALA 134.A O no hydrogen 2.916 N/A GLN 190.A N THR 209.A O no hydrogen 3.181 N/A TYR 191.A OH SER 131.A OG no hydrogen 2.765 N/A THR 192.A N SER 207.A O no hydrogen 2.849 N/A GLN 193.A NE2 TRP 49.A O no hydrogen 3.122 N/A GLN 193.A NE2 GLN 206.A OE1 no hydrogen 2.809 N/A SER 194.A N CYS 205.A O no hydrogen 2.920 N/A LYS 195.A NZ HIS 203.A O no hydrogen 2.773 N/A ASP 196.A N HIS 203.A NE2 no hydrogen 2.870 N/A THR 198.A N ASP 196.A OD1 no hydrogen 2.840 N/A THR 198.A OG1 ASP 196.A OD1 no hydrogen 2.662 N/A THR 198.A OG1 ASP 196.A OD2 no hydrogen 3.271 N/A GLU 199.A N ASP 196.A O no hydrogen 2.989 N/A ARG 201.A N GLU 199.A OE1 no hydrogen 3.051 N/A ARG 201.A NE GLU 199.A OE1 no hydrogen 2.800 N/A ARG 201.A NH2 GLU 199.A OE1 no hydrogen 3.485 N/A ARG 201.A NH2 GLU 199.A OE2 no hydrogen 3.014 N/A HIS 203.A ND1 ARG 201.A O no hydrogen 2.858 N/A ILE 204.A N TYR 38.A O no hydrogen 2.890 N/A CYS 205.A N SER 194.A O no hydrogen 2.779 N/A GLN 206.A N GLY 36.A O no hydrogen 2.935 N/A GLN 206.A NE2 GLY 53.A O no hydrogen 2.938 N/A GLN 206.A NE2 GLU 208.A OE1 no hydrogen 2.927 N/A SER 207.A N THR 192.A O no hydrogen 3.141 N/A GLU 208.A N HIS 34.A O no hydrogen 2.859 N/A THR 209.A N GLN 190.A O no hydrogen 2.899 N/A THR 209.A OG1 GLN 190.A O no hydrogen 3.490 N/A LEU 210.A N GLY 32.A O no hydrogen 2.854 N/A GLU 211.A N ARG 188.A O no hydrogen 2.984 N/A ALA 212.A N LYS 62.A O no hydrogen 2.968 N/A HIS 213.A N TRP 186.A O no hydrogen 2.895 N/A HIS 213.A ND1 LEU 214.A O no hydrogen 2.788 N/A HIS 213.A NE2 GLU 135.A OE1 no hydrogen 2.589 N/A