Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1qjb_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 2.A N GLU 5.A OE1 no hydrogen 3.266 N/A LEU 6.A N ASP 2.A O no hydrogen 2.868 N/A VAL 7.A N LYS 3.A O no hydrogen 3.066 N/A GLN 8.A N ASN 4.A O no hydrogen 3.151 N/A LYS 9.A N GLU 5.A O no hydrogen 3.024 N/A ALA 10.A N LEU 6.A O no hydrogen 2.876 N/A LYS 11.A N VAL 7.A O no hydrogen 3.042 N/A LYS 11.A NZ GLU 39.A OE2 no hydrogen 2.640 N/A LEU 12.A N GLN 8.A O no hydrogen 2.982 N/A ALA 13.A N LYS 9.A O no hydrogen 2.843 N/A GLU 14.A N ALA 10.A O no hydrogen 2.896 N/A GLN 15.A N LYS 11.A O no hydrogen 3.106 N/A GLN 15.A NE2 LYS 11.A O no hydrogen 3.047 N/A ALA 16.A N LEU 12.A O no hydrogen 2.970 N/A GLU 17.A N GLU 14.A O no hydrogen 3.026 N/A ARG 18.A N ALA 13.A O no hydrogen 2.911 N/A ARG 18.A NE ASP 21.A OD2 no hydrogen 2.897 N/A ARG 18.A NH2 ASP 21.A OD2 no hydrogen 2.932 N/A MET 22.A N ARG 18.A O no hydrogen 3.167 N/A ALA 23.A N TYR 19.A O no hydrogen 2.948 N/A ALA 24.A N ASP 20.A O no hydrogen 2.894 N/A CYS 25.A N ASP 21.A O no hydrogen 2.933 N/A CYS 25.A SG ASP 21.A O no hydrogen 3.257 N/A MET 26.A N MET 22.A O no hydrogen 3.144 N/A LYS 27.A N ALA 23.A O no hydrogen 2.796 N/A LYS 27.A NZ ASP 92.A OD1 no hydrogen 2.908 N/A SER 28.A N ALA 24.A O no hydrogen 3.090 N/A SER 28.A OG ALA 24.A O no hydrogen 3.095 N/A VAL 29.A N CYS 25.A O no hydrogen 2.915 N/A THR 30.A N MET 26.A O no hydrogen 2.954 N/A THR 30.A OG1 MET 26.A O no hydrogen 2.954 N/A GLU 31.A N LYS 27.A O no hydrogen 2.976 N/A GLN 32.A N VAL 29.A O no hydrogen 3.178 N/A GLY 33.A N THR 30.A O no hydrogen 2.984 N/A SER 37.A N GLU 40.A OE1 no hydrogen 2.976 N/A GLU 40.A N SER 37.A OG no hydrogen 3.269 N/A ARG 41.A N SER 37.A O no hydrogen 2.889 N/A ARG 41.A NH1 GLU 109.A OE2 no hydrogen 3.128 N/A ARG 41.A NH2 GLU 109.A OE2 no hydrogen 2.870 N/A ASN 42.A N ASN 38.A O no hydrogen 3.096 N/A ASN 42.A ND2 ASN 38.A OD1 no hydrogen 3.497 N/A LEU 43.A N GLU 39.A O no hydrogen 3.043 N/A LEU 44.A N GLU 40.A O no hydrogen 3.070 N/A SER 45.A N ARG 41.A O no hydrogen 3.038 N/A VAL 46.A N ASN 42.A O no hydrogen 2.840 N/A ALA 47.A N LEU 43.A O no hydrogen 3.047 N/A TYR 48.A N LEU 44.A O no hydrogen 3.011 N/A TYR 48.A OH ASP 92.A OD2 no hydrogen 2.836 N/A LYS 49.A N SER 45.A O no hydrogen 2.974 N/A ASN 50.A N VAL 46.A O no hydrogen 3.157 N/A ASN 50.A ND2 VAL 46.A O no hydrogen 2.866 N/A VAL 51.A N ALA 47.A O no hydrogen 3.123 N/A VAL 52.A N TYR 48.A O no hydrogen 2.858 N/A GLY 53.A N LYS 49.A O no hydrogen 2.809 N/A ALA 54.A N ASN 50.A O no hydrogen 3.214 N/A ARG 55.A NE GLU 85.A OE1 no hydrogen 2.940 N/A ARG 55.A NH1 VAL 51.A O no hydrogen 3.071 N/A ARG 56.A N VAL 52.A O no hydrogen 2.910 N/A ARG 56.A NE GLU 127.A OE1 no hydrogen 2.753 N/A ARG 56.A NH2 GLU 127.A OE1 no hydrogen 3.510 N/A ARG 56.A NH2 GLU 127.A OE2 no hydrogen 2.887 N/A SER 57.A N GLY 53.A O no hydrogen 2.960 N/A SER 58.A N ALA 54.A O no hydrogen 3.026 N/A SER 58.A OG ALA 54.A O no hydrogen 3.037 N/A TRP 59.A N ARG 55.A O no hydrogen 2.796 N/A TRP 59.A NE1 GLU 83.A OE1 no hydrogen 2.970 N/A ARG 60.A N ARG 56.A O no hydrogen 3.080 N/A VAL 61.A N SER 57.A O no hydrogen 3.331 N/A VAL 62.A N SER 58.A O no hydrogen 2.966 N/A SER 63.A N TRP 59.A O no hydrogen 2.792 N/A SER 64.A N ARG 60.A O no hydrogen 3.060 N/A ILE 65.A N VAL 61.A O no hydrogen 2.953 N/A GLU 66.A N VAL 62.A O no hydrogen 3.187 N/A GLN 67.A N SER 64.A O no hydrogen 3.064 N/A LYS 68.A N ILE 65.A O no hydrogen 2.969 N/A MET 74.A N LYS 71.A O no hydrogen 3.073 N/A ARG 76.A N GLN 72.A O no hydrogen 3.039 N/A ARG 76.A NE GLU 80.A OE2 no hydrogen 3.298 N/A GLU 77.A N GLN 73.A O no hydrogen 2.745 N/A TYR 78.A N MET 74.A O no hydrogen 2.945 N/A ARG 79.A N ALA 75.A O no hydrogen 2.893 N/A ARG 79.A NE GLU 66.A OE2 no hydrogen 3.455 N/A ARG 79.A NH1 GLU 83.A OE1 no hydrogen 3.001 N/A ARG 79.A NH2 GLU 66.A OE2 no hydrogen 3.257 N/A GLU 80.A N ARG 76.A O no hydrogen 3.047 N/A LYS 81.A N GLU 77.A O no hydrogen 3.174 N/A ILE 82.A N TYR 78.A O no hydrogen 3.000 N/A GLU 83.A N ARG 79.A O no hydrogen 2.941 N/A THR 84.A N GLU 80.A O no hydrogen 3.080 N/A THR 84.A OG1 GLU 80.A O no hydrogen 3.161 N/A GLU 85.A N LYS 81.A O no hydrogen 3.240 N/A LEU 86.A N ILE 82.A O no hydrogen 2.838 N/A ARG 87.A N GLU 83.A O no hydrogen 2.722 N/A ASP 88.A N THR 84.A O no hydrogen 2.838 N/A ILE 89.A N GLU 85.A O no hydrogen 2.988 N/A CYS 90.A N LEU 86.A O no hydrogen 2.969 N/A CYS 90.A SG LEU 86.A O no hydrogen 3.469 N/A CYS 90.A SG TYR 121.A O no hydrogen 3.738 N/A ASN 91.A N ARG 87.A O no hydrogen 2.822 N/A ASP 92.A N ASP 88.A O no hydrogen 2.936 N/A VAL 93.A N ILE 89.A O no hydrogen 3.023 N/A LEU 94.A N CYS 90.A O no hydrogen 2.772 N/A SER 95.A N ASN 91.A O no hydrogen 2.903 N/A LEU 96.A N ASP 92.A O no hydrogen 3.125 N/A LEU 97.A N VAL 93.A O no hydrogen 2.965 N/A GLU 98.A N LEU 94.A O no hydrogen 2.978 N/A LYS 99.A N SER 95.A O no hydrogen 2.802 N/A PHE 100.A N LEU 96.A O no hydrogen 2.921 N/A LEU 101.A N LEU 96.A O no hydrogen 3.126 N/A ILE 102.A N LEU 97.A O no hydrogen 2.840 N/A ALA 105.A N ILE 102.A O no hydrogen 2.895 N/A SER 106.A N GLU 35.A OE2 no hydrogen 3.379 N/A SER 106.A OG GLU 35.A OE1 no hydrogen 2.588 N/A SER 106.A OG GLU 35.A OE2 no hydrogen 3.461 N/A LYS 111.A N GLN 107.A O no hydrogen 3.030 N/A LYS 111.A NZ GLU 147.A OE2 no hydrogen 2.976 N/A VAL 112.A N ALA 108.A O no hydrogen 3.051 N/A PHE 113.A N GLU 109.A O no hydrogen 3.009 N/A TYR 114.A N SER 110.A O no hydrogen 2.840 N/A LEU 115.A N LYS 111.A O no hydrogen 2.800 N/A LYS 116.A N VAL 112.A O no hydrogen 2.855 N/A LYS 116.A NZ ASP 120.A OD2 no hydrogen 2.824 N/A MET 117.A N PHE 113.A O no hydrogen 3.105 N/A LYS 118.A N TYR 114.A O no hydrogen 2.959 N/A LYS 118.A NZ GLU 98.A OE1 no hydrogen 2.675 N/A LYS 118.A NZ GLU 98.A OE2 no hydrogen 3.484 N/A GLY 119.A N LEU 115.A O no hydrogen 2.943 N/A ASP 120.A N LYS 116.A O no hydrogen 2.827 N/A TYR 121.A N MET 117.A O no hydrogen 2.973 N/A TYR 122.A N LYS 118.A O no hydrogen 3.123 N/A ARG 123.A N GLY 119.A O no hydrogen 2.932 N/A ARG 123.A NE TYR 145.A OH no hydrogen 2.792 N/A ARG 123.A NH2 ASP 120.A OD1 no hydrogen 2.943 N/A ARG 123.A NH2 TYR 145.A OH no hydrogen 3.408 N/A TYR 124.A N ASP 120.A O no hydrogen 2.846 N/A LEU 125.A N TYR 121.A O no hydrogen 3.112 N/A ALA 126.A N TYR 122.A O no hydrogen 2.799 N/A GLU 127.A N ARG 123.A O no hydrogen 3.074 N/A VAL 128.A N LEU 125.A O no hydrogen 3.082 N/A ALA 129.A N ALA 126.A O no hydrogen 3.349 N/A LYS 134.A NZ GLU 176.A O no hydrogen 3.129 N/A ILE 137.A N LYS 135.A O no hydrogen 2.466 N/A VAL 138.A N LYS 135.A O no hydrogen 2.925 N/A SER 141.A N ILE 137.A O no hydrogen 3.039 N/A SER 141.A OG GLY 119.A O no hydrogen 2.709 N/A GLN 142.A N VAL 138.A O no hydrogen 2.951 N/A GLN 143.A N ASP 139.A O no hydrogen 3.131 N/A ALA 144.A N GLN 140.A O no hydrogen 3.261 N/A TYR 145.A N SER 141.A O no hydrogen 3.055 N/A TYR 145.A OH ASP 120.A OD1 no hydrogen 2.620 N/A GLN 146.A N GLN 142.A O no hydrogen 2.797 N/A GLN 146.A NE2 GLU 150.A OE2 no hydrogen 2.866 N/A GLU 147.A N GLN 143.A O no hydrogen 3.028 N/A ALA 148.A N ALA 144.A O no hydrogen 3.055 N/A PHE 149.A N TYR 145.A O no hydrogen 2.768 N/A GLU 150.A N GLN 146.A O no hydrogen 3.095 N/A ILE 151.A N GLU 147.A O no hydrogen 2.980 N/A SER 152.A N ALA 148.A O no hydrogen 2.882 N/A SER 152.A OG ALA 148.A O no hydrogen 3.430 N/A SER 152.A OG PHE 149.A O no hydrogen 2.863 N/A LYS 153.A N PHE 149.A O no hydrogen 2.934 N/A LYS 154.A N GLU 150.A O no hydrogen 3.129 N/A GLU 155.A N ILE 151.A O no hydrogen 2.913 N/A MET 156.A N SER 152.A O no hydrogen 3.013 N/A THR 159.A OG1 THR 201.A OG1 no hydrogen 3.049 N/A HIS 160.A N GLN 157.A O no hydrogen 3.062 N/A ILE 162.A N HIS 160.A ND1 no hydrogen 3.147 N/A ARG 163.A NH1 MET 156.A O no hydrogen 2.806 N/A LEU 164.A N HIS 160.A O no hydrogen 2.931 N/A GLY 165.A N PRO 161.A O no hydrogen 2.833 N/A LEU 166.A N ILE 162.A O no hydrogen 3.115 N/A ALA 167.A N ARG 163.A O no hydrogen 2.949 N/A LEU 168.A N LEU 164.A O no hydrogen 2.889 N/A ASN 169.A N GLY 165.A O no hydrogen 2.981 N/A ASN 169.A ND2 ASP 120.A OD1 no hydrogen 2.851 N/A ASN 169.A ND2 ASP 120.A OD2 no hydrogen 3.290 N/A PHE 170.A N LEU 166.A O no hydrogen 2.782 N/A SER 171.A N ALA 167.A O no hydrogen 2.971 N/A SER 171.A OG ALA 184.A O no hydrogen 2.739 N/A VAL 172.A N LEU 168.A O no hydrogen 2.984 N/A PHE 173.A N ASN 169.A O no hydrogen 2.874 N/A TYR 174.A N PHE 170.A O no hydrogen 2.990 N/A TYR 175.A N SER 171.A O no hydrogen 3.018 N/A GLU 176.A N VAL 172.A O no hydrogen 2.830 N/A ILE 177.A N PHE 173.A O no hydrogen 2.892 N/A LEU 178.A N PHE 173.A O no hydrogen 3.042 N/A SER 180.A N TYR 174.A O no hydrogen 2.905 N/A ALA 184.A N SER 180.A O no hydrogen 3.054 N/A CYS 185.A N PRO 181.A O no hydrogen 2.943 N/A CYS 185.A SG PRO 181.A O no hydrogen 3.277 N/A SER 186.A N GLU 182.A O no hydrogen 2.980 N/A LEU 187.A N LYS 183.A O no hydrogen 2.949 N/A ALA 188.A N ALA 184.A O no hydrogen 2.971 N/A LYS 189.A N CYS 185.A O no hydrogen 2.748 N/A LYS 189.A NZ ASP 193.A OD2 no hydrogen 2.941 N/A THR 190.A N SER 186.A O no hydrogen 3.159 N/A THR 190.A OG1 SER 186.A O no hydrogen 3.051 N/A ALA 191.A N LEU 187.A O no hydrogen 3.031 N/A PHE 192.A N ALA 188.A O no hydrogen 2.943 N/A ASP 193.A N LYS 189.A O no hydrogen 2.810 N/A GLU 194.A N THR 190.A O no hydrogen 2.982 N/A ALA 195.A N ALA 191.A O no hydrogen 3.260 N/A ILE 196.A N PHE 192.A O no hydrogen 2.824 N/A ALA 197.A N ASP 193.A O no hydrogen 3.135 N/A GLU 198.A N ALA 195.A O no hydrogen 3.011 N/A THR 201.A N GLU 198.A O no hydrogen 2.776 N/A THR 201.A OG1 THR 159.A OG1 no hydrogen 3.049 N/A THR 201.A OG1 GLU 198.A O no hydrogen 2.917 N/A LEU 202.A N LEU 199.A O no hydrogen 3.058 N/A SER 206.A N SER 203.A OG no hydrogen 3.306 N/A TYR 207.A N SER 203.A O no hydrogen 3.104 N/A SER 210.A N SER 206.A O no hydrogen 2.835 N/A SER 210.A OG THR 159.A O no hydrogen 2.533 N/A SER 210.A OG SER 206.A O no hydrogen 3.391 N/A THR 211.A N TYR 207.A O no hydrogen 3.200 N/A LEU 212.A N LYS 208.A O no hydrogen 3.061 N/A ILE 213.A N ASP 209.A O no hydrogen 3.003 N/A MET 214.A N SER 210.A O no hydrogen 2.993 N/A GLN 215.A N THR 211.A O no hydrogen 3.148 N/A GLN 215.A NE2 ASP 219.A OD1 no hydrogen 3.265 N/A LEU 216.A N LEU 212.A O no hydrogen 3.191 N/A LEU 217.A N ILE 213.A O no hydrogen 2.872 N/A ARG 218.A N MET 214.A O no hydrogen 3.049 N/A ASP 219.A N GLN 215.A O no hydrogen 2.780 N/A ASN 220.A N LEU 216.A O no hydrogen 2.920 N/A LEU 221.A N LEU 217.A O no hydrogen 2.891 N/A THR 222.A N ARG 218.A O no hydrogen 2.917 N/A THR 222.A OG1 ARG 218.A O no hydrogen 3.223 N/A LEU 223.A N ASP 219.A O no hydrogen 2.833 N/A TRP 224.A N ASN 220.A O no hydrogen 2.686 N/A THR 225.A N THR 222.A O no hydrogen 3.156 N/A