Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4jzq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 1.A NE2 PRO 2.A O no hydrogen 2.945 N/A GLN 1.A NE2 TYR 65.A OH no hydrogen 3.097 N/A GLN 3.A NE2.B GLY 66.A O no hydrogen 2.625 N/A GLU 5.A N LEU 64.A O no hydrogen 2.885 N/A LEU 6.A N ASN 38.A O.A no hydrogen 2.801 N/A LEU 6.A N ASN 38.A O.B no hydrogen 2.945 N/A PHE 7.A N PHE 62.A O no hydrogen 2.856 N/A VAL 8.A N THR 40.A O no hydrogen 2.941 N/A LYS 9.A N SER 23.A OG no hydrogen 3.187 N/A ALA 10.A N VAL 42.A O no hydrogen 2.985 N/A GLY 11.A N LYS 16.A O no hydrogen 2.797 N/A SER 12.A N GLU 224.A OE1 no hydrogen 3.477 N/A SER 12.A N GLU 224.A OE2 no hydrogen 2.631 N/A SER 12.A OG GLU 224.A OE1 no hydrogen 2.814 N/A SER 12.A OG GLU 224.A OE2 no hydrogen 3.515 N/A GLY 14.A N GLY 11.A O no hydrogen 2.844 N/A ALA 15.A N ASP 13.A OD1 no hydrogen 2.850 N/A LYS 16.A N ASP 13.A OD1 no hydrogen 2.802 N/A LYS 16.A NZ ASP 221.A OD2 no hydrogen 3.499 N/A GLY 18.A N LYS 9.A O no hydrogen 2.929 N/A PHE 22.A N ASP 20.A OD1 no hydrogen 2.903 N/A SER 23.A N ASP 20.A OD2 no hydrogen 3.276 N/A SER 23.A OG ASP 20.A OD2 no hydrogen 2.634 N/A GLN 24.A N ASP 20.A O no hydrogen 3.155 N/A GLN 24.A NE2 PHE 215.A O no hydrogen 3.376 N/A GLN 24.A NE2 THR 218.A OG1 no hydrogen 2.982 N/A ARG 25.A N PRO 21.A O no hydrogen 2.990 N/A ARG 25.A NE GLU 77.A OE2 no hydrogen 2.782 N/A ARG 25.A NH2 ASN 74.A OD1 no hydrogen 3.232 N/A ARG 25.A NH2 GLU 77.A OE1 no hydrogen 3.025 N/A LEU 26.A N PHE 22.A O no hydrogen 3.183 N/A PHE 27.A N SER 23.A O no hydrogen 2.991 N/A MET 28.A N GLN 24.A O no hydrogen 2.914 N/A VAL 29.A N ARG 25.A O no hydrogen 2.975 N/A LEU 30.A N LEU 26.A O no hydrogen 2.986 N/A TRP 31.A N PHE 27.A O no hydrogen 2.944 N/A TRP 31.A NE1 GLU 213.A OE1.B no hydrogen 3.081 N/A LEU 32.A N MET 28.A O no hydrogen 2.909 N/A LYS 33.A N VAL 29.A O no hydrogen 2.976 N/A LYS 33.A N LEU 30.A O no hydrogen 3.268 N/A LYS 33.A NZ GLU 81.A O no hydrogen 3.516 N/A LYS 33.A NZ GLU 81.A OE1 no hydrogen 2.780 N/A LYS 33.A NZ LEU 84.A O no hydrogen 2.672 N/A LYS 33.A NZ PRO 90.A O no hydrogen 2.821 N/A GLY 34.A N TRP 31.A O no hydrogen 3.187 N/A ASN 38.A N.A VAL 4.A O no hydrogen 2.909 N/A ASN 38.A N.B VAL 4.A O no hydrogen 2.948 N/A THR 40.A N LEU 6.A O no hydrogen 2.834 N/A THR 40.A OG1 GLU 5.A OE2 no hydrogen 2.597 N/A THR 41.A OG1 ALA 15.A O no hydrogen 2.797 N/A VAL 42.A N VAL 8.A O no hydrogen 2.786 N/A LYS 45.A N ASP 43.A OD1 no hydrogen 3.001 N/A ARG 46.A N ASP 43.A O no hydrogen 2.906 N/A ARG 47.A NH2 GLY 58.A O no hydrogen 2.884 N/A VAL 51.A N THR 48.A OG1 no hydrogen 3.074 N/A GLN 52.A N THR 48.A O no hydrogen 2.999 N/A LYS 53.A N GLU 49.A O no hydrogen 2.951 N/A LEU 54.A N THR 50.A O no hydrogen 2.986 N/A CYS 55.A N VAL 51.A O no hydrogen 3.058 N/A CYS 55.A SG GLN 59.A O no hydrogen 3.920 N/A CYS 55.A SG GLN 59.A OE1 no hydrogen 3.483 N/A GLY 58.A N CYS 55.A O no hydrogen 2.878 N/A GLN 59.A N GLN 59.A OE1 no hydrogen 2.807 N/A PHE 62.A N PHE 7.A O no hydrogen 3.049 N/A LEU 63.A N HIS 70.A O no hydrogen 2.894 N/A LEU 64.A N GLU 5.A O no hydrogen 2.798 N/A TYR 65.A N GLU 68.A O no hydrogen 2.827 N/A GLY 66.A N GLN 3.A O no hydrogen 2.796 N/A GLU 68.A N TYR 65.A O no hydrogen 2.911 N/A HIS 70.A N LEU 63.A O no hydrogen 2.834 N/A HIS 70.A NE2 GLU 68.A OE1 no hydrogen 2.706 N/A ASN 74.A ND2 GLU 78.A OE2 no hydrogen 3.166 N/A LYS 75.A N ASP 72.A OD2 no hydrogen 3.297 N/A ILE 76.A N ASP 72.A O no hydrogen 2.797 N/A GLU 77.A N THR 73.A O no hydrogen 2.917 N/A GLU 78.A N ASN 74.A O no hydrogen 3.026 N/A PHE 79.A N LYS 75.A O no hydrogen 2.961 N/A LEU 80.A N ILE 76.A O no hydrogen 2.888 N/A GLU 81.A N GLU 77.A O no hydrogen 2.898 N/A ALA 82.A N GLU 78.A O no hydrogen 3.132 N/A VAL 83.A N PHE 79.A O no hydrogen 2.883 N/A LEU 84.A N LEU 80.A O no hydrogen 2.972 N/A CYS 85.A SG ALA 82.A O no hydrogen 3.571 N/A CYS 85.A SG VAL 83.A O no hydrogen 3.937 N/A CYS 85.A SG PRO 86.A O no hydrogen 3.858 N/A TYR 89.A N CYS 85.A O no hydrogen 3.119 N/A TYR 89.A OH GLN 1.A OE1 no hydrogen 2.737 N/A LEU 92.A N GLU 81.A OE1 no hydrogen 2.944 N/A LEU 92.A N GLU 81.A OE2 no hydrogen 3.182 N/A ALA 93.A N GLU 81.A OE2 no hydrogen 2.958 N/A LEU 95.A N ASP 165.A OD2 no hydrogen 2.690 N/A ASN 96.A N ASP 165.A OD1 no hydrogen 3.068 N/A ASN 96.A ND2 GLU 146.A OE1 no hydrogen 2.970 N/A ASN 96.A ND2 ASP 165.A OD1 no hydrogen 3.045 N/A SER 99.A N ASN 96.A O no hydrogen 2.931 N/A SER 99.A OG ASN 96.A O no hydrogen 3.412 N/A SER 99.A OG TYR 139.A OH no hydrogen 2.710 N/A SER 99.A OG LEU 164.A O no hydrogen 3.508 N/A SER 99.A OG ASP 165.A OD1 no hydrogen 2.753 N/A ASN 100.A N PRO 97.A O no hydrogen 2.982 N/A THR 101.A N GLU 98.A O no hydrogen 3.155 N/A THR 101.A OG1 GLU 98.A O no hydrogen 3.430 N/A ALA 102.A N GLU 98.A O no hydrogen 3.013 N/A LEU 104.A N THR 101.A O no hydrogen 3.188 N/A ILE 106.A N GLY 103.A O no hydrogen 3.107 N/A LYS 109.A N ASP 105.A O no hydrogen 3.365 N/A LYS 109.A NZ ASP 105.A OD2 no hydrogen 2.957 N/A PHE 110.A N ILE 106.A O no hydrogen 2.874 N/A SER 111.A N PHE 107.A O no hydrogen 2.853 N/A SER 111.A OG PHE 107.A O no hydrogen 2.976 N/A ALA 112.A N ALA 108.A O no hydrogen 3.075 N/A TYR 113.A N LYS 109.A O no hydrogen 3.078 N/A ILE 114.A N PHE 110.A O no hydrogen 2.945 N/A LYS 115.A N SER 111.A O no hydrogen 3.043 N/A ASN 116.A N ALA 112.A O no hydrogen 3.116 N/A ASN 116.A ND2 ASN 118.A O no hydrogen 2.919 N/A ASN 118.A N ASN 116.A OD1 no hydrogen 2.973 N/A ALA 120.A N ASN 118.A OD1 no hydrogen 2.955 N/A LEU 121.A N ASN 118.A O no hydrogen 3.129 N/A ASN 122.A N PRO 119.A O no hydrogen 3.338 N/A LEU 125.A N LEU 121.A O no hydrogen 3.073 N/A GLU 126.A N ASN 122.A O no hydrogen 2.871 N/A LYS 127.A N ASP 123.A O no hydrogen 3.019 N/A GLY 128.A N ASN 124.A O no hydrogen 2.896 N/A LEU 129.A N LEU 125.A O no hydrogen 3.057 N/A LEU 130.A N GLU 126.A O no hydrogen 2.870 N/A LYS 131.A N LYS 127.A O no hydrogen 2.830 N/A ALA 132.A N GLY 128.A O no hydrogen 3.088 N/A LEU 133.A N LEU 129.A O no hydrogen 2.928 N/A LYS 134.A N LEU 130.A O no hydrogen 2.841 N/A LYS 134.A NZ ASP 137.A OD2 no hydrogen 2.880 N/A VAL 135.A N LYS 131.A O no hydrogen 2.961 N/A LEU 136.A N ALA 132.A O no hydrogen 3.181 N/A ASP 137.A N LEU 133.A O no hydrogen 2.893 N/A ASN 138.A N LYS 134.A O no hydrogen 2.842 N/A TYR 139.A N VAL 135.A O no hydrogen 3.003 N/A TYR 139.A OH SER 99.A OG no hydrogen 2.710 N/A LEU 140.A N LEU 136.A O no hydrogen 2.929 N/A THR 141.A N ASP 137.A O no hydrogen 3.049 N/A THR 141.A OG1 ASP 137.A O no hydrogen 2.913 N/A THR 141.A OG1 ASN 138.A O no hydrogen 3.229 N/A SER 142.A N TYR 139.A O no hydrogen 3.115 N/A SER 142.A OG ASN 138.A O no hydrogen 2.698 N/A LEU 144.A N GLU 147.A OE2 no hydrogen 2.838 N/A GLU 147.A N LEU 144.A O no hydrogen 2.880 N/A GLU 150.A N GLU 150.A OE1 no hydrogen 2.679 N/A ASP 155.A N SER 152.A O no hydrogen 3.248 N/A ASP 155.A N SER 152.A OG no hydrogen 2.941 N/A GLY 157.A N THR 151.A OG1 no hydrogen 3.229 N/A VAL 158.A N ASP 155.A O no hydrogen 3.154 N/A SER 159.A N THR 141.A O no hydrogen 2.810 N/A SER 159.A OG GLU 147.A OE1 no hydrogen 2.706 N/A SER 159.A OG GLU 147.A OE2 no hydrogen 3.354 N/A ARG 161.A N SER 159.A OG no hydrogen 3.325 N/A ARG 161.A NE PHE 163.A O no hydrogen 2.975 N/A ARG 161.A NE LEU 164.A O no hydrogen 3.020 N/A ARG 161.A NH1 TYR 139.A O no hydrogen 3.542 N/A ARG 161.A NH1 SER 142.A O no hydrogen 2.750 N/A ARG 161.A NH1 SER 159.A OG no hydrogen 3.061 N/A ARG 161.A NH2 TYR 139.A O no hydrogen 2.897 N/A ARG 161.A NH2 LEU 164.A O no hydrogen 2.919 N/A LYS 162.A N ASN 167.A OD1 no hydrogen 2.927 N/A PHE 163.A N GLY 166.A O no hydrogen 2.936 N/A LEU 164.A N ASP 173.A OD1 no hydrogen 3.123 N/A THR 170.A N ASP 173.A OD2 no hydrogen 2.824 N/A THR 170.A OG1 ASP 173.A OD2 no hydrogen 3.261 N/A LEU 171.A N LEU 92.A O no hydrogen 2.881 N/A CYS 174.A N THR 170.A O no hydrogen 3.209 N/A CYS 174.A SG THR 170.A O no hydrogen 3.576 N/A ASN 175.A N LEU 171.A O no hydrogen 3.137 N/A LEU 176.A N ALA 172.A O no hydrogen 3.047 N/A LEU 177.A N ASP 173.A O no hydrogen 2.881 N/A LYS 179.A NZ ASN 175.A OD1 no hydrogen 3.258 N/A LEU 180.A N LEU 176.A O no hydrogen 2.916 N/A HIS 181.A N LEU 177.A O no hydrogen 2.911 N/A HIS 181.A ND1 TYR 210.A OH no hydrogen 2.525 N/A ILE 182.A N PRO 178.A O no hydrogen 3.280 N/A VAL 183.A N LYS 179.A O no hydrogen 2.984 N/A GLN 184.A N LEU 180.A O no hydrogen 2.962 N/A GLN 184.A NE2.B LEU 180.A O no hydrogen 3.195 N/A VAL 185.A N HIS 181.A O no hydrogen 3.032 N/A VAL 186.A N ILE 182.A O no hydrogen 2.884 N/A CYS 187.A N VAL 183.A O no hydrogen 2.918 N/A CYS 187.A SG VAL 183.A O no hydrogen 3.284 N/A LYS 188.A N GLN 184.A O no hydrogen 3.108 N/A LYS 189.A N VAL 185.A O no hydrogen 3.155 N/A TYR 190.A N VAL 186.A O no hydrogen 2.943 N/A TYR 190.A OH GLU 226.A O no hydrogen 2.645 N/A ARG 191.A N CYS 187.A O no hydrogen 3.002 N/A ARG 191.A NE TYR 113.A O no hydrogen 3.261 N/A ARG 191.A NH1 TYR 190.A O no hydrogen 3.349 N/A ARG 191.A NH1 LYS 234.A O no hydrogen 2.810 N/A ARG 191.A NH2 TYR 113.A O no hydrogen 3.094 N/A ARG 191.A NH2 LYS 234.A O no hydrogen 2.857 N/A PHE 193.A N CYS 187.A O no hydrogen 3.100 N/A PHE 199.A N PRO 196.A O no hydrogen 2.993 N/A ARG 200.A NH1 ASP 155.A OD1 no hydrogen 3.491 N/A ARG 200.A NH2 ASP 155.A OD1 no hydrogen 2.938 N/A VAL 202.A N ASP 137.A OD1 no hydrogen 2.919 N/A HIS 203.A N PHE 199.A O no hydrogen 3.067 N/A HIS 203.A NE2 ILE 195.A O no hydrogen 2.867 N/A ARG 204.A N ARG 200.A O no hydrogen 2.925 N/A ARG 204.A NH1 SER 159.A O no hydrogen 3.402 N/A ARG 204.A NH2 SER 159.A O no hydrogen 2.978 N/A TYR 205.A N GLY 201.A O no hydrogen 2.993 N/A TYR 205.A OH ASP 173.A OD1 no hydrogen 2.667 N/A LEU 206.A N VAL 202.A O no hydrogen 2.919 N/A SER 207.A N HIS 203.A O no hydrogen 2.974 N/A SER 207.A OG HIS 203.A O no hydrogen 3.000 N/A ASN 208.A N ARG 204.A O no hydrogen 2.883 N/A ASN 208.A ND2 ARG 204.A O no hydrogen 3.108 N/A ALA 209.A N TYR 205.A O no hydrogen 2.878 N/A TYR 210.A N LEU 206.A O no hydrogen 2.876 N/A TYR 210.A OH HIS 181.A ND1 no hydrogen 2.525 N/A ALA 211.A N SER 207.A O no hydrogen 3.159 N/A ARG 212.A N ALA 209.A O no hydrogen 2.958 N/A ARG 212.A NE GLU 214.A OE1 no hydrogen 2.868 N/A ARG 212.A NH2 GLU 214.A OE2 no hydrogen 2.969 N/A GLU 214.A N GLU 214.A OE1 no hydrogen 2.766 N/A PHE 215.A N ARG 212.A O no hydrogen 3.059 N/A ALA 216.A N ARG 212.A O no hydrogen 2.901 N/A SER 217.A N GLU 213.A O no hydrogen 2.841 N/A THR 218.A N PHE 215.A O no hydrogen 3.137 N/A THR 218.A OG1 GLU 214.A O no hydrogen 2.843 N/A THR 218.A OG1 PHE 215.A O no hydrogen 3.131 N/A CYS 219.A N ALA 216.A O no hydrogen 3.423 N/A CYS 219.A SG PHE 215.A O no hydrogen 3.397 N/A GLU 223.A N GLU 223.A OE1 no hydrogen 2.782 N/A GLU 224.A N ASP 221.A O no hydrogen 3.010 N/A ILE 225.A N ASP 221.A O no hydrogen 3.214 N/A GLU 226.A N ASP 222.A O no hydrogen 2.827 N/A LEU 227.A N GLU 223.A O no hydrogen 2.882 N/A ALA 228.A N GLU 224.A O no hydrogen 2.917 N/A TYR 229.A N ILE 225.A O no hydrogen 3.259 N/A TYR 229.A N GLU 226.A O no hydrogen 3.200 N/A GLU 230.A N LEU 227.A O no hydrogen 3.070 N/A GLN 231.A NE2 GLU 230.A OE2 no hydrogen 3.016 N/A VAL 232.A N TYR 229.A O no hydrogen 3.148 N/A ALA 233.A N TYR 229.A O no hydrogen 2.915 N/A LYS 234.A N ILE 114.A O no hydrogen 2.991 N/A LYS 237.A N SER 117.A O no hydrogen 2.968 N/A