Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5q1h_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 4.A N GLN 7.A OE1 no hydrogen 3.221 N/A GLN 7.A N THR 4.A OG1 no hydrogen 3.201 N/A GLN 8.A N THR 4.A O no hydrogen 3.028 N/A THR 9.A N PRO 5.A O no hydrogen 3.092 N/A THR 9.A OG1 PRO 5.A O no hydrogen 3.325 N/A LEU 10.A N ASP 6.A O no hydrogen 2.957 N/A LEU 11.A N GLN 7.A O no hydrogen 2.841 N/A HIS 12.A N GLN 8.A O no hydrogen 2.921 N/A PHE 13.A N THR 9.A O no hydrogen 3.096 N/A ILE 14.A N LEU 10.A O no hydrogen 2.864 N/A MET 15.A N LEU 11.A O no hydrogen 2.992 N/A ASP 16.A N HIS 12.A O no hydrogen 3.072 N/A SER 17.A N PHE 13.A O no hydrogen 3.189 N/A SER 17.A OG PHE 13.A O no hydrogen 3.455 N/A TYR 18.A N ILE 14.A O no hydrogen 2.947 N/A TYR 18.A OH GLU 92.A OE1 no hydrogen 2.665 N/A ASN 19.A N MET 15.A O no hydrogen 3.035 N/A LYS 20.A N SER 17.A O no hydrogen 3.309 N/A GLN 21.A N TYR 18.A O no hydrogen 3.384 N/A GLN 21.A NE2 TYR 18.A O no hydrogen 2.834 N/A ARG 22.A NH1 GLU 47.A OE1 no hydrogen 2.773 N/A ARG 22.A NH1 GLU 47.A OE2 no hydrogen 3.567 N/A ARG 22.A NH2 GLU 47.A OE2 no hydrogen 2.982 N/A THR 28.A N PRO 24.A O no hydrogen 3.042 N/A THR 28.A OG1 GLN 25.A O no hydrogen 3.407 N/A ASN 29.A N GLN 25.A O no hydrogen 2.765 N/A ILE 31.A N ILE 27.A O no hydrogen 3.419 N/A LEU 32.A N THR 28.A O no hydrogen 2.802 N/A LYS 33.A N ASN 29.A O no hydrogen 2.842 N/A SER 37.A N GLU 40.A OE1 no hydrogen 2.925 N/A SER 37.A OG GLU 40.A OE1 no hydrogen 3.176 N/A GLU 40.A N SER 37.A OG no hydrogen 3.301 N/A ASN 41.A N SER 37.A O no hydrogen 3.064 N/A ASN 41.A ND2 PHE 36.A O no hydrogen 3.219 N/A ASN 41.A ND2 SER 113.A O no hydrogen 2.919 N/A PHE 42.A N ALA 38.A O no hydrogen 2.992 N/A ILE 44.A N GLU 40.A O no hydrogen 3.012 N/A LEU 45.A N ASN 41.A O no hydrogen 2.870 N/A THR 46.A N PHE 42.A O no hydrogen 2.978 N/A THR 46.A OG1 PHE 42.A O no hydrogen 3.405 N/A THR 46.A OG1 LEU 43.A O no hydrogen 3.009 N/A GLU 47.A N LEU 43.A O no hydrogen 3.100 N/A MET 48.A N ILE 44.A O no hydrogen 2.847 N/A ALA 49.A N LEU 45.A O no hydrogen 2.783 N/A THR 50.A N THR 46.A O no hydrogen 3.001 N/A THR 50.A OG1 THR 46.A O no hydrogen 2.723 N/A THR 50.A OG1 THR 220.A OG1 no hydrogen 3.050 N/A ASN 51.A N GLU 47.A O no hydrogen 3.108 N/A HIS 52.A N MET 48.A O no hydrogen 2.892 N/A VAL 53.A N ALA 49.A O no hydrogen 3.061 N/A GLN 54.A N THR 50.A O no hydrogen 3.148 N/A VAL 55.A N ASN 51.A O no hydrogen 3.052 N/A LEU 56.A N HIS 52.A O no hydrogen 2.789 N/A VAL 57.A N VAL 53.A O no hydrogen 2.870 N/A GLU 58.A N GLN 54.A O no hydrogen 3.450 N/A PHE 59.A N VAL 55.A O no hydrogen 2.938 N/A THR 60.A N LEU 56.A O no hydrogen 2.881 N/A THR 60.A OG1 LEU 56.A O no hydrogen 2.799 N/A LYS 61.A N VAL 57.A O no hydrogen 3.061 N/A LYS 61.A NZ GLU 58.A OE2 no hydrogen 3.254 N/A LYS 62.A NZ GLU 58.A O no hydrogen 3.279 N/A LEU 63.A N THR 60.A O no hydrogen 2.954 N/A PHE 66.A N LEU 63.A O no hydrogen 3.138 N/A THR 68.A N GLY 65.A O no hydrogen 3.133 N/A THR 68.A OG1 GLY 65.A O no hydrogen 2.712 N/A LEU 69.A N PHE 66.A O no hydrogen 3.142 N/A GLU 72.A N ASP 70.A OD2 no hydrogen 3.127 N/A ASP 73.A N ASP 70.A OD2 no hydrogen 3.372 N/A GLN 74.A N ASP 70.A O no hydrogen 2.930 N/A GLN 74.A NE2 PHE 66.A O no hydrogen 3.055 N/A GLN 74.A NE2 LEU 69.A O no hydrogen 3.195 N/A ILE 75.A N HIS 71.A O no hydrogen 3.218 N/A ALA 76.A N GLU 72.A O no hydrogen 3.133 N/A LEU 77.A N ASP 73.A O no hydrogen 2.871 N/A LEU 78.A N GLN 74.A O no hydrogen 3.109 N/A LYS 79.A N ILE 75.A O no hydrogen 2.815 N/A LYS 79.A NZ GLU 225.A O no hydrogen 3.200 N/A LYS 79.A NZ ASP 228.A OD1 no hydrogen 2.805 N/A GLY 80.A N ALA 76.A O no hydrogen 2.918 N/A SER 81.A N LEU 78.A O no hydrogen 3.316 N/A SER 81.A OG LEU 77.A O no hydrogen 2.913 N/A SER 81.A OG LEU 78.A O no hydrogen 3.408 N/A ALA 82.A N LEU 78.A O no hydrogen 3.135 N/A ALA 85.A N SER 81.A O no hydrogen 2.989 N/A MET 86.A N ALA 82.A O no hydrogen 3.034 N/A PHE 87.A N VAL 83.A O no hydrogen 3.041 N/A LEU 88.A N GLU 84.A O no hydrogen 2.960 N/A ARG 89.A N ALA 85.A O no hydrogen 2.932 N/A ARG 89.A NH1 GLU 92.A OE1 no hydrogen 2.807 N/A ARG 89.A NH2 ARG 22.A O no hydrogen 3.009 N/A SER 90.A N MET 86.A O no hydrogen 2.929 N/A SER 90.A OG MET 86.A O no hydrogen 2.707 N/A ALA 91.A N PHE 87.A O no hydrogen 2.965 N/A GLU 92.A N LEU 88.A O no hydrogen 3.024 N/A ILE 93.A N ARG 89.A O no hydrogen 3.044 N/A PHE 94.A N SER 90.A O no hydrogen 2.837 N/A ASN 95.A N ALA 91.A O no hydrogen 3.113 N/A ASN 95.A ND2 ALA 91.A O no hydrogen 2.745 N/A ASN 95.A ND2 TYR 127.A O no hydrogen 2.824 N/A LYS 96.A N ILE 93.A O no hydrogen 2.981 N/A HIS 102.A N PRO 99.A O no hydrogen 3.033 N/A LEU 105.A N GLY 101.A O no hydrogen 3.317 N/A LEU 106.A N HIS 102.A O no hydrogen 2.948 N/A GLU 107.A N SER 103.A O no hydrogen 2.995 N/A ALA 108.A N ASP 104.A O no hydrogen 2.977 N/A ARG 109.A N LEU 105.A O no hydrogen 2.775 N/A ARG 109.A NH1 ILE 31.A O no hydrogen 2.931 N/A ARG 109.A NH1 LEU 32.A O no hydrogen 2.813 N/A ILE 110.A N LEU 106.A O no hydrogen 2.928 N/A ARG 111.A N GLU 107.A O no hydrogen 2.835 N/A ASN 112.A N ALA 108.A O no hydrogen 3.025 N/A ASN 112.A ND2 ALA 108.A O no hydrogen 2.951 N/A SER 113.A N ILE 110.A O no hydrogen 3.296 N/A SER 113.A OG ILE 110.A O no hydrogen 2.807 N/A SER 116.A OG SER 211.A OG no hydrogen 3.102 N/A TYR 119.A N SER 116.A O no hydrogen 3.232 N/A ILE 120.A N SER 116.A O no hydrogen 3.176 N/A MET 123.A N TYR 119.A O no hydrogen 3.359 N/A PHE 124.A N ILE 120.A O no hydrogen 2.829 N/A SER 125.A N THR 121.A O no hydrogen 2.930 N/A PHE 126.A N PRO 122.A O no hydrogen 3.035 N/A TYR 127.A N MET 123.A O no hydrogen 3.146 N/A LYS 128.A N PHE 124.A O no hydrogen 3.022 N/A LYS 128.A NZ GLU 107.A OE1 no hydrogen 3.239 N/A LYS 128.A NZ GLU 107.A OE2 no hydrogen 2.925 N/A SER 129.A N SER 125.A O no hydrogen 3.055 N/A SER 129.A OG SER 125.A O no hydrogen 3.450 N/A SER 129.A OG PHE 126.A O no hydrogen 3.079 N/A ILE 130.A N PHE 126.A O no hydrogen 2.896 N/A GLY 131.A N TYR 127.A O no hydrogen 2.927 N/A GLU 132.A N LYS 128.A O no hydrogen 2.985 N/A LEU 133.A N ILE 130.A O no hydrogen 3.132 N/A LYS 134.A N GLY 131.A O no hydrogen 3.174 N/A THR 136.A N GLU 139.A OE1 no hydrogen 3.112 N/A GLN 137.A NE2 GLU 138.A OE2 no hydrogen 2.994 N/A GLU 138.A N GLU 138.A OE1 no hydrogen 2.868 N/A TYR 140.A N THR 136.A O no hydrogen 3.189 N/A ALA 141.A N GLN 137.A O no hydrogen 3.011 N/A LEU 142.A N GLU 138.A O no hydrogen 2.905 N/A LEU 143.A N GLU 139.A O no hydrogen 2.877 N/A THR 144.A N TYR 140.A O no hydrogen 3.061 N/A THR 144.A OG1 TYR 140.A O no hydrogen 2.690 N/A ALA 145.A N ALA 141.A O no hydrogen 3.067 N/A ILE 146.A N LEU 142.A O no hydrogen 2.885 N/A VAL 147.A N LEU 143.A O no hydrogen 2.952 N/A ILE 148.A N THR 144.A O no hydrogen 3.004 N/A LEU 149.A N ALA 145.A O no hydrogen 2.999 N/A SER 150.A OG.A ILE 146.A O no hydrogen 3.095 N/A SER 150.A OG.A VAL 147.A O no hydrogen 2.730 N/A SER 150.A OG.B ASP 152.A OD1 no hydrogen 2.988 N/A ASP 152.A N ASP 152.A OD1 no hydrogen 2.731 N/A ARG 153.A NH1 GLU 84.A OE1 no hydrogen 3.372 N/A ARG 153.A NH1 GLU 84.A OE2 no hydrogen 2.765 N/A ARG 153.A NH2 GLU 84.A OE1 no hydrogen 2.805 N/A ARG 153.A NH2 VAL 147.A O no hydrogen 2.829 N/A LYS 157.A N ASP 73.A OD1 no hydrogen 3.028 N/A LYS 157.A NZ ASP 70.A OD2 no hydrogen 3.287 N/A ASP 158.A N ASP 73.A OD2 no hydrogen 3.025 N/A ARG 159.A NH2 ARG 153.A O no hydrogen 3.372 N/A GLU 160.A N GLU 160.A OE1 no hydrogen 2.858 N/A GLU 163.A N ARG 159.A O no hydrogen 2.884 N/A LYS 164.A N GLU 160.A O no hydrogen 2.791 N/A LEU 165.A N VAL 162.A O no hydrogen 2.986 N/A GLN 166.A N VAL 162.A O no hydrogen 3.057 N/A GLN 166.A NE2 ILE 146.A O no hydrogen 3.198 N/A GLU 167.A N GLU 163.A O no hydrogen 3.029 N/A LEU 169.A N GLN 166.A O no hydrogen 2.880 N/A LEU 170.A N GLN 166.A O no hydrogen 2.914 N/A ASP 171.A N GLU 167.A O no hydrogen 2.971 N/A VAL 172.A N PRO 168.A O no hydrogen 3.181 N/A LEU 173.A N LEU 169.A O no hydrogen 2.960 N/A GLN 174.A N LEU 170.A O no hydrogen 2.991 N/A LYS 175.A N ASP 171.A O no hydrogen 3.189 N/A LYS 175.A NZ GLU 2.A O no hydrogen 2.773 N/A LYS 175.A NZ GLN 7.A OE1 no hydrogen 2.850 N/A LEU 176.A N VAL 172.A O no hydrogen 2.889 N/A CYS 177.A N LEU 173.A O no hydrogen 2.981 N/A CYS 177.A SG GLU 139.A OE2 no hydrogen 3.668 N/A CYS 177.A SG LEU 173.A O no hydrogen 3.326 N/A CYS 177.A SG HIS 187.A ND1 no hydrogen 3.420 N/A LYS 178.A N GLN 174.A O no hydrogen 2.989 N/A HIS 180.A N LEU 176.A O no hydrogen 2.939 N/A GLN 181.A N CYS 177.A O no hydrogen 3.052 N/A GLU 183.A N GLU 183.A OE1 no hydrogen 2.871 N/A ASN 184.A N GLN 181.A O no hydrogen 3.180 N/A ASN 184.A ND2 GLN 181.A OE1 no hydrogen 3.666 N/A HIS 187.A N ASN 184.A O no hydrogen 3.252 N/A HIS 187.A NE2 LEU 133.A O no hydrogen 3.223 N/A CYS 190.A N GLN 186.A O no hydrogen 2.810 N/A LEU 191.A N HIS 187.A O no hydrogen 2.949 N/A LEU 192.A N PHE 188.A O no hydrogen 3.236 N/A GLY 193.A N ALA 189.A O no hydrogen 2.918 N/A ARG 194.A N CYS 190.A O no hydrogen 3.219 N/A ARG 194.A N LEU 191.A O no hydrogen 3.228 N/A ARG 194.A NE GLU 197.A OE1 no hydrogen 2.916 N/A LEU 195.A N LEU 192.A O no hydrogen 3.239 N/A THR 196.A N GLY 193.A O no hydrogen 3.314 N/A LEU 198.A N ARG 194.A O no hydrogen 3.112 N/A ARG 199.A N LEU 195.A O no hydrogen 3.158 N/A ARG 199.A NH1 ASP 152.A O no hydrogen 3.214 N/A ARG 199.A NH2 ASP 152.A OD1 no hydrogen 3.037 N/A THR 200.A N GLU 197.A O no hydrogen 3.269 N/A THR 200.A OG1 GLU 197.A O no hydrogen 2.652 N/A PHE 201.A N LEU 198.A O no hydrogen 3.269 N/A ASN 202.A N ARG 199.A O no hydrogen 3.168 N/A HIS 204.A ND1 GLU 207.A OE2 no hydrogen 3.295 N/A GLU 207.A N GLU 207.A OE1 no hydrogen 3.189 N/A MET 208.A N HIS 204.A O no hydrogen 2.954 N/A LEU 209.A N HIS 205.A O no hydrogen 3.022 N/A MET 210.A N ALA 206.A O no hydrogen 3.113 N/A SER 211.A N GLU 207.A O no hydrogen 3.090 N/A SER 211.A OG SER 116.A OG no hydrogen 3.102 N/A SER 211.A OG GLU 207.A O no hydrogen 3.038 N/A SER 211.A OG MET 208.A O no hydrogen 2.926 N/A TRP 212.A N LEU 209.A O no hydrogen 3.453 N/A ARG 213.A N GLY 114.A O no hydrogen 2.799 N/A VAL 214.A N TRP 212.A O no hydrogen 2.843 N/A ASN 215.A N GLU 39.A OE2 no hydrogen 2.799 N/A HIS 217.A NE2 TRP 212.A O no hydrogen 3.074 N/A LYS 218.A NZ PHE 219.A O no hydrogen 2.984 N/A THR 220.A OG1 THR 50.A OG1 no hydrogen 3.050 N/A LEU 223.A N THR 220.A OG1 no hydrogen 3.402 N/A CYS 224.A N THR 220.A O no hydrogen 3.018 N/A CYS 224.A SG THR 220.A O no hydrogen 3.523 N/A CYS 224.A SG VAL 229.A O no hydrogen 3.767 N/A GLU 225.A N PRO 221.A O no hydrogen 3.425 N/A ILE 226.A N LEU 222.A O no hydrogen 3.109 N/A TRP 227.A N LEU 223.A O no hydrogen 2.760 N/A VAL 229.A N CYS 224.A O no hydrogen 3.354 N/A