Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3nzx_D.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A NH2 TYR 18.A OH no hydrogen 3.415 N/A THR 6.A OG1 GLY 3.A O no hydrogen 2.680 N/A SER 8.A N ARG 12.A O no hydrogen 2.617 N/A SER 8.A OG GLU 10.A OE2 no hydrogen 2.971 N/A SER 8.A OG ARG 12.A O no hydrogen 3.307 N/A GLU 10.A N SER 8.A OG no hydrogen 3.330 N/A GLY 11.A N SER 8.A O no hydrogen 2.924 N/A ARG 12.A N SER 8.A OG no hydrogen 3.138 N/A VAL 16.A N LEU 13.A O no hydrogen 2.713 N/A GLU 17.A N LEU 13.A O no hydrogen 3.058 N/A TYR 18.A N PHE 14.A O no hydrogen 2.856 N/A SER 19.A N GLN 15.A O no hydrogen 2.990 N/A SER 19.A OG PHE 130.A O no hydrogen 2.724 N/A LEU 20.A N VAL 16.A O no hydrogen 3.041 N/A GLU 21.A N GLU 17.A O no hydrogen 3.224 N/A GLU 21.A N TYR 18.A O no hydrogen 3.086 N/A ALA 22.A N TYR 18.A O no hydrogen 3.352 N/A ILE 23.A N SER 19.A O no hydrogen 3.317 N/A LYS 24.A N LEU 20.A O no hydrogen 3.184 N/A LYS 24.A N GLU 21.A O no hydrogen 3.042 N/A LYS 24.A NZ GLU 21.A OE1 no hydrogen 3.372 N/A LYS 24.A NZ GLU 21.A OE2 no hydrogen 3.532 N/A LEU 25.A N ALA 22.A O no hydrogen 3.057 N/A GLY 26.A N ILE 23.A O no hydrogen 3.049 N/A THR 28.A N GLU 43.A OE2 no hydrogen 3.255 N/A THR 28.A OG1 SER 166.A OG no hydrogen 3.333 N/A ALA 29.A N ILE 164.A O no hydrogen 2.891 N/A ILE 30.A N GLY 41.A O no hydrogen 2.802 N/A GLY 31.A N LYS 162.A O no hydrogen 2.910 N/A ILE 32.A N VAL 39.A O no hydrogen 2.840 N/A ALA 33.A N ASN 160.A O no hydrogen 2.829 N/A THR 34.A N GLY 37.A O no hydrogen 2.884 N/A THR 34.A OG1 GLY 37.A O no hydrogen 2.860 N/A LYS 35.A NZ SER 181D.A O no hydrogen 3.326 N/A GLU 36.A N THR 34.A OG1 no hydrogen 3.135 N/A GLY 37.A N THR 34.A O no hydrogen 2.797 N/A VAL 38.A N ILE 214.A O no hydrogen 3.214 N/A VAL 39.A N ILE 32.A O no hydrogen 2.681 N/A LEU 40.A N SER 212.A O no hydrogen 2.727 N/A GLY 41.A N ILE 30.A O no hydrogen 2.810 N/A VAL 42.A N GLN 210.A O no hydrogen 3.001 N/A GLU 43.A N THR 28.A O no hydrogen 2.948 N/A LYS 44.A N ASN 208B.A O no hydrogen 2.837 N/A LYS 44.A NZ SER 53.A O no hydrogen 2.954 N/A ARG 45.A NE GLU 43.A OE1 no hydrogen 3.124 N/A ARG 45.A NH1 LEU 25.A O no hydrogen 3.236 N/A ARG 45.A NH2 GLU 43.A OE2 no hydrogen 3.419 N/A LEU 50.A N SER 48.A OG no hydrogen 3.420 N/A LEU 51.A N SER 48.A O no hydrogen 2.931 N/A SER 53.A OG ASN 207A.A O no hydrogen 3.156 N/A SER 55.A N GLU 52.A O no hydrogen 2.822 N/A SER 55.A OG GLU 52.A O no hydrogen 3.088 N/A ILE 56.A N SER 53.A O no hydrogen 3.128 N/A LYS 58.A NZ LYS 44.A O no hydrogen 3.042 N/A VAL 60.A N CYS 68.A O no hydrogen 2.772 N/A ILE 62.A N ILE 66.A O no hydrogen 2.780 N/A ASP 63.A N ILE 66.A O no hydrogen 2.963 N/A ARG 64.A N ASP 63.A OD2 no hydrogen 2.849 N/A ARG 64.A NH1 GLN 217.A O no hydrogen 3.058 N/A HIS 65.A N HIS 65.A ND1 no hydrogen 2.763 N/A HIS 65.A NE2 ILE 99.A O no hydrogen 2.823 N/A ILE 66.A N ASP 63.A O no hydrogen 3.105 N/A GLY 67.A N ALA 137.A O no hydrogen 2.769 N/A CYS 68.A N VAL 60.A O no hydrogen 2.759 N/A CYS 68.A SG ALA 69.A O no hydrogen 3.838 N/A CYS 68.A SG LEU 135.A O no hydrogen 3.775 N/A ALA 69.A N LEU 135.A O no hydrogen 2.834 N/A MET 70.A N LYS 58.A O no hydrogen 3.056 N/A SER 71.A N ALA 133.A O no hydrogen 3.081 N/A SER 71.A OG SER 27.A O no hydrogen 2.764 N/A LEU 73.A N GLY 131.A O no hydrogen 2.581 N/A ASP 76.A N LEU 73.A O no hydrogen 2.917 N/A ALA 77.A N THR 74.A O no hydrogen 3.038 N/A ARG 78.A N ALA 75.A O no hydrogen 3.366 N/A ARG 78.A NH2 GLU 57.A O no hydrogen 3.334 N/A ILE 81.A N ALA 77.A O no hydrogen 2.904 N/A GLU 82.A N ARG 78.A O no hydrogen 3.006 N/A HIS 83.A N SER 79.A O no hydrogen 2.968 N/A HIS 83.A NE2 SER 107.A OG no hydrogen 2.887 N/A ALA 84.A N MET 80.A O no hydrogen 2.867 N/A ARG 85.A N ILE 81.A O no hydrogen 2.736 N/A ARG 85.A NE GLU 61.A O no hydrogen 2.843 N/A ARG 85.A NH2 GLU 61.A O no hydrogen 3.349 N/A THR 86.A N GLU 82.A O no hydrogen 2.918 N/A THR 86.A OG1 GLU 82.A O no hydrogen 3.148 N/A THR 86.A OG1 GLU 82.A OE2 no hydrogen 3.148 N/A ALA 87.A N HIS 83.A O no hydrogen 2.801 N/A ALA 88.A N ALA 84.A O no hydrogen 2.883 N/A VAL 89.A N ARG 85.A O no hydrogen 2.866 N/A THR 90.A N THR 86.A O no hydrogen 2.659 N/A THR 90.A OG1 THR 86.A O no hydrogen 2.819 N/A HIS 91.A N ALA 87.A O no hydrogen 2.925 N/A HIS 91.A NE2 GLU 97.A OE1 no hydrogen 2.921 N/A ASN 92.A N ALA 88.A O no hydrogen 3.159 N/A ASN 92.A ND2 GLU 97.A O no hydrogen 3.243 N/A LEU 93.A N VAL 89.A O no hydrogen 3.070 N/A LEU 93.A N THR 90.A O no hydrogen 3.022 N/A TYR 94.A N THR 90.A O no hydrogen 3.055 N/A TYR 95.A N HIS 91.A O no hydrogen 2.905 N/A ASP 96.A N ASN 92.A O no hydrogen 2.829 N/A ASN 100.A ND2 ASP 142.A OD1 no hydrogen 3.290 N/A VAL 101.A N ASP 140.A OD1 no hydrogen 3.054 N/A LEU 104.A N ASN 100.A O no hydrogen 2.966 N/A THR 105.A N VAL 101.A O no hydrogen 3.096 N/A THR 105.A OG1 VAL 101.A O no hydrogen 2.926 N/A GLN 106.A N GLU 102.A O no hydrogen 2.848 N/A SER 107.A N SER 103.A O no hydrogen 2.974 N/A SER 107.A OG HIS 83.A NE2 no hydrogen 2.887 N/A VAL 108.A N LEU 104.A O no hydrogen 3.154 N/A CYS 109.A N THR 105.A O no hydrogen 2.997 N/A CYS 109.A SG THR 105.A O no hydrogen 3.461 N/A ASP 110.A N SER 107.A O no hydrogen 3.263 N/A LEU 111.A N VAL 108.A O no hydrogen 3.107 N/A ARG 114.A N LEU 111.A O no hydrogen 2.940 N/A PHE 115.A N LEU 113.A O no hydrogen 2.689 N/A LEU 125.A N GLU 123.A O no hydrogen 2.848 N/A ARG 128.A NH1 ASP 76.A OD1 no hydrogen 2.687 N/A ARG 128.A NH1 PRO 129.A O no hydrogen 3.018 N/A ARG 128.A NH2 ASP 76.A OD1 no hydrogen 3.215 N/A ARG 128.A NH2 ASP 76.A OD2 no hydrogen 2.976 N/A GLY 131.A N ASP 76.A OD1 no hydrogen 2.804 N/A ALA 133.A N SER 71.A O no hydrogen 3.014 N/A LEU 134.A N ALA 150.A O no hydrogen 2.978 N/A LEU 135.A N ALA 69.A O no hydrogen 2.745 N/A ILE 136.A N PHE 148.A O no hydrogen 2.878 N/A ALA 137.A N GLY 67.A O no hydrogen 2.882 N/A GLY 138.A N GLN 146.A O no hydrogen 2.914 N/A HIS 139.A N HIS 65.A O no hydrogen 3.019 N/A ASP 140.A N GLY 144.A O no hydrogen 3.364 N/A GLN 146.A N GLY 138.A O no hydrogen 2.807 N/A PHE 148.A N ILE 136.A O no hydrogen 2.747 N/A HIS 149.A N TYR 157.A O no hydrogen 2.925 N/A ALA 150.A N LEU 134.A O no hydrogen 2.799 N/A GLU 151.A N THR 155.A O no hydrogen 3.293 N/A SER 153.A OG THR 155.A OG1 no hydrogen 2.963 N/A GLY 154.A N GLU 151.A O no hydrogen 3.054 N/A THR 155.A OG1 SER 153.A OG no hydrogen 2.963 N/A TYR 157.A N HIS 149.A O no hydrogen 3.115 N/A TYR 159.A N LEU 147.A O no hydrogen 3.003 N/A LYS 162.A N GLY 31.A O no hydrogen 2.994 N/A LYS 162.A NZ TYR 159.A OH no hydrogen 3.489 N/A ALA 163.A N GLN 172.A OE1 no hydrogen 2.890 N/A ILE 164.A N ALA 29.A O no hydrogen 2.909 N/A SER 166.A N GLY 26.A O no hydrogen 2.817 N/A SER 166.A OG GLY 26.A O no hydrogen 3.259 N/A SER 166.A OG THR 28.A OG1 no hydrogen 3.333 N/A GLY 167.A N THR 28.A OG1 no hydrogen 3.203 N/A SER 168.A N GLY 165.A O no hydrogen 2.836 N/A SER 168.A OG GLY 165.A O no hydrogen 2.940 N/A GLU 169.A N GLU 169.A OE1 no hydrogen 2.475 N/A GLY 170.A N GLU 169.A OE1 no hydrogen 3.419 N/A ALA 171.A N GLY 167.A O no hydrogen 2.762 N/A GLN 172.A N SER 168.A O no hydrogen 2.592 N/A GLN 172.A NE2 ALA 161.A O no hydrogen 3.594 N/A ALA 173.A N GLU 169.A O no hydrogen 3.244 N/A GLU 174.A N GLY 170.A O no hydrogen 3.199 N/A LEU 175.A N ALA 171.A O no hydrogen 2.938 N/A LEU 176.A N GLN 172.A O no hydrogen 2.899 N/A ASN 177.A N GLU 174.A O no hydrogen 3.046 N/A GLU 178.A N GLU 174.A O no hydrogen 3.130 N/A TRP 179.A N LEU 175.A O no hydrogen 3.060 N/A TRP 179.A NE1 ALA 33.A O no hydrogen 3.175 N/A LEU 183.A N HIS 180C.A O no hydrogen 3.200 N/A THR 184.A N GLU 187.A OE1 no hydrogen 2.873 N/A LEU 185.A N GLU 36.A OE1 no hydrogen 3.197 N/A LYS 186.A NZ GLU 234.A OE1 no hydrogen 3.468 N/A GLU 187.A N THR 184.A OG1 no hydrogen 3.009 N/A ALA 188.A N THR 184.A O no hydrogen 3.040 N/A GLU 189.A N LEU 185.A O no hydrogen 2.963 N/A LEU 190.A N LYS 186.A O no hydrogen 3.106 N/A LEU 191.A N GLU 187.A O no hydrogen 2.838 N/A VAL 192.A N ALA 188.A O no hydrogen 2.845 N/A LEU 193.A N GLU 189.A O no hydrogen 2.897 N/A LYS 194.A N LEU 190.A O no hydrogen 2.719 N/A LYS 194.A NZ GLU 178.A OE1 no hydrogen 3.055 N/A ILE 195.A N LEU 191.A O no hydrogen 3.098 N/A LEU 196.A N VAL 192.A O no hydrogen 3.086 N/A LYS 197.A N LEU 193.A O no hydrogen 3.294 N/A GLN 198.A N LYS 194.A O no hydrogen 3.202 N/A GLN 198.A NE2 GLU 174.A OE2 no hydrogen 2.615 N/A VAL 199.A N ILE 195.A O no hydrogen 3.311 N/A MET 200.A N LEU 196.A O no hydrogen 2.767 N/A ASP 205.A N ASN 208B.A OD1 no hydrogen 3.112 N/A GLU 206.A N GLU 206.A OE2 no hydrogen 2.572 N/A GLN 210.A N VAL 42.A O no hydrogen 3.120 N/A SER 212.A OG LEU 40.A O no hydrogen 2.975 N/A CYS 213.A N LYS 221.A O no hydrogen 3.082 N/A CYS 213.A SG TYR 223.A OH no hydrogen 3.302 N/A ILE 214.A N VAL 38.A O no hydrogen 3.030 N/A THR 215.A N GLY 219.A O no hydrogen 3.244 N/A LYS 216.A N TYR 145.A OH no hydrogen 2.760 N/A ASP 218.A N THR 215.A OG1 no hydrogen 3.289 N/A GLY 219.A N THR 215.A O no hydrogen 2.563 N/A PHE 220.A N ARG 64.A O no hydrogen 2.879 N/A LYS 221.A N CYS 213.A O no hydrogen 2.978 N/A TYR 223.A N LEU 211.A O no hydrogen 3.069 N/A TYR 223.A OH GLU 189.A OE1 no hydrogen 2.924 N/A GLU 226.A N GLU 226.A OE2 no hydrogen 2.541 N/A THR 228.A N ASP 224.A O no hydrogen 3.248 N/A ALA 229.A N ASN 225.A O no hydrogen 2.877 N/A GLU 230.A N GLU 226.A O no hydrogen 3.361 N/A LEU 231.A N LYS 227.A O no hydrogen 3.460 N/A ILE 232.A N THR 228.A O no hydrogen 2.803 N/A LYS 233.A N ALA 229.A O no hydrogen 2.994 N/A LYS 233.A NZ GLU 237.A OE2 no hydrogen 2.834 N/A GLU 234.A N GLU 230.A O no hydrogen 2.776 N/A LEU 235.A N LEU 231.A O no hydrogen 3.052 N/A LEU 235.A N ILE 232.A O no hydrogen 3.134 N/A LYS 236.A N ILE 232.A O no hydrogen 3.014 N/A GLU 237.A N LYS 233.A O no hydrogen 3.059 N/A LYS 238.A N GLU 234.A O no hydrogen 3.271 N/A GLU 239.A N LEU 235.A O no hydrogen 3.051 N/A ALA 240.A N LYS 236.A O no hydrogen 3.028 N/A GLU 242.A N GLU 239.A O no hydrogen 3.101 N/A GLY 116A.A N MET 126.A O no hydrogen 2.905 N/A ASP 143A.A N ASP 140.A OD2 no hydrogen 2.823 N/A ASN 207A.A N ASP 205.A OD1 no hydrogen 2.885 N/A ASN 208B.A N ASP 205.A OD1 no hydrogen 2.774 N/A ASN 208B.A ND2 LYS 203.A O no hydrogen 3.195 N/A HIS 180C.A ND1 SER 182E.A OG no hydrogen 3.009 N/A SER 182E.A N HIS 180C.A ND1 no hydrogen 3.323 N/A SER 182E.A OG HIS 180C.A ND1 no hydrogen 3.009 N/A