Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3uan_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 2.A N SER 61.A O no hydrogen 3.038 N/A GLN 3.A NE2 THR 56.A O no hydrogen 2.914 N/A GLN 3.A NE2 MET 58.A O no hydrogen 2.751 N/A GLN 4.A NE2 THR 2.A OG1 no hydrogen 3.046 N/A GLN 7.A N GLN 7.A OE1 no hydrogen 2.938 N/A GLN 7.A N THR 67.A O no hydrogen 3.004 N/A THR 8.A N THR 67.A O no hydrogen 3.420 N/A THR 8.A OG1 ARG 92.A O no hydrogen 2.808 N/A ILE 9.A N ARG 92.A O no hydrogen 3.425 N/A ILE 10.A N GLU 69.A O no hydrogen 2.910 N/A ILE 11.A N LEU 94.A O no hydrogen 2.988 N/A VAL 13.A N ILE 96.A O no hydrogen 2.942 N/A ARG 14.A NE ASP 107.A OD1 no hydrogen 3.064 N/A ARG 14.A NE ASP 107.A OD2 no hydrogen 3.178 N/A ARG 14.A NH2 ASP 107.A OD1 no hydrogen 2.988 N/A LYS 15.A NZ GLN 110.A OE1 no hydrogen 2.724 N/A GLY 16.A N VAL 13.A O no hydrogen 2.822 N/A ARG 19.A NH1 GLU 23.A OE1 no hydrogen 2.862 N/A ARG 19.A NH1 GLU 35.A O no hydrogen 3.129 N/A ARG 19.A NH2 GLU 35.A O no hydrogen 2.894 N/A LEU 21.A N GLY 17.A O no hydrogen 3.024 N/A LEU 22.A N THR 18.A O no hydrogen 3.042 N/A GLU 23.A N ARG 19.A O no hydrogen 2.906 N/A MET 24.A N ALA 20.A O no hydrogen 2.908 N/A LEU 25.A N LEU 21.A O no hydrogen 2.894 N/A SER 26.A N LEU 22.A O no hydrogen 2.882 N/A SER 26.A OG.A GLU 23.A O no hydrogen 2.664 N/A SER 26.A OG.B LEU 22.A O no hydrogen 2.751 N/A LEU 27.A N MET 24.A O no hydrogen 3.192 N/A HIS 28.A N LEU 25.A O no hydrogen 3.023 N/A HIS 28.A NE2 SER 187.A O no hydrogen 2.693 N/A ASP 30.A N HIS 28.A ND1 no hydrogen 2.912 N/A VAL 31.A N HIS 28.A O no hydrogen 3.143 N/A ALA 32.A N LEU 66.A O.A no hydrogen 2.838 N/A ALA 32.A N LEU 66.A O.B no hydrogen 2.702 N/A ALA 34.A N VAL 68.A O no hydrogen 2.939 N/A VAL 38.A N THR 71.A OG1 no hydrogen 3.262 N/A HIS 39.A N THR 71.A OG1 no hydrogen 3.045 N/A HIS 39.A ND1 ASP 42.A OD2 no hydrogen 2.728 N/A HIS 39.A NE2 GLU 37.A OE1 no hydrogen 2.934 N/A PHE 40.A N TYR 74.A OH no hydrogen 2.993 N/A HIS 46.A N TRP 43.A O no hydrogen 2.985 N/A HIS 46.A ND1 HIS 39.A O no hydrogen 2.948 N/A TYR 47.A N TRP 43.A O no hydrogen 2.904 N/A SER 48.A N GLU 44.A O no hydrogen 2.992 N/A SER 48.A OG.A GLU 44.A O no hydrogen 2.838 N/A SER 48.A OG.B GLU 44.A O no hydrogen 2.829 N/A GLN 49.A N HIS 46.A O no hydrogen 3.092 N/A GLN 49.A NE2 GLU 45.A O no hydrogen 3.097 N/A GLY 50.A N TYR 47.A O no hydrogen 3.109 N/A TRP 53.A N GLY 50.A O no hydrogen 3.058 N/A TYR 54.A N GLY 50.A O no hydrogen 3.457 N/A TYR 54.A OH GLU 69.A OE1 no hydrogen 2.504 N/A LEU 55.A N LEU 51.A O no hydrogen 2.885 N/A THR 56.A N GLY 52.A O no hydrogen 3.281 N/A THR 56.A OG1 TRP 53.A O no hydrogen 2.694 N/A GLN 57.A N TYR 54.A O no hydrogen 2.975 N/A GLN 57.A NE2 THR 56.A OG1 no hydrogen 3.086 N/A MET 58.A N LEU 55.A O no hydrogen 3.086 N/A SER 61.A N THR 2.A O no hydrogen 2.805 N/A SER 61.A OG THR 2.A O no hydrogen 3.388 N/A SER 62.A N GLN 65.A OE1 no hydrogen 2.850 N/A GLN 65.A N SER 62.A O no hydrogen 2.984 N/A GLN 65.A NE2 PRO 29.A O no hydrogen 2.957 N/A LEU 66.A N.A ASP 30.A O no hydrogen 2.716 N/A LEU 66.A N.B ASP 30.A O no hydrogen 2.726 N/A THR 67.A N GLN 7.A OE1 no hydrogen 2.626 N/A VAL 68.A N ALA 32.A O no hydrogen 3.042 N/A LYS 70.A NZ THR 18.A OG1 no hydrogen 3.134 N/A LYS 70.A NZ GLU 37.A OE2 no hydrogen 2.784 N/A THR 71.A N ILE 10.A O no hydrogen 3.084 N/A THR 71.A OG1 GLU 69.A OE2 no hydrogen 2.727 N/A THR 71.A OG1 TYR 74.A OH no hydrogen 3.339 N/A TYR 74.A N THR 71.A O no hydrogen 3.254 N/A TYR 74.A OH GLU 69.A OE1 no hydrogen 2.729 N/A PHE 75.A N ILE 11.A O no hydrogen 2.721 N/A SER 77.A N TYR 74.A O no hydrogen 3.041 N/A SER 77.A OG.B ALA 73.A O no hydrogen 2.624 N/A LYS 79.A NZ ASP 42.A O no hydrogen 2.863 N/A LYS 79.A NZ GLU 44.A OE1 no hydrogen 2.695 N/A VAL 80.A N SER 77.A O no hydrogen 2.950 N/A ARG 83.A NH1 PHE 41.A O no hydrogen 2.940 N/A ARG 83.A NH1 GLU 44.A OE1 no hydrogen 2.816 N/A ARG 83.A NH2 GLU 44.A OE1 no hydrogen 3.184 N/A ARG 83.A NH2 GLU 44.A OE2 no hydrogen 3.198 N/A ILE 84.A N VAL 80.A O no hydrogen 3.022 N/A HIS 85.A N PRO 81.A O no hydrogen 2.962 N/A SER 86.A N GLU 82.A O no hydrogen 2.988 N/A SER 86.A OG.B GLU 82.A O no hydrogen 3.124 N/A MET 87.A N ARG 83.A O no hydrogen 3.191 N/A ASN 88.A N ILE 84.A O no hydrogen 2.851 N/A THR 90.A N ASN 88.A OD1 no hydrogen 2.934 N/A THR 90.A OG1 ASN 88.A OD1 no hydrogen 2.839 N/A ILE 91.A N ASN 88.A O no hydrogen 3.214 N/A LEU 93.A N HIS 160.A O no hydrogen 2.862 N/A LEU 94.A N ILE 9.A O no hydrogen 2.903 N/A LEU 95.A N HIS 162.A O no hydrogen 2.902 N/A ILE 96.A N GLY 12.A O no hydrogen 2.842 N/A LEU 97.A N VAL 164.A O no hydrogen 2.986 N/A ARG 98.A NH1 LYS 15.A O no hydrogen 2.783 N/A ARG 98.A NH1 SER 106.A OG no hydrogen 3.338 N/A ASP 99.A N ASP 167.A OD1 no hydrogen 3.266 N/A ASP 99.A N ASP 167.A OD2 no hydrogen 3.335 N/A SER 101.A OG HIS 235.A ND1 no hydrogen 3.318 N/A GLU 102.A N ASP 99.A OD2 no hydrogen 2.853 N/A ARG 103.A N ASP 99.A O no hydrogen 2.822 N/A ARG 103.A NE SER 143.A OG no hydrogen 2.811 N/A ARG 103.A NH1 ARG 14.A O no hydrogen 2.822 N/A ARG 103.A NH1 ASP 107.A OD2 no hydrogen 2.893 N/A ARG 103.A NH2 ASP 107.A OD2 no hydrogen 2.947 N/A ARG 103.A NH2 ALA 139.A O no hydrogen 2.842 N/A VAL 104.A N PRO 100.A O no hydrogen 3.019 N/A LEU 105.A N SER 101.A O no hydrogen 3.057 N/A SER 106.A N GLU 102.A O no hydrogen 2.893 N/A ASP 107.A N ARG 103.A O no hydrogen 2.907 N/A TYR 108.A N VAL 104.A O no hydrogen 2.928 N/A TYR 108.A OH PRO 123.A O no hydrogen 2.859 N/A THR 109.A N LEU 105.A O no hydrogen 2.997 N/A THR 109.A OG1 LEU 105.A O no hydrogen 2.801 N/A GLN 110.A N SER 106.A O no hydrogen 3.135 N/A VAL 111.A N ASP 107.A O no hydrogen 3.185 N/A LEU 112.A N TYR 108.A O no hydrogen 2.771 N/A TYR 113.A N.A THR 109.A O no hydrogen 2.937 N/A TYR 113.A N.B THR 109.A O no hydrogen 2.961 N/A ASN 114.A N GLN 110.A O no hydrogen 2.933 N/A HIS 115.A N VAL 111.A O no hydrogen 3.027 N/A HIS 115.A ND1 VAL 111.A O no hydrogen 2.796 N/A LEU 116.A N LEU 112.A O no hydrogen 2.839 N/A GLN 117.A N.A TYR 113.A O.A no hydrogen 2.957 N/A GLN 117.A N.A TYR 113.A O.B no hydrogen 3.106 N/A GLN 117.A N.B TYR 113.A O.A no hydrogen 2.965 N/A GLN 117.A N.B TYR 113.A O.B no hydrogen 3.114 N/A LYS 118.A N ASN 114.A O no hydrogen 3.355 N/A LYS 118.A N HIS 115.A O no hydrogen 3.079 N/A HIS 119.A N LEU 116.A O no hydrogen 3.005 N/A LYS 120.A N HIS 115.A O no hydrogen 2.825 N/A GLU 126.A N GLU 126.A OE1 no hydrogen 2.694 N/A ASP 127.A N PRO 124.A O no hydrogen 2.970 N/A LEU 129.A N ILE 125.A O no hydrogen 2.865 N/A MET 130.A N GLU 126.A O no hydrogen 3.000 N/A ARG 131.A N ARG 132.A O no hydrogen 2.756 N/A ASN 134.A N LEU 129.A O no hydrogen 2.464 N/A ASN 134.A ND2 LEU 128.A O no hydrogen 2.963 N/A ASP 136.A N ASN 134.A OD1 no hydrogen 2.786 N/A LEU 140.A N TYR 137.A O no hydrogen 3.202 N/A ARG 142.A N LYS 138.A O no hydrogen 3.290 N/A ARG 142.A NE ASP 107.A OD2 no hydrogen 2.981 N/A ARG 142.A NH2 ASP 107.A OD1 no hydrogen 3.238 N/A ARG 142.A NH2 ASP 107.A OD2 no hydrogen 3.003 N/A SER 143.A N LEU 140.A O no hydrogen 3.059 N/A SER 143.A OG PRO 100.A O no hydrogen 2.805 N/A LEU 144.A N ASN 141.A O no hydrogen 3.023 N/A TYR 145.A N SER 143.A O no hydrogen 2.944 N/A TYR 145.A OH ARG 98.A O no hydrogen 2.627 N/A HIS 148.A N LEU 144.A O no hydrogen 3.366 N/A HIS 148.A NE2 ASN 141.A O no hydrogen 2.977 N/A HIS 148.A NE2 ASN 141.A OD1 no hydrogen 3.074 N/A MET 149.A N TYR 145.A O no hydrogen 2.811 N/A LEU 150.A N HIS 146.A O no hydrogen 3.104 N/A ASN 151.A N HIS 148.A O no hydrogen 3.130 N/A TRP 152.A N MET 149.A O no hydrogen 2.974 N/A TRP 152.A NE1 PHE 75.A O no hydrogen 2.907 N/A LEU 153.A N MET 149.A O no hydrogen 2.992 N/A PHE 155.A N TRP 152.A O no hydrogen 3.012 N/A PHE 156.A N TRP 152.A O no hydrogen 2.905 N/A HIS 160.A N PRO 157.A O no hydrogen 2.913 N/A ILE 161.A N LEU 158.A O no hydrogen 2.993 N/A HIS 162.A N LEU 93.A O no hydrogen 2.894 N/A VAL 164.A N LEU 95.A O no hydrogen 2.666 N/A ASP 165.A N GLU 176.A OE1 no hydrogen 3.069 N/A GLY 166.A N LEU 97.A O no hydrogen 2.672 N/A ARG 168.A N ASP 165.A OD1 no hydrogen 3.156 N/A LEU 169.A N ASP 165.A O no hydrogen 2.880 N/A ILE 170.A N GLY 166.A O no hydrogen 3.128 N/A ARG 171.A N ASP 167.A O no hydrogen 3.201 N/A ASP 172.A N ARG 168.A O no hydrogen 2.814 N/A ILE 177.A N PRO 173.A O no hydrogen 2.959 N/A GLN 178.A N PHE 174.A O no hydrogen 2.869 N/A LYS 179.A N PRO 175.A O no hydrogen 3.352 N/A VAL 180.A N GLU 176.A O no hydrogen 3.220 N/A GLU 181.A N ILE 177.A O no hydrogen 2.990 N/A ARG 182.A N GLN 178.A O no hydrogen 3.128 N/A PHE 183.A N LYS 179.A O no hydrogen 2.932 N/A LEU 184.A N VAL 180.A O no hydrogen 2.942 N/A LYS 185.A N ARG 182.A O no hydrogen 2.940 N/A LEU 186.A N GLU 181.A O no hydrogen 2.799 N/A GLN 189.A N SER 187.A O no hydrogen 2.771 N/A GLN 189.A NE2 SER 187.A OG no hydrogen 3.033 N/A ILE 190.A N GLU 181.A OE1 no hydrogen 3.087 N/A ASN 191.A N ASN 194.A OD1 no hydrogen 2.971 N/A SER 193.A OG ASN 191.A OD1 no hydrogen 2.600 N/A ASN 194.A N ASN 191.A O no hydrogen 2.845 N/A ASN 194.A ND2 ARG 207.A O no hydrogen 2.850 N/A PHE 195.A N ALA 192.A O no hydrogen 3.172 N/A TYR 196.A N CYS 205.A O no hydrogen 3.021 N/A ASN 198.A N PHE 203.A O no hydrogen 3.066 N/A LYS 201.A N ASN 198.A OD1 no hydrogen 2.710 N/A LYS 201.A NZ LEU 215.A O no hydrogen 3.100 N/A LYS 201.A NZ HIS 216.A O no hydrogen 3.031 N/A LYS 201.A NZ LYS 219.A O no hydrogen 2.873 N/A GLY 202.A N ASN 198.A O no hydrogen 2.766 N/A CYS 205.A N TYR 196.A O no hydrogen 2.674 N/A CYS 205.A SG PHE 203.A O no hydrogen 3.835 N/A LEU 206.A N ARG 213.A O no hydrogen 2.810 N/A ARG 207.A N ASN 194.A O no hydrogen 2.768 N/A ARG 207.A NE ASP 212.A OD1 no hydrogen 3.167 N/A ARG 207.A NE ASP 212.A OD2 no hydrogen 2.970 N/A ARG 207.A NH2 ASP 212.A OD2 no hydrogen 2.796 N/A ASP 208.A N LYS 211.A O no hydrogen 2.978 N/A LYS 211.A N ASP 208.A O no hydrogen 2.913 N/A ARG 213.A N LEU 206.A O no hydrogen 2.962 N/A ARG 213.A NH1 GLU 23.A OE2 no hydrogen 3.168 N/A ARG 213.A NH2 GLU 23.A OE2 no hydrogen 2.665 N/A HIS 216.A ND1 SER 218.A OG no hydrogen 2.784 N/A SER 218.A N HIS 216.A ND1 no hydrogen 3.070 N/A SER 218.A OG HIS 216.A ND1 no hydrogen 2.784 N/A LYS 219.A N HIS 216.A O no hydrogen 2.849 N/A ARG 221.A NH1 GLN 110.A OE1 no hydrogen 3.387 N/A ARG 221.A NH2 GLN 110.A OE1 no hydrogen 2.787 N/A ASP 227.A N GLU 126.A OE2 no hydrogen 3.235 N/A LYS 229.A N ASP 227.A OD1 no hydrogen 2.882 N/A LEU 230.A N ASP 227.A O no hydrogen 2.816 N/A LEU 231.A N ASP 227.A O no hydrogen 2.980 N/A ASP 232.A N PRO 228.A O no hydrogen 2.959 N/A LYS 233.A N LYS 229.A O no hydrogen 3.231 N/A LEU 234.A N LEU 230.A O no hydrogen 2.951 N/A HIS 235.A N LEU 231.A O no hydrogen 2.842 N/A GLU 236.A N ASP 232.A O no hydrogen 2.910 N/A TYR 237.A N LYS 233.A O no hydrogen 2.848 N/A PHE 238.A N LEU 234.A O no hydrogen 3.339 N/A PHE 238.A N HIS 235.A O no hydrogen 3.252 N/A HIS 239.A N GLU 236.A O no hydrogen 3.156 N/A ASN 242.A N PHE 238.A O no hydrogen 2.802 N/A LYS 243.A N HIS 239.A O no hydrogen 3.198 N/A LYS 244.A N GLU 240.A O no hydrogen 3.004 N/A PHE 245.A N PRO 241.A O no hydrogen 3.099 N/A PHE 246.A N ASN 242.A O no hydrogen 2.797 N/A LYS 247.A N LYS 243.A O no hydrogen 3.084 N/A LEU 248.A N LYS 244.A O no hydrogen 3.014 N/A VAL 249.A N PHE 245.A O no hydrogen 3.065 N/A ARG 251.A N PHE 246.A O no hydrogen 2.930 N/A ARG 251.A NH1 ILE 163.A O no hydrogen 3.009 N/A TRP 255.A N PHE 253.A O no hydrogen 2.797 N/A HIS 256.A N ASP 99.A OD1 no hydrogen 2.783 N/A HIS 256.A ND1 ASP 99.A OD1 no hydrogen 3.039 N/A HIS 256.A ND1 ASP 99.A OD2 no hydrogen 3.285 N/A