Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4jun_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 13.A N ASN 11A.A OD1 no hydrogen 2.981 N/A SER 13.A OG VAL 27.A O no hydrogen 3.205 N/A GLU 15.A N SER 13.A OG no hydrogen 3.302 N/A VAL 17.A N VAL 25.A O no hydrogen 3.083 N/A THR 19.A N GLU 22.A O no hydrogen 2.752 N/A THR 19.A OG1 GLU 22.A O no hydrogen 2.853 N/A GLU 22.A N THR 19.A OG1 no hydrogen 2.988 N/A ASN 24.A N ASP 18.A OD1 no hydrogen 2.970 N/A VAL 25.A N VAL 17.A O no hydrogen 2.924 N/A VAL 27.A N GLU 15.A O no hydrogen 2.800 N/A THR 28.A N LEU 318.A O no hydrogen 2.720 N/A GLN 31.A N LEU 314.A O no hydrogen 2.782 N/A ILE 33.A N LEU 312.A O no hydrogen 3.343 N/A LEU 34.A N ASP 32.A OD1 no hydrogen 2.948 N/A GLU 35.A N PHE 292.A O no hydrogen 2.653 N/A LYS 36.A NZ ASP 32.A OD1 no hydrogen 3.382 N/A LYS 36.A NZ ASP 32.A OD2 no hydrogen 2.554 N/A LYS 36.A NZ LEU 34.A O no hydrogen 2.976 N/A THR 37.A N GLU 35.A OE2 no hydrogen 3.238 N/A THR 37.A OG1 GLU 35.A OE2 no hydrogen 3.006 N/A ASN 39.A N ALA 285.A O no hydrogen 2.960 N/A GLY 40.A N HIS 38.A ND1 no hydrogen 2.981 N/A LYS 41.A N ASN 39.A OD1 no hydrogen 2.854 N/A LYS 41.A NZ GLY 273.A O no hydrogen 3.338 N/A CYS 43.A N GLN 280.A OE1 no hydrogen 2.759 N/A ASP 44.A N CYS 275.A O no hydrogen 2.874 N/A ASP 46.A N THR 277.A O no hydrogen 3.135 N/A GLY 47.A N ASN 276.A OD1 no hydrogen 2.773 N/A VAL 48.A N LEU 45A.A O no hydrogen 3.177 N/A LEU 51.A N TYR 79.A O no hydrogen 2.952 N/A LEU 53.A N VAL 81.A O no hydrogen 2.909 N/A ARG 54.A NE GLU 70.A OE2 no hydrogen 2.641 N/A ARG 54.A NH2 GLU 70.A OE2 no hydrogen 2.939 N/A CYS 56.A N LEU 53.A O no hydrogen 2.975 N/A SER 57.A N ASN 88.A O no hydrogen 3.132 N/A SER 57.A OG ASP 89.A OD1 no hydrogen 2.803 N/A VAL 58.A N GLU 82.A OE2 no hydrogen 3.099 N/A ALA 59.A N TYR 99.A OH no hydrogen 3.163 N/A GLY 60.A N SER 57.A OG no hydrogen 3.022 N/A TRP 61.A N SER 57.A O no hydrogen 2.962 N/A LEU 62.A N VAL 58.A O no hydrogen 2.861 N/A LEU 63.A N ALA 59.A O no hydrogen 2.972 N/A GLY 64.A N GLY 60.A O no hydrogen 3.094 N/A ASN 65.A N GLY 60.A O no hydrogen 2.887 N/A ASN 65.A ND2 ASP 89.A O no hydrogen 3.211 N/A ILE 67.A N ASN 65.A OD1 no hydrogen 3.219 N/A CYS 68.A N ASN 65.A O no hydrogen 2.811 N/A PHE 71.A N CYS 68.A O no hydrogen 3.179 N/A ILE 72.A N ASP 69.A O no hydrogen 2.945 N/A TRP 77.A N ASN 110.A O no hydrogen 3.024 N/A SER 78.A N LYS 49.A O no hydrogen 3.327 N/A SER 78.A OG VAL 48.A O no hydrogen 2.906 N/A TYR 79.A OH CYS 43.A O no hydrogen 2.961 N/A ILE 80.A N ALA 264.A O no hydrogen 2.861 N/A VAL 81.A N LEU 51.A O no hydrogen 2.895 N/A GLU 82.A N MET 266.A O no hydrogen 3.002 N/A LYS 83.A NZ GLU 271.A OE2 no hydrogen 3.126 N/A ALA 84.A N GLU 269.A OE2 no hydrogen 3.046 N/A ASN 88.A N ASP 55.A O no hydrogen 2.991 N/A ASP 95.A N MET 227.A O no hydrogen 2.997 N/A ASN 97.A N PHE 229.A O no hydrogen 2.882 N/A GLU 100.A N GLU 100.A OE1 no hydrogen 2.582 N/A LEU 102.A N ASP 98.A O no hydrogen 3.155 N/A LYS 103.A N TYR 99.A O no hydrogen 2.900 N/A LYS 103.A NZ GLU 82.A OE1 no hydrogen 2.805 N/A HIS 104.A N GLU 100.A O no hydrogen 2.866 N/A LEU 105.A N GLU 101.A O no hydrogen 3.125 N/A LEU 106.A N LEU 102.A O no hydrogen 3.141 N/A LEU 106.A N LYS 103.A O no hydrogen 3.092 N/A SER 107.A N HIS 104.A O no hydrogen 3.335 N/A SER 107.A OG HIS 104.A O no hydrogen 2.888 N/A ARG 108.A N LEU 105.A O no hydrogen 3.180 N/A ARG 108.A NH1 ASP 262A.A OD2 no hydrogen 3.133 N/A ILE 109.A N LEU 106.A O no hydrogen 2.934 N/A ASN 110.A N LYS 259.A O no hydrogen 2.826 N/A ASN 110.A ND2 TRP 77.A O no hydrogen 2.921 N/A ASN 110.A ND2 ASP 262A.A O no hydrogen 3.314 N/A HIS 111.A N LYS 259.A O no hydrogen 3.369 N/A HIS 111.A NE2 VAL 74.A O no hydrogen 3.134 N/A GLU 113.A N LYS 256.A O no hydrogen 2.742 N/A LYS 114.A NZ ILE 72.A O no hydrogen 3.199 N/A ILE 115.A N ALA 254.A O no hydrogen 2.930 N/A GLN 116.A NE2 GLU 252.A OE2 no hydrogen 3.237 N/A ILE 117.A N GLU 252.A O no hydrogen 2.949 N/A ILE 118.A N GLU 252.A O no hydrogen 3.274 N/A SER 122.A N PRO 119.A O no hydrogen 3.186 N/A SER 122.A OG PRO 119.A O no hydrogen 3.074 N/A HIS 126.A NE2 PRO 159.A O no hydrogen 2.861 N/A GLU 127.A N ILE 152.A O no hydrogen 2.879 N/A VAL 132.A N SER 130A.A O no hydrogen 2.855 N/A SER 133.A N SER 143.A O no hydrogen 2.922 N/A ALA 135.A N SER 133.A OG no hydrogen 3.111 N/A CYS 136.A N SER 133.A O no hydrogen 2.997 N/A TYR 138.A N ARG 141.A O no hydrogen 2.730 N/A ARG 141.A N TYR 138.A O no hydrogen 2.968 N/A SER 143.A N SER 133.A O no hydrogen 3.198 N/A PHE 144.A N SER 143.A OG no hydrogen 2.736 N/A ARG 146.A N GLY 64.A O no hydrogen 2.754 N/A ARG 146.A NE ASP 69.A OD2 no hydrogen 2.537 N/A ASN 147.A N LEU 63.A O no hydrogen 3.057 N/A ASN 147.A ND2 LEU 62.A O no hydrogen 2.746 N/A VAL 149.A N ALA 250.A O no hydrogen 2.791 N/A TRP 150.A NE1 TYR 192.A OH no hydrogen 2.869 N/A ILE 152.A N GLU 127.A O no hydrogen 2.978 N/A LYS 153.A N LEU 191.A O no hydrogen 2.839 N/A LYS 153.A NZ THR 189.A O no hydrogen 2.811 N/A LYS 153.A NZ LYS 190.A O no hydrogen 3.057 N/A LYS 153.A NZ GLN 193.A OE1 no hydrogen 2.978 N/A LYS 154.A N ALA 157.A O no hydrogen 2.972 N/A LYS 154.A NZ SER 124.A O no hydrogen 2.590 N/A ALA 157.A N LYS 154.A O no hydrogen 2.926 N/A ILE 161.A N SER 244.A O no hydrogen 2.614 N/A ARG 163.A N PHE 242.A O no hydrogen 3.183 N/A ARG 163.A NH1 SER 122.A O no hydrogen 3.119 N/A ARG 163.A NH1 SER 122.A OG no hydrogen 2.884 N/A ARG 163.A NH2 SER 122.A OG no hydrogen 2.910 N/A SER 164.A OG ILE 240.A O no hydrogen 3.531 N/A SER 164.A OG ASN 241.A OD1 no hydrogen 2.486 N/A TYR 165.A N ILE 240.A O no hydrogen 2.856 N/A ASN 167.A N ASP 238.A O no hydrogen 2.953 N/A ASN 167.A ND2 GLU 171.A O no hydrogen 2.738 N/A ASN 167.A ND2 LEU 234.A O no hydrogen 3.172 N/A ASN 167.A ND2 LYS 235.A O no hydrogen 3.172 N/A SER 169.A N ASN 167.A OD1 no hydrogen 3.158 N/A SER 169.A OG ASN 167.A OD1 no hydrogen 2.910 N/A GLU 171.A N SER 169.A OG no hydrogen 2.906 N/A LEU 173.A N LEU 234.A O no hydrogen 2.736 N/A LEU 174.A N TYR 255.A O no hydrogen 2.693 N/A VAL 175.A N THR 232.A O no hydrogen 2.983 N/A TRP 177.A N PHE 230.A O no hydrogen 3.086 N/A TRP 177.A NE1 GLN 208.A OE1 no hydrogen 3.164 N/A GLY 178.A N ILE 249.A O no hydrogen 2.941 N/A ILE 179.A N GLU 228.A O no hydrogen 2.914 N/A HIS 180.A N ASN 247.A O no hydrogen 2.975 N/A HIS 180.A ND1 TYR 192.A OH no hydrogen 2.643 N/A HIS 181.A N ARG 226.A O no hydrogen 2.827 N/A HIS 181.A NE2 GLU 228.A OE1 no hydrogen 2.968 N/A ASN 183.A N GLU 187.A OE2 no hydrogen 3.175 N/A ASN 183.A ND2 ASP 184.A OD2 no hydrogen 3.502 N/A GLU 187.A N ASP 184.A OD1 no hydrogen 3.122 N/A GLN 188.A N ASP 184.A O no hydrogen 3.226 N/A GLN 188.A NE2 ASN 194.A O no hydrogen 3.047 N/A GLN 188.A NE2 ASN 247.A OD1 no hydrogen 2.899 N/A THR 189.A N ALA 185.A O no hydrogen 3.154 N/A THR 189.A OG1 ALA 185.A O no hydrogen 3.088 N/A LYS 190.A N ALA 186.A O no hydrogen 2.978 N/A LEU 191.A N GLU 187.A O no hydrogen 3.021 N/A TYR 192.A N GLN 188.A O no hydrogen 3.042 N/A TYR 192.A OH HIS 180.A ND1 no hydrogen 2.643 N/A GLN 193.A N THR 189.A O no hydrogen 3.041 N/A ASN 194.A N TYR 192.A O no hydrogen 2.640 N/A ASN 194.A ND2 TYR 158.A O no hydrogen 3.089 N/A ASN 194.A ND2 ASN 245.A O no hydrogen 2.712 N/A THR 197.A OG1 ASN 247.A OD1 no hydrogen 2.822 N/A TYR 198.A N ASN 245.A OD1 no hydrogen 3.006 N/A ILE 199.A N LEU 210.A O no hydrogen 2.715 N/A SER 200.A N GLU 243.A O no hydrogen 2.791 N/A VAL 201.A N GLN 208.A O no hydrogen 2.820 N/A GLY 202.A N ASN 241.A O no hydrogen 2.979 N/A THR 203.A N LEU 206.A O no hydrogen 3.166 N/A THR 203.A OG1 THR 205.A OG1 no hydrogen 3.371 N/A SER 204.A N ASP 238.A OD2 no hydrogen 2.963 N/A SER 204.A OG ASP 238.A OD2 no hydrogen 3.112 N/A THR 205.A N THR 203.A OG1 no hydrogen 2.959 N/A THR 205.A OG1 THR 203.A OG1 no hydrogen 3.371 N/A LEU 206.A N THR 203.A OG1 no hydrogen 2.538 N/A GLN 208.A N VAL 201.A O no hydrogen 2.861 N/A LEU 210.A N ILE 199.A O no hydrogen 2.761 N/A ARG 213.A N HIS 181.A ND1 no hydrogen 2.856 N/A ARG 217.A NH1 HIS 181.A O no hydrogen 3.372 N/A ARG 217.A NH1 PRO 182.A O no hydrogen 3.332 N/A ARG 217.A NH1 SER 224.A O no hydrogen 2.672 N/A ARG 217.A NH2 PRO 182.A O no hydrogen 3.323 N/A VAL 220.A N GLN 223.A O no hydrogen 2.914 N/A ASN 221.A ND2 CYS 91.A O no hydrogen 2.750 N/A GLN 223.A N VAL 220.A O no hydrogen 2.819 N/A GLN 223.A NE2 ASN 221.A O no hydrogen 3.512 N/A SER 224.A OG ARG 217.A O no hydrogen 3.124 N/A ARG 226.A N HIS 181.A O no hydrogen 3.067 N/A ARG 226.A NH1 GLN 223.A O no hydrogen 2.919 N/A ARG 226.A NH1 GLY 225.A O no hydrogen 2.761 N/A ARG 226.A NH2 SER 218.A O no hydrogen 2.815 N/A MET 227.A N PRO 93.A O no hydrogen 2.794 N/A GLU 228.A N ILE 179.A O no hydrogen 2.923 N/A PHE 229.A N ASP 95.A O no hydrogen 2.826 N/A PHE 230.A N TRP 177.A O no hydrogen 2.780 N/A TRP 231.A NE1 ASP 98.A O no hydrogen 3.055 N/A THR 232.A N VAL 175.A O no hydrogen 3.145 N/A THR 232.A OG1 ILE 233.A O no hydrogen 3.518 N/A LEU 234.A N LEU 173.A O no hydrogen 2.726 N/A ASN 237.A N ASN 167.A O no hydrogen 2.796 N/A ASP 238.A N LYS 235.A O no hydrogen 3.163 N/A ILE 240.A N TYR 165.A O no hydrogen 2.782 N/A ASN 241.A N GLY 202.A O no hydrogen 2.694 N/A ASN 241.A ND2 GLY 202.A O no hydrogen 3.652 N/A PHE 242.A N ARG 163.A O no hydrogen 2.949 N/A GLU 243.A N SER 200.A O no hydrogen 2.986 N/A SER 244.A N ILE 161.A O no hydrogen 3.115 N/A SER 244.A OG TYR 198.A O no hydrogen 2.966 N/A ASN 245.A ND2 THR 196.A O no hydrogen 3.045 N/A GLY 246.A N SER 244.A OG no hydrogen 3.090 N/A ASN 247.A ND2 HIS 180.A O no hydrogen 2.906 N/A ASN 247.A ND2 GLN 188.A OE1 no hydrogen 2.992 N/A ILE 249.A N GLY 178.A O no hydrogen 2.859 N/A ALA 250.A N VAL 149.A O no hydrogen 2.827 N/A GLU 252.A N ASN 147.A O no hydrogen 2.854 N/A TYR 253.A N ASN 147.A O no hydrogen 3.062 N/A ALA 254.A N ILE 115.A O no hydrogen 2.844 N/A TYR 255.A N LEU 174.A O no hydrogen 2.997 N/A TYR 255.A OH LEU 62.A O no hydrogen 2.851 N/A LYS 256.A N GLU 113.A O no hydrogen 2.905 N/A ILE 257.A N ASP 172.A O no hydrogen 2.977 N/A VAL 258.A N HIS 111.A O no hydrogen 2.997 N/A LYS 259.A N HIS 111.A O no hydrogen 3.446 N/A GLY 261.A N ARG 108.A O no hydrogen 3.256 N/A SER 263.A OG ILE 109.A O no hydrogen 3.293 N/A ALA 264.A N SER 263.A OG no hydrogen 2.841 N/A MET 266.A N ILE 80.A O no hydrogen 2.747 N/A LYS 267.A NZ GLU 82.A OE1 no hydrogen 3.245 N/A LYS 267.A NZ LYS 83.A O no hydrogen 3.048 N/A SER 268.A N GLU 82.A O no hydrogen 3.043 N/A SER 268.A OG PRO 282.A O no hydrogen 2.776 N/A LEU 270.A N SER 268.A OG no hydrogen 3.131 N/A TYR 272.A OH ASP 44.A OD1 no hydrogen 2.631 N/A GLY 273.A N LEU 42.A O no hydrogen 3.059 N/A CYS 275.A SG GLY 273.A O no hydrogen 3.859 N/A THR 277.A N ASP 44.A O no hydrogen 3.098 N/A THR 277.A OG1 CYS 279.A O no hydrogen 3.088 N/A CYS 279.A N THR 277.A OG1 no hydrogen 3.161 N/A GLN 280.A N ILE 300.A O no hydrogen 3.000 N/A GLN 280.A NE2 LYS 41.A O no hydrogen 2.944 N/A GLN 280.A NE2 THR 281.A O no hydrogen 2.996 N/A THR 281.A N GLY 284.A O no hydrogen 3.087 N/A THR 281.A OG1 GLY 284.A O no hydrogen 2.944 N/A MET 283.A N THR 281.A OG1 no hydrogen 3.104 N/A GLY 284.A N THR 281.A O no hydrogen 3.053 N/A ALA 285.A N ASN 39.A OD1 no hydrogen 3.112 N/A ILE 286.A N CYS 279.A O no hydrogen 2.962 N/A SER 288.A OG GLU 35.A OE1 no hydrogen 2.586 N/A MET 290.A N SER 288.A OG no hydrogen 3.000 N/A PHE 292.A N ILE 33.A O no hydrogen 3.095 N/A HIS 293.A N LYS 305.A O no hydrogen 2.911 N/A HIS 293.A NE2 HIS 296.A O no hydrogen 2.825 N/A ASN 294.A N GLU 35.A O no hydrogen 3.166 N/A ASN 294.A ND2 SER 309.A O no hydrogen 2.786 N/A LEU 298.A N HIS 296.A ND1 no hydrogen 2.720 N/A ILE 300.A N GLN 280.A O no hydrogen 3.017 N/A GLU 302.A N LYS 278.A O no hydrogen 2.807 N/A CYS 303.A SG THR 299.A OG1 no hydrogen 3.501 N/A CYS 303.A SG ILE 300.A O no hydrogen 3.653 N/A LYS 305.A N PRO 291.A O no hydrogen 2.908 N/A VAL 307.A N HIS 293.A O no hydrogen 3.043 N/A LEU 314.A N GLN 31.A O no hydrogen 3.034 N/A THR 316.A N HIS 29.A O no hydrogen 2.915 N/A THR 316.A OG1 HIS 29.A O no hydrogen 2.661 N/A GLY 317.A N HIS 29.A O no hydrogen 2.691 N/A ARG 319.A NH1 GLU 22.A OE1 no hydrogen 3.167 N/A ARG 319.A NH2 GLU 22.A OE1 no hydrogen 3.495 N/A ARG 319.A NH2 GLU 22.A OE2 no hydrogen 3.109 N/A ASN 320.A N THR 26A.A O no hydrogen 3.053 N/A ASN 320.A ND2 SER 13.A O no hydrogen 3.301 N/A ASN 320.A ND2 ASN 11A.A O no hydrogen 2.971 N/A ASN 320.A ND2 ASN 11A.A OD1 no hydrogen 2.958 N/A SER 321.A N ASN 320.A OD1 no hydrogen 2.622 N/A ASN 11A.A N ASN 320.A OD1 no hydrogen 3.143 N/A ASN 11A.A ND2 HIS 9.A NE2 no hydrogen 3.631 N/A ASN 11A.A ND2 THR 28.A O no hydrogen 3.293 N/A LEU 45A.A N VAL 48.A O no hydrogen 2.915 N/A LYS 120A.A N GLU 252.A OE2 no hydrogen 2.925 N/A