Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3kul_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 3.A N THR 1.A OG1 no hydrogen 3.298 N/A ILE 4.A N VAL 76.A O no hydrogen 2.649 N/A ARG 8.A N GLU 5.A O no hydrogen 2.853 N/A ARG 8.A NE ARG 29.A O no hydrogen 2.883 N/A ARG 8.A NH2 ARG 29.A O no hydrogen 2.963 N/A ILE 9.A N ALA 6.A O no hydrogen 2.997 N/A HIS 10.A N ARG 27.A O no hydrogen 2.827 N/A GLU 12.A N TYR 25.A O no hydrogen 2.858 N/A LYS 13.A N TYR 25.A O no hydrogen 3.213 N/A ILE 15.A N VAL 23.A O no hydrogen 2.703 N/A SER 17.A N GLY 21.A O no hydrogen 2.853 N/A SER 17.A OG GLY 16.A O no hydrogen 3.235 N/A SER 20.A OG SER 20.A O no hydrogen 2.407 N/A GLU 22.A N ALA 42.A O no hydrogen 3.023 N/A VAL 23.A N ILE 15.A O no hydrogen 2.868 N/A CYS 24.A N ILE 40.A O no hydrogen 2.829 N/A TYR 25.A N LYS 13.A O no hydrogen 2.966 N/A GLY 26.A N VAL 38.A O no hydrogen 3.072 N/A ARG 27.A N HIS 10.A O no hydrogen 2.811 N/A LEU 28.A N VAL 36.A O no hydrogen 2.762 N/A ARG 29.A N ARG 8.A O no hydrogen 2.896 N/A GLN 33.A N VAL 30.A O no hydrogen 3.185 N/A VAL 36.A N LEU 28.A O no hydrogen 2.777 N/A VAL 38.A N GLY 26.A O no hydrogen 2.896 N/A ALA 39.A N THR 87.A O no hydrogen 3.030 N/A ILE 40.A N CYS 24.A O no hydrogen 2.563 N/A LYS 41.A N ILE 85.A O no hydrogen 2.975 N/A LYS 41.A NZ GLU 58.A OE2 no hydrogen 2.953 N/A ALA 42.A N GLU 22.A O no hydrogen 2.928 N/A LEU 43.A N ALA 83.A O no hydrogen 3.205 N/A LYS 44.A N SER 20.A O no hydrogen 3.129 N/A TYR 47.A OH ARG 81.A O no hydrogen 2.204 N/A GLN 51.A N THR 48.A O no hydrogen 3.003 N/A ARG 52.A N THR 48.A O no hydrogen 3.085 N/A ARG 52.A NH1 TYR 47.A OH no hydrogen 3.545 N/A ARG 52.A NH1 LEU 82.A O no hydrogen 2.732 N/A ARG 52.A NH2 THR 78.A O no hydrogen 2.852 N/A ASP 54.A N ARG 50.A O no hydrogen 3.112 N/A PHE 55.A N GLN 51.A O no hydrogen 2.830 N/A LEU 56.A N ARG 52.A O no hydrogen 2.974 N/A SER 57.A N ARG 53.A O no hydrogen 2.976 N/A SER 57.A OG ARG 53.A O no hydrogen 3.409 N/A SER 57.A OG ASP 54.A O no hydrogen 2.493 N/A GLU 58.A N PHE 55.A O no hydrogen 3.178 N/A SER 60.A N LEU 56.A O no hydrogen 2.960 N/A ILE 61.A N SER 57.A O no hydrogen 3.016 N/A MET 62.A N GLU 58.A O no hydrogen 3.124 N/A GLY 63.A N ALA 59.A O no hydrogen 3.017 N/A GLN 64.A N ILE 61.A O no hydrogen 3.127 N/A GLN 64.A NE2 SER 60.A O no hydrogen 3.105 N/A PHE 65.A N MET 62.A O no hydrogen 3.235 N/A ASP 66.A N TYR 124.A OH no hydrogen 2.802 N/A ASN 69.A ND2 CYS 148.A O no hydrogen 3.075 N/A ILE 70.A N HIS 67.A O no hydrogen 3.258 N/A ILE 71.A N VAL 150.A O no hydrogen 2.978 N/A ARG 72.A N GLU 88.A OE2 no hydrogen 2.689 N/A ARG 72.A NE GLU 74.A OE2 no hydrogen 2.957 N/A GLU 74.A N VAL 86.A O no hydrogen 2.674 N/A GLY 75.A N VAL 86.A O no hydrogen 3.119 N/A VAL 76.A N ARG 2.A O no hydrogen 2.841 N/A VAL 77.A N MET 84.A O no hydrogen 2.969 N/A THR 78.A N GLU 3.A OE2 no hydrogen 2.811 N/A THR 78.A OG1 GLU 3.A OE1 no hydrogen 2.505 N/A THR 78.A OG1 GLU 3.A OE2 no hydrogen 3.377 N/A ARG 79.A N GLU 3.A OE2 no hydrogen 3.223 N/A LEU 82.A N ARG 79.A O no hydrogen 3.278 N/A MET 84.A N VAL 77.A O no hydrogen 2.819 N/A ILE 85.A N LYS 41.A O no hydrogen 2.853 N/A VAL 86.A N GLY 75.A O no hydrogen 2.832 N/A THR 87.A N ALA 39.A O no hydrogen 2.913 N/A THR 87.A OG1 ALA 39.A O no hydrogen 3.557 N/A GLU 88.A N ARG 72.A O no hydrogen 2.984 N/A TYR 89.A N PRO 37.A O no hydrogen 3.331 N/A ASN 92.A N VAL 142.A O no hydrogen 2.926 N/A GLY 93.A N MET 90.A O no hydrogen 3.063 N/A SER 94.A OG ARG 138.A O no hydrogen 2.793 N/A LEU 95.A N VAL 140.A O no hydrogen 2.877 N/A THR 97.A N ASP 96.A OD1 no hydrogen 2.898 N/A THR 97.A OG1 SER 94.A O no hydrogen 3.175 N/A PHE 98.A N SER 94.A O no hydrogen 2.954 N/A LEU 99.A N LEU 95.A O no hydrogen 3.056 N/A ARG 100.A N ASP 96.A O no hydrogen 2.962 N/A ARG 100.A NE GLY 207.A O no hydrogen 2.765 N/A ARG 100.A NH2 ASP 96.A OD2 no hydrogen 3.215 N/A ARG 100.A NH2 GLY 207.A O no hydrogen 3.542 N/A THR 101.A N THR 97.A O no hydrogen 2.906 N/A THR 101.A OG1 THR 97.A O no hydrogen 2.947 N/A THR 101.A OG1 PHE 98.A O no hydrogen 3.204 N/A THR 101.A OG1 HIS 102.A ND1 no hydrogen 3.214 N/A HIS 102.A N LEU 99.A O no hydrogen 3.197 N/A HIS 102.A ND1 PHE 98.A O no hydrogen 2.746 N/A GLN 105.A N HIS 102.A O no hydrogen 2.951 N/A PHE 106.A N TYR 206.A OH no hydrogen 3.023 N/A THR 107.A N GLN 110.A OE1 no hydrogen 2.859 N/A THR 107.A OG1 GLN 110.A OE1 no hydrogen 3.522 N/A GLN 110.A N THR 107.A OG1 no hydrogen 3.070 N/A LEU 111.A N THR 107.A O no hydrogen 2.916 N/A VAL 112.A N ILE 108.A O no hydrogen 2.773 N/A GLY 113.A N MET 109.A O no hydrogen 2.869 N/A MET 114.A N GLN 110.A O no hydrogen 2.989 N/A LEU 115.A N LEU 111.A O no hydrogen 3.055 N/A ARG 116.A N VAL 112.A O no hydrogen 2.925 N/A ARG 116.A NE ASP 265.A OD1 no hydrogen 2.589 N/A ARG 116.A NH2 ASP 265.A OD2 no hydrogen 2.965 N/A GLY 117.A N GLY 113.A O no hydrogen 3.198 N/A VAL 118.A N MET 114.A O no hydrogen 3.217 N/A GLY 119.A N LEU 115.A O no hydrogen 2.758 N/A ALA 120.A N ARG 116.A O no hydrogen 2.746 N/A GLY 121.A N GLY 117.A O no hydrogen 2.988 N/A MET 122.A N VAL 118.A O no hydrogen 2.957 N/A ARG 123.A N GLY 119.A O no hydrogen 2.857 N/A TYR 124.A N ALA 120.A O no hydrogen 2.921 N/A LEU 125.A N GLY 121.A O no hydrogen 2.989 N/A SER 126.A N MET 122.A O no hydrogen 2.890 N/A SER 126.A OG MET 122.A O no hydrogen 2.689 N/A SER 126.A OG ARG 123.A O no hydrogen 3.129 N/A ASP 127.A N ARG 123.A O no hydrogen 2.942 N/A LEU 128.A N TYR 124.A O no hydrogen 3.283 N/A LEU 128.A N LEU 125.A O no hydrogen 3.079 N/A GLY 129.A N SER 126.A O no hydrogen 2.747 N/A TYR 130.A N LEU 125.A O no hydrogen 3.176 N/A VAL 131.A N ARG 157.A O no hydrogen 2.918 N/A HIS 132.A N ASP 192.A OD2 no hydrogen 2.658 N/A HIS 132.A NE2 SER 151.A O no hydrogen 2.877 N/A ARG 133.A N ASP 192.A OD1 no hydrogen 2.971 N/A ARG 133.A NH1 LEU 155.A O no hydrogen 2.822 N/A ASP 134.A N HIS 132.A ND1 no hydrogen 3.013 N/A ALA 137.A N GLU 202.A OE1 no hydrogen 3.110 N/A ASN 139.A N ALA 136.A O no hydrogen 2.740 N/A ASN 139.A ND2 ASP 134.A O no hydrogen 2.599 N/A VAL 140.A N ALA 137.A O no hydrogen 3.141 N/A LEU 141.A N LYS 149.A O no hydrogen 2.834 N/A VAL 142.A N GLY 93.A O no hydrogen 2.902 N/A ASP 143.A N VAL 147.A O no hydrogen 2.968 N/A LEU 146.A N ASP 143.A O no hydrogen 2.951 N/A VAL 147.A N ASP 143.A OD1 no hydrogen 2.787 N/A CYS 148.A SG LEU 146.A O no hydrogen 3.870 N/A LYS 149.A N LEU 141.A O no hydrogen 2.807 N/A LYS 149.A NZ GLU 88.A OE1 no hydrogen 2.781 N/A LYS 149.A NZ GLU 88.A OE2 no hydrogen 3.224 N/A VAL 150.A N ASN 69.A O no hydrogen 2.800 N/A SER 151.A N ASN 139.A O no hydrogen 3.056 N/A SER 151.A OG ASN 139.A O no hydrogen 2.755 N/A SER 156.A N PHE 153.A O no hydrogen 3.116 N/A ARG 157.A N VAL 131.A O no hydrogen 3.027 N/A ARG 157.A NH1 GLY 154.A O no hydrogen 3.099 N/A ARG 157.A NH1 SER 156.A O no hydrogen 2.910 N/A LEU 159.A N GLY 129.A O no hydrogen 2.558 N/A ASP 162.A N GLU 160.A O no hydrogen 2.772 N/A ALA 165.A N ASP 162.A O no hydrogen 3.194 N/A THR 168.A N ARG 185.A O no hydrogen 2.979 N/A ARG 175.A NH1 PRO 210.A O no hydrogen 2.968 N/A ARG 175.A NH1 TYR 211.A O no hydrogen 2.653 N/A ARG 175.A NH1 MET 214.A O no hydrogen 3.288 N/A ARG 175.A NH2 MET 214.A O no hydrogen 2.767 N/A ARG 175.A NH2 ASN 216.A OD1 no hydrogen 3.216 N/A TRP 176.A N PRO 173.A O no hydrogen 3.183 N/A TRP 176.A NE1 GLU 202.A OE1 no hydrogen 2.798 N/A THR 177.A N ILE 174.A O no hydrogen 3.280 N/A THR 177.A OG1 PRO 173.A O no hydrogen 2.647 N/A GLU 180.A N GLU 180.A OE1 no hydrogen 2.971 N/A ALA 181.A N ALA 178.A O no hydrogen 2.980 N/A ILE 182.A N ALA 178.A O no hydrogen 3.122 N/A ALA 183.A N PRO 179.A O no hydrogen 3.098 N/A PHE 184.A N GLU 180.A O no hydrogen 2.987 N/A SER 188.A N SER 191.A OG no hydrogen 2.958 N/A SER 191.A N SER 188.A OG no hydrogen 3.261 N/A SER 191.A OG SER 188.A O no hydrogen 2.901 N/A ASP 192.A N SER 188.A O no hydrogen 3.094 N/A VAL 193.A N SER 189.A O no hydrogen 2.893 N/A TRP 194.A N ALA 190.A O no hydrogen 3.036 N/A SER 195.A N SER 191.A O no hydrogen 3.215 N/A SER 195.A OG TRP 176.A O no hydrogen 2.630 N/A SER 195.A OG SER 191.A O no hydrogen 3.293 N/A PHE 196.A N ASP 192.A O no hydrogen 2.900 N/A GLY 197.A N VAL 193.A O no hydrogen 3.034 N/A VAL 198.A N TRP 194.A O no hydrogen 3.399 N/A VAL 199.A N SER 195.A O no hydrogen 2.943 N/A MET 200.A N PHE 196.A O no hydrogen 2.967 N/A TRP 201.A N GLY 197.A O no hydrogen 3.055 N/A TRP 201.A NE1 PRO 230.A O no hydrogen 2.837 N/A GLU 202.A N VAL 198.A O no hydrogen 2.891 N/A VAL 203.A N VAL 199.A O no hydrogen 2.956 N/A LEU 204.A N MET 200.A O no hydrogen 3.066 N/A ALA 205.A N TRP 201.A O no hydrogen 2.848 N/A TYR 206.A N VAL 203.A O no hydrogen 2.927 N/A GLY 207.A N GLU 202.A O no hydrogen 2.646 N/A GLU 208.A N ALA 205.A O no hydrogen 3.277 N/A MET 214.A N TYR 211.A O no hydrogen 3.148 N/A ASP 218.A N THR 215.A OG1 no hydrogen 3.293 N/A VAL 219.A N THR 215.A O no hydrogen 2.923 N/A ILE 220.A N ASN 216.A O no hydrogen 3.050 N/A SER 221.A N ARG 217.A O no hydrogen 3.065 N/A SER 222.A N ASP 218.A O no hydrogen 2.980 N/A SER 222.A OG ASP 218.A O no hydrogen 2.641 N/A VAL 223.A N VAL 219.A O no hydrogen 3.241 N/A GLU 224.A N ILE 220.A O no hydrogen 3.194 N/A GLU 225.A N SER 221.A O no hydrogen 3.111 N/A GLY 226.A N VAL 223.A O no hydrogen 3.007 N/A TYR 227.A N SER 222.A O no hydrogen 2.932 N/A ARG 228.A NE TRP 247.A O no hydrogen 3.078 N/A ARG 228.A NH1 VAL 223.A O no hydrogen 2.851 N/A ARG 228.A NH1 TYR 227.A O no hydrogen 2.843 N/A ARG 228.A NH2 TRP 247.A O no hydrogen 3.077 N/A CYS 235.A N PRO 232.A O no hydrogen 2.928 N/A CYS 235.A SG PRO 236.A O no hydrogen 3.470 N/A HIS 240.A N PRO 236.A O no hydrogen 3.021 N/A GLN 241.A N HIS 237.A O no hydrogen 2.798 N/A GLN 241.A NE2 ASP 245.A OD1 no hydrogen 2.854 N/A LEU 242.A N ALA 238.A O no hydrogen 3.070 N/A MET 243.A N LEU 239.A O no hydrogen 3.030 N/A LEU 244.A N HIS 240.A O no hydrogen 2.989 N/A ASP 245.A N GLN 241.A O no hydrogen 2.951 N/A CYS 246.A N LEU 242.A O no hydrogen 2.984 N/A CYS 246.A SG LEU 242.A O no hydrogen 3.329 N/A TRP 247.A N LEU 244.A O no hydrogen 2.938 N/A HIS 248.A N ASP 245.A O no hydrogen 3.165 N/A ASP 250.A N HIS 248.A ND1 no hydrogen 3.024 N/A ARG 251.A NH1 THR 186.A OG1 no hydrogen 3.027 N/A ALA 252.A N ASP 250.A OD1 no hydrogen 2.964 N/A GLN 253.A N ASP 250.A O no hydrogen 2.833 N/A GLN 253.A NE2 ASP 250.A OD2 no hydrogen 2.894 N/A ARG 254.A N ARG 251.A O no hydrogen 3.218 N/A ARG 254.A NE HIS 248.A O no hydrogen 2.623 N/A ARG 254.A NH1 GLU 180.A OE1 no hydrogen 3.288 N/A ARG 254.A NH1 GLU 180.A OE2 no hydrogen 2.860 N/A ARG 254.A NH1 ALA 190.A O no hydrogen 3.272 N/A ARG 254.A NH2 GLU 180.A OE1 no hydrogen 2.840 N/A ARG 254.A NH2 HIS 248.A O no hydrogen 2.962 N/A ARG 254.A NH2 LYS 249.A O.A no hydrogen 3.563 N/A ARG 254.A NH2 LYS 249.A O.B no hydrogen 3.451 N/A ARG 256.A N GLN 259.A OE1 no hydrogen 3.256 N/A ILE 260.A N ARG 256.A O no hydrogen 3.112 N/A VAL 261.A N PHE 257.A O no hydrogen 2.828 N/A SER 262.A N SER 258.A O no hydrogen 3.098 N/A SER 262.A OG SER 258.A O no hydrogen 3.003 N/A SER 262.A OG GLN 259.A O no hydrogen 3.048 N/A VAL 263.A N GLN 259.A O no hydrogen 2.981 N/A LEU 264.A N ILE 260.A O no hydrogen 3.071 N/A ASP 265.A N VAL 261.A O no hydrogen 2.763 N/A ALA 266.A N SER 262.A O no hydrogen 2.781 N/A LEU 267.A N VAL 263.A O no hydrogen 3.085 N/A ILE 268.A N LEU 264.A O no hydrogen 3.041 N/A ILE 268.A N ASP 265.A O no hydrogen 3.168 N/A ARG 269.A N ASP 265.A O no hydrogen 2.743 N/A SER 270.A N ALA 266.A O no hydrogen 2.610 N/A