Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4juk_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 16.A N VAL 24.A O no hydrogen 3.217 N/A THR 18.A N GLU 21.A O no hydrogen 2.749 N/A THR 18.A OG1 GLU 21.A O no hydrogen 3.044 N/A GLU 21.A N THR 18.A OG1 no hydrogen 3.051 N/A LYS 22.A NZ THR 18.A O no hydrogen 2.854 N/A ASN 23.A N ASP 17.A OD1 no hydrogen 3.359 N/A VAL 24.A N VAL 16.A O no hydrogen 2.852 N/A VAL 26.A N GLU 14.A O no hydrogen 3.027 N/A THR 27.A N LEU 317.A O no hydrogen 2.741 N/A THR 27.A OG1 ASN 319.A OD1 no hydrogen 3.164 N/A THR 27.A OG1 ASN 10A.A OD1 no hydrogen 3.220 N/A GLN 30.A N LEU 313.A O no hydrogen 2.846 N/A ILE 32.A N LEU 311.A O no hydrogen 3.113 N/A LEU 33.A N ASP 31.A OD1 no hydrogen 3.391 N/A GLU 34.A N PHE 291.A O no hydrogen 2.595 N/A LYS 35.A NZ ASP 31.A OD2 no hydrogen 3.193 N/A LYS 35.A NZ LEU 33.A O no hydrogen 2.946 N/A THR 36.A N GLU 34.A OE2 no hydrogen 3.049 N/A ASN 38.A N ALA 284.A O no hydrogen 2.996 N/A GLY 39.A N HIS 37.A ND1 no hydrogen 3.043 N/A LYS 40.A N ASN 38.A OD1 no hydrogen 2.879 N/A LYS 40.A NZ ASN 38.A O no hydrogen 3.181 N/A LEU 41.A N GLU 270.A O no hydrogen 3.072 N/A CYS 42.A N GLN 279.A OE1 no hydrogen 2.738 N/A CYS 42.A SG LYS 40.A O no hydrogen 3.734 N/A ASP 43.A N CYS 274.A O no hydrogen 3.043 N/A ASN 45.A N THR 276.A O no hydrogen 2.983 N/A GLY 46.A N ASN 275.A OD1 no hydrogen 2.768 N/A VAL 47.A N LEU 44A.A O no hydrogen 3.282 N/A LEU 50.A N TYR 78.A O no hydrogen 2.886 N/A LEU 52.A N VAL 80.A O no hydrogen 2.959 N/A LYS 53.A NZ GLU 69.A OE1 no hydrogen 2.841 N/A LYS 53.A NZ GLU 69.A OE2 no hydrogen 3.077 N/A CYS 55.A N LEU 52.A O no hydrogen 2.838 N/A CYS 55.A SG MET 66.A O no hydrogen 4.048 N/A SER 56.A N ASN 87.A O no hydrogen 3.057 N/A SER 56.A OG ASP 88.A OD1 no hydrogen 2.387 N/A VAL 57.A N GLU 81.A OE2 no hydrogen 3.009 N/A ALA 58.A N TYR 98.A OH no hydrogen 3.141 N/A GLY 59.A N SER 56.A OG no hydrogen 3.226 N/A TRP 60.A N SER 56.A O no hydrogen 2.943 N/A LEU 61.A N VAL 57.A O no hydrogen 2.978 N/A LEU 62.A N ALA 58.A O no hydrogen 2.978 N/A GLY 63.A N GLY 59.A O no hydrogen 3.009 N/A ASN 64.A N GLY 59.A O no hydrogen 2.891 N/A ASN 64.A ND2 ASP 88.A O no hydrogen 3.443 N/A MET 66.A N ASN 64.A OD1 no hydrogen 2.914 N/A CYS 67.A N ASN 64.A O no hydrogen 2.869 N/A PHE 70.A N CYS 67.A O no hydrogen 2.804 N/A ILE 71.A N ASP 68.A O no hydrogen 2.990 N/A TRP 76.A N ASN 109.A O no hydrogen 3.012 N/A SER 77.A N LYS 48.A O no hydrogen 3.175 N/A SER 77.A OG VAL 47.A O no hydrogen 2.913 N/A TYR 78.A OH CYS 42.A O no hydrogen 2.717 N/A ILE 79.A N THR 263.A O no hydrogen 2.961 N/A VAL 80.A N LEU 50.A O no hydrogen 2.877 N/A GLU 81.A N MET 265.A O no hydrogen 2.978 N/A LYS 82.A NZ LYS 53.A O no hydrogen 3.546 N/A ALA 83.A N GLU 268.A OE2 no hydrogen 3.244 N/A ASN 87.A N ASP 54.A O no hydrogen 2.919 N/A TYR 91.A OH HIS 179.A NE2 no hydrogen 3.338 N/A ASN 94.A N ASP 227.A OD1 no hydrogen 2.893 N/A ASN 96.A N PHE 228.A O no hydrogen 2.881 N/A GLU 99.A N GLU 99.A OE1 no hydrogen 2.574 N/A LEU 101.A N ASP 97.A O no hydrogen 3.054 N/A LYS 102.A N TYR 98.A O no hydrogen 3.006 N/A HIS 103.A N GLU 99.A O no hydrogen 2.856 N/A LEU 104.A N GLU 100.A O no hydrogen 3.070 N/A LEU 105.A N LEU 101.A O no hydrogen 2.848 N/A SER 106.A N LYS 102.A O no hydrogen 2.992 N/A SER 106.A N HIS 103.A O no hydrogen 3.334 N/A SER 106.A OG HIS 103.A O no hydrogen 2.971 N/A ARG 107.A N LEU 104.A O no hydrogen 3.037 N/A ILE 108.A N LEU 105.A O no hydrogen 2.860 N/A ASN 109.A N LYS 258.A O no hydrogen 2.699 N/A ASN 109.A ND2 TRP 76.A O no hydrogen 3.474 N/A ASN 109.A ND2 ASP 261A.A O no hydrogen 3.200 N/A HIS 110.A N LYS 258.A O no hydrogen 3.359 N/A HIS 110.A NE2 VAL 73.A O no hydrogen 3.032 N/A GLU 112.A N LYS 255.A O no hydrogen 2.810 N/A LYS 113.A NZ ILE 71.A O no hydrogen 2.713 N/A ILE 114.A N ALA 253.A O no hydrogen 2.959 N/A GLN 115.A NE2 GLU 251.A OE2 no hydrogen 3.470 N/A ILE 116.A N GLU 251.A O no hydrogen 3.023 N/A ILE 117.A N GLU 251.A O no hydrogen 3.299 N/A SER 121.A N PRO 118.A O no hydrogen 2.922 N/A SER 121.A OG PRO 118.A O no hydrogen 2.644 N/A HIS 125.A NE2 PRO 158.A O no hydrogen 2.940 N/A GLU 126.A N ILE 151.A O no hydrogen 2.928 N/A SER 132.A N SER 142.A O no hydrogen 3.041 N/A SER 132.A OG GLN 222.A OE1 no hydrogen 3.356 N/A ALA 134.A N SER 132.A OG no hydrogen 2.676 N/A CYS 135.A N SER 132.A O no hydrogen 3.143 N/A TYR 137.A N ASN 140.A O no hydrogen 2.874 N/A SER 142.A N CYS 135.A O no hydrogen 2.766 N/A SER 142.A OG PHE 143.A O no hydrogen 3.451 N/A PHE 143.A N SER 142.A OG no hydrogen 2.675 N/A ARG 145.A N GLY 63.A O no hydrogen 2.792 N/A ARG 145.A NH1 ASP 68.A OD1 no hydrogen 2.609 N/A ASN 146.A N LEU 62.A O no hydrogen 3.037 N/A ASN 146.A ND2 LEU 61.A O no hydrogen 2.675 N/A ASN 146.A ND2 TYR 254.A OH no hydrogen 3.113 N/A VAL 148.A N ALA 249.A O no hydrogen 2.760 N/A TRP 149.A NE1 TYR 191.A OH no hydrogen 2.968 N/A ILE 151.A N GLU 126.A O no hydrogen 2.876 N/A LYS 152.A N LEU 190.A O no hydrogen 2.991 N/A LYS 152.A NZ THR 188.A O no hydrogen 3.220 N/A LYS 152.A NZ GLN 192.A OE1 no hydrogen 3.032 N/A LYS 153.A N ALA 156.A O no hydrogen 3.106 N/A LYS 153.A NZ SER 123.A O no hydrogen 2.741 N/A ILE 160.A N SER 243.A O no hydrogen 2.767 N/A LYS 162.A N PHE 241.A O no hydrogen 3.107 N/A LYS 162.A NZ SER 121.A O no hydrogen 2.707 N/A LYS 162.A NZ SER 121.A OG no hydrogen 3.094 N/A TYR 164.A N ILE 239.A O no hydrogen 2.928 N/A ASN 166.A N ASP 237.A O no hydrogen 2.808 N/A ASN 166.A ND2 GLU 170.A O no hydrogen 3.040 N/A ASN 166.A ND2 LEU 233.A O no hydrogen 3.152 N/A ASN 168.A N ASN 166.A OD1 no hydrogen 2.982 N/A ASN 168.A ND2 ASN 166.A OD1 no hydrogen 2.762 N/A LEU 172.A N LEU 233.A O no hydrogen 2.882 N/A LEU 173.A N TYR 254.A O no hydrogen 2.858 N/A VAL 174.A N THR 231.A O no hydrogen 3.015 N/A TRP 176.A N PHE 229.A O no hydrogen 2.894 N/A GLY 177.A N ILE 248.A O no hydrogen 2.934 N/A ILE 178.A N ASP 227.A O no hydrogen 2.891 N/A HIS 179.A N ASN 246.A O no hydrogen 2.947 N/A HIS 180.A N ARG 225.A O no hydrogen 2.785 N/A HIS 180.A NE2 ASP 227.A OD2 no hydrogen 2.759 N/A ASN 182.A ND2 ASP 183.A OD2 no hydrogen 2.742 N/A GLU 186.A N ASP 183.A OD1 no hydrogen 2.964 N/A GLN 187.A N ASP 183.A O no hydrogen 3.392 N/A GLN 187.A NE2 ASN 193.A O no hydrogen 2.829 N/A GLN 187.A NE2 ASN 246.A OD1 no hydrogen 3.294 N/A THR 188.A N GLU 184.A O no hydrogen 3.023 N/A THR 188.A OG1 GLU 184.A O no hydrogen 3.389 N/A THR 188.A OG1 ALA 185.A O no hydrogen 2.774 N/A ARG 189.A N ALA 185.A O no hydrogen 2.750 N/A TYR 191.A N GLN 187.A O no hydrogen 3.066 N/A TYR 191.A OH HIS 179.A ND1 no hydrogen 2.808 N/A GLN 192.A N THR 188.A O no hydrogen 2.904 N/A ASN 193.A N TYR 191.A O no hydrogen 2.474 N/A ASN 193.A ND2 TYR 157.A O no hydrogen 2.995 N/A ASN 193.A ND2 ASN 244.A O no hydrogen 2.656 N/A THR 196.A OG1 ASN 246.A OD1 no hydrogen 2.632 N/A TYR 197.A N ASN 244.A OD1 no hydrogen 3.120 N/A TYR 197.A OH GLU 242.A OE2 no hydrogen 2.700 N/A ILE 198.A N LEU 209.A O no hydrogen 2.877 N/A SER 199.A N GLU 242.A O no hydrogen 2.769 N/A SER 199.A OG GLU 242.A O no hydrogen 3.554 N/A ILE 200.A N GLN 207.A O no hydrogen 2.757 N/A GLY 201.A N ASN 240.A O no hydrogen 2.891 N/A THR 202.A N LEU 205.A O no hydrogen 2.922 N/A SER 203.A N ASP 237.A OD2 no hydrogen 3.133 N/A SER 203.A OG ASP 237.A OD2 no hydrogen 2.881 N/A THR 204.A N THR 202.A OG1 no hydrogen 3.264 N/A LEU 205.A N THR 202.A OG1 no hydrogen 2.957 N/A GLN 207.A N ILE 200.A O no hydrogen 2.792 N/A LEU 209.A N ILE 198.A O no hydrogen 2.897 N/A LYS 212.A N HIS 180.A ND1 no hydrogen 2.887 N/A ALA 214.A N PRO 181.A O no hydrogen 3.366 N/A ARG 216.A NH1 HIS 180.A O no hydrogen 3.092 N/A ARG 216.A NH1 PRO 181.A O no hydrogen 3.023 N/A ARG 216.A NH1 SER 223.A O no hydrogen 3.152 N/A ARG 216.A NH2 PRO 181.A O no hydrogen 3.468 N/A ARG 216.A NH2 LYS 212.A O no hydrogen 2.329 N/A VAL 219.A N GLN 222.A O no hydrogen 2.769 N/A ASN 220.A ND2 CYS 90.A O no hydrogen 2.748 N/A GLN 222.A N VAL 219.A O no hydrogen 2.670 N/A SER 223.A OG ARG 216.A O no hydrogen 2.727 N/A ARG 225.A N HIS 180.A O no hydrogen 2.995 N/A ARG 225.A NH1 SER 217.A O no hydrogen 3.424 N/A ARG 225.A NH1 GLN 222.A O no hydrogen 3.166 N/A ARG 225.A NH1 GLY 224.A O no hydrogen 2.825 N/A ARG 225.A NH2 SER 217.A O no hydrogen 2.726 N/A ILE 226.A N PRO 92.A O no hydrogen 2.804 N/A ASP 227.A N ILE 178.A O no hydrogen 3.065 N/A PHE 228.A N ASN 94.A O no hydrogen 2.764 N/A PHE 229.A N TRP 176.A O no hydrogen 2.784 N/A THR 231.A N VAL 174.A O no hydrogen 2.993 N/A LEU 233.A N LEU 172.A O no hydrogen 2.646 N/A ASN 236.A N ASN 166.A O no hydrogen 2.781 N/A ASP 237.A N LYS 234.A O no hydrogen 3.154 N/A ALA 238.A N ASP 237.A OD1 no hydrogen 2.860 N/A ILE 239.A N TYR 164.A O no hydrogen 2.857 N/A ASN 240.A N GLY 201.A O no hydrogen 2.870 N/A PHE 241.A N LYS 162.A O no hydrogen 2.785 N/A GLU 242.A N SER 199.A O no hydrogen 2.932 N/A SER 243.A N ILE 160.A O no hydrogen 3.215 N/A SER 243.A OG TYR 197.A O no hydrogen 3.062 N/A ASN 244.A ND2 THR 195.A O no hydrogen 3.265 N/A GLY 245.A N SER 243.A OG no hydrogen 3.145 N/A ASN 246.A ND2 HIS 179.A O no hydrogen 2.841 N/A ASN 246.A ND2 GLN 187.A OE1 no hydrogen 3.090 N/A ILE 248.A N GLY 177.A O no hydrogen 3.097 N/A ALA 249.A N VAL 148.A O no hydrogen 2.819 N/A GLU 251.A N ASN 146.A O no hydrogen 2.942 N/A TYR 252.A N ASN 146.A O no hydrogen 3.228 N/A ALA 253.A N ILE 114.A O no hydrogen 2.805 N/A TYR 254.A N LEU 173.A O no hydrogen 3.078 N/A LYS 255.A N GLU 112.A O no hydrogen 2.742 N/A LYS 255.A NZ GLU 112.A OE2 no hydrogen 3.122 N/A LYS 255.A NZ ASN 168.A OD1 no hydrogen 3.502 N/A ILE 256.A N ASP 171.A O no hydrogen 3.041 N/A VAL 257.A N HIS 110.A O no hydrogen 3.299 N/A LYS 258.A N HIS 110.A O no hydrogen 3.414 N/A LYS 258.A NZ GLU 75.A OE1 no hydrogen 3.167 N/A LYS 258.A NZ GLU 75.A OE2 no hydrogen 2.927 N/A GLY 260.A N ARG 107.A O no hydrogen 3.125 N/A SER 262.A OG SER 77.A O no hydrogen 3.386 N/A MET 265.A N ILE 79.A O no hydrogen 2.727 N/A LYS 266.A NZ GLU 81.A OE1 no hydrogen 3.085 N/A LYS 266.A NZ LYS 82.A O no hydrogen 2.871 N/A SER 267.A N GLU 81.A O no hydrogen 3.288 N/A SER 267.A OG PRO 281.A O no hydrogen 2.851 N/A VAL 269.A N SER 267.A OG no hydrogen 2.998 N/A TYR 271.A OH ASP 43.A OD2 no hydrogen 2.532 N/A GLY 272.A N LEU 41.A O no hydrogen 2.970 N/A CYS 274.A SG LEU 41.A O no hydrogen 3.732 N/A THR 276.A N ASP 43.A O no hydrogen 2.940 N/A THR 276.A OG1 CYS 278.A O no hydrogen 2.932 N/A THR 276.A OG1 ILE 285.A O no hydrogen 3.443 N/A CYS 278.A N THR 276.A OG1 no hydrogen 3.073 N/A GLN 279.A N ILE 299.A O no hydrogen 2.902 N/A GLN 279.A NE2 LYS 40.A O no hydrogen 3.324 N/A GLN 279.A NE2 THR 280.A O no hydrogen 2.957 N/A THR 280.A N GLY 283.A O no hydrogen 3.245 N/A THR 280.A OG1 GLY 283.A O no hydrogen 2.652 N/A MET 282.A N THR 280.A OG1 no hydrogen 3.045 N/A GLY 283.A N THR 280.A O no hydrogen 2.934 N/A GLY 283.A N THR 280.A OG1 no hydrogen 3.039 N/A ALA 284.A N ASN 38.A OD1 no hydrogen 3.107 N/A ILE 285.A N CYS 278.A O no hydrogen 2.937 N/A SER 287.A OG GLU 34.A OE1 no hydrogen 2.885 N/A MET 289.A N SER 287.A OG no hydrogen 2.900 N/A PHE 291.A N ILE 32.A O no hydrogen 3.337 N/A HIS 292.A N LYS 304.A O no hydrogen 3.030 N/A HIS 292.A NE2 HIS 295.A O no hydrogen 3.154 N/A ASN 293.A N GLU 34.A O no hydrogen 3.159 N/A ASN 293.A ND2 SER 308.A O no hydrogen 3.199 N/A LEU 297.A N HIS 295.A ND1 no hydrogen 3.130 N/A ILE 299.A N GLN 279.A O no hydrogen 3.030 N/A GLU 301.A N ARG 277.A O no hydrogen 2.905 N/A CYS 302.A SG THR 298.A OG1 no hydrogen 3.623 N/A CYS 302.A SG ILE 299.A O no hydrogen 3.746 N/A LYS 304.A N PRO 290.A O no hydrogen 2.806 N/A VAL 306.A N HIS 292.A O no hydrogen 2.967 N/A LEU 313.A N GLN 30.A O no hydrogen 2.791 N/A THR 315.A N HIS 28.A O no hydrogen 2.902 N/A THR 315.A OG1 HIS 28.A O no hydrogen 2.671 N/A GLY 316.A N HIS 28.A O no hydrogen 2.724 N/A ARG 318.A NH2 GLU 21.A OE1 no hydrogen 2.636 N/A ASN 319.A N THR 25A.A O no hydrogen 3.092 N/A ASN 319.A ND2 SER 12.A O no hydrogen 3.387 N/A ASN 319.A ND2 ASN 10A.A O no hydrogen 2.600 N/A ASN 10A.A N ASN 319.A OD1 no hydrogen 3.241 N/A LEU 44A.A N VAL 47.A O no hydrogen 2.948 N/A