Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5sk8_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 10.A NH1 GLU 13.A OE1 no hydrogen 2.937 N/A GLU 13.A N ARG 10.A O no hydrogen 2.879 N/A ILE 14.A N LEU 11.A O no hydrogen 2.792 N/A GLU 15.A N LYS 12.A O no hydrogen 3.419 N/A LEU 16.A N GLU 13.A O no hydrogen 2.880 N/A PHE 19.A N LEU 16.A O no hydrogen 3.377 N/A GLY 22.A N ASP 20.A OD2 no hydrogen 2.874 N/A MET 27.A N PHE 24.A O no hydrogen 3.084 N/A TRP 28.A N GLU 25.A O no hydrogen 3.052 N/A TRP 28.A NE1 GLY 22.A O no hydrogen 3.029 N/A ILE 31.A N MET 27.A O no hydrogen 2.996 N/A PHE 32.A N TRP 28.A O no hydrogen 2.930 N/A VAL 33.A N PRO 29.A O no hydrogen 3.019 N/A TYR 34.A N GLY 30.A O no hydrogen 2.990 N/A MET 35.A N ILE 31.A O no hydrogen 3.158 N/A VAL 36.A N PHE 32.A O no hydrogen 2.916 N/A HIS 37.A N VAL 33.A O no hydrogen 2.823 N/A ARG 38.A N TYR 34.A O no hydrogen 3.120 N/A ARG 38.A NE TYR 79.A OH no hydrogen 3.139 N/A SER 39.A N MET 35.A O no hydrogen 2.926 N/A SER 39.A OG MET 35.A O no hydrogen 2.721 N/A CYS 40.A N VAL 36.A O no hydrogen 2.835 N/A GLY 41.A N VAL 36.A O no hydrogen 3.293 N/A CYS 44.A N GLY 41.A O no hydrogen 3.335 N/A LEU 50.A N GLU 46.A O no hydrogen 3.060 N/A ARG 51.A NE GLY 148.A O no hydrogen 3.166 N/A ARG 51.A NH1 GLY 148.A O no hydrogen 2.907 N/A ARG 51.A NH2 GLU 48.A OE2 no hydrogen 2.921 N/A PHE 52.A N LYS 49.A O no hydrogen 2.765 N/A ILE 53.A N LEU 50.A O no hydrogen 2.751 N/A SER 55.A N ARG 51.A O no hydrogen 3.119 N/A SER 55.A OG ARG 51.A O no hydrogen 3.325 N/A SER 55.A OG HIS 149.A NE2 no hydrogen 2.773 N/A VAL 56.A N PHE 52.A O no hydrogen 2.976 N/A LYS 57.A N ILE 53.A O no hydrogen 3.033 N/A LYS 57.A NZ GLU 25.A OE1 no hydrogen 3.449 N/A LYS 58.A N MET 54.A O no hydrogen 3.113 N/A ASN 59.A N VAL 56.A O no hydrogen 3.033 N/A ASN 59.A ND2 SER 55.A O no hydrogen 2.670 N/A TYR 60.A N VAL 56.A O no hydrogen 3.250 N/A TYR 60.A N LYS 57.A O no hydrogen 3.166 N/A TYR 60.A OH LEU 102.A O no hydrogen 2.562 N/A ARG 61.A NE ASP 107.A OD1 no hydrogen 2.690 N/A ARG 61.A NH2 ASP 107.A OD1 no hydrogen 2.935 N/A TYR 65.A N GLU 236.A OE2 no hydrogen 2.901 N/A HIS 66.A N GLU 236.A OE2 no hydrogen 2.791 N/A HIS 66.A ND1 GLU 236.A OE1 no hydrogen 2.661 N/A ASN 67.A N TYR 65.A O no hydrogen 2.803 N/A ASN 67.A ND2 VAL 63.A O no hydrogen 3.080 N/A HIS 70.A N ASN 67.A OD1 no hydrogen 3.155 N/A HIS 70.A NE2 HIS 104.A NE2 no hydrogen 2.999 N/A ALA 71.A N ASN 67.A O no hydrogen 3.121 N/A VAL 72.A N TRP 68.A O no hydrogen 3.134 N/A THR 73.A N LYS 69.A O no hydrogen 2.938 N/A THR 73.A OG1 LYS 69.A O no hydrogen 2.692 N/A VAL 74.A N HIS 70.A O no hydrogen 2.800 N/A ALA 75.A N ALA 71.A O no hydrogen 3.041 N/A HIS 76.A N VAL 72.A O no hydrogen 2.790 N/A HIS 76.A NE2 ILE 14.A O no hydrogen 2.830 N/A CYS 77.A N THR 73.A O no hydrogen 3.107 N/A MET 78.A N VAL 74.A O no hydrogen 3.115 N/A TYR 79.A N ALA 75.A O no hydrogen 2.880 N/A TYR 79.A OH GLU 15.A OE1 no hydrogen 3.411 N/A TYR 79.A OH GLU 15.A OE2 no hydrogen 2.389 N/A ALA 80.A N HIS 76.A O no hydrogen 3.076 N/A ILE 81.A N CYS 77.A O no hydrogen 3.162 N/A LEU 82.A N MET 78.A O no hydrogen 2.835 N/A GLN 83.A N TYR 79.A O no hydrogen 2.849 N/A ASN 84.A N ALA 80.A O no hydrogen 3.241 N/A ASN 84.A ND2 ALA 80.A O no hydrogen 2.562 N/A ASN 85.A N LEU 82.A O no hydrogen 3.351 N/A ASN 85.A ND2 ILE 81.A O no hydrogen 2.647 N/A LEU 88.A N ASN 85.A O no hydrogen 3.093 N/A THR 90.A N GLU 93.A OE2 no hydrogen 3.047 N/A GLU 93.A N THR 90.A OG1 no hydrogen 3.016 N/A ARG 94.A N THR 90.A O no hydrogen 3.136 N/A ARG 94.A NH1 ASP 91.A OD2 no hydrogen 2.840 N/A LYS 95.A N ASP 91.A O no hydrogen 3.232 N/A GLY 96.A N LEU 92.A O no hydrogen 2.789 N/A LEU 97.A N GLU 93.A O no hydrogen 2.998 N/A ALA 100.A N GLY 96.A O no hydrogen 2.823 N/A CYS 101.A N LEU 97.A O no hydrogen 3.022 N/A CYS 101.A SG LEU 97.A O no hydrogen 3.375 N/A LEU 102.A N LEU 98.A O no hydrogen 3.063 N/A CYS 103.A N ILE 99.A O no hydrogen 3.167 N/A CYS 103.A N ALA 100.A O no hydrogen 3.263 N/A CYS 103.A SG ILE 99.A O no hydrogen 3.342 N/A HIS 104.A N CYS 101.A O no hydrogen 3.442 N/A HIS 104.A ND1 CYS 101.A O no hydrogen 2.665 N/A HIS 104.A NE2 HIS 70.A NE2 no hydrogen 2.999 N/A HIS 104.A NE2 ASP 215.A OD1 no hydrogen 2.946 N/A ASP 105.A N TYR 60.A OH no hydrogen 3.058 N/A LEU 106.A N CYS 103.A O no hydrogen 3.175 N/A HIS 108.A N ASP 105.A O no hydrogen 3.091 N/A ARG 109.A NE ASP 107.A O no hydrogen 2.980 N/A ARG 109.A NE ASP 107.A OD2 no hydrogen 3.360 N/A ARG 109.A NH2 ASP 107.A OD2 no hydrogen 2.774 N/A GLY 110.A N HIS 108.A ND1 no hydrogen 2.928 N/A SER 112.A N GLU 240.A OE1 no hydrogen 2.870 N/A SER 112.A OG GLU 240.A OE2 no hydrogen 2.626 N/A ASN 113.A ND2 GLU 133.A OE1 no hydrogen 2.735 N/A TYR 115.A N SER 112.A O no hydrogen 3.182 N/A TYR 115.A N SER 112.A OG no hydrogen 3.101 N/A LEU 116.A N SER 112.A O no hydrogen 3.320 N/A GLN 117.A N ASN 113.A O no hydrogen 3.092 N/A LYS 118.A N SER 114.A O no hydrogen 3.011 N/A PHE 119.A N TYR 115.A O no hydrogen 2.665 N/A ASP 120.A N GLN 117.A O no hydrogen 3.009 N/A HIS 121.A N LEU 116.A O no hydrogen 2.953 N/A LEU 123.A N HIS 121.A ND1 no hydrogen 3.057 N/A ALA 124.A N HIS 121.A O no hydrogen 2.942 N/A ALA 125.A N PRO 122.A O no hydrogen 2.955 N/A LEU 126.A N PRO 122.A O no hydrogen 3.147 N/A TYR 127.A N LEU 123.A O no hydrogen 2.927 N/A SER 130.A OG ASP 175.A OD2 no hydrogen 2.690 N/A THR 131.A OG1 TYR 127.A O no hydrogen 2.730 N/A MET 132.A N ASN 113.A OD1 no hydrogen 2.747 N/A GLN 134.A N SER 130.A O no hydrogen 2.878 N/A GLN 134.A NE2 THR 129.A O no hydrogen 2.935 N/A HIS 135.A N THR 131.A O no hydrogen 3.176 N/A HIS 135.A NE2 ASP 107.A OD2 no hydrogen 2.763 N/A HIS 136.A N MET 132.A O no hydrogen 2.801 N/A HIS 136.A ND1 LEU 106.A O no hydrogen 2.616 N/A PHE 137.A N GLU 133.A O no hydrogen 3.083 N/A SER 138.A N GLN 134.A O no hydrogen 3.067 N/A GLN 139.A N HIS 135.A O no hydrogen 2.977 N/A THR 140.A N HIS 136.A O no hydrogen 3.000 N/A THR 140.A OG1 HIS 136.A O no hydrogen 2.822 N/A VAL 141.A N PHE 137.A O no hydrogen 2.927 N/A SER 142.A N SER 138.A O no hydrogen 3.065 N/A SER 142.A OG SER 138.A O no hydrogen 3.375 N/A ILE 143.A N GLN 139.A O no hydrogen 3.153 N/A LEU 144.A N THR 140.A O no hydrogen 2.962 N/A GLN 145.A N VAL 141.A O no hydrogen 2.987 N/A GLN 145.A N SER 142.A O no hydrogen 3.255 N/A LEU 146.A N ILE 143.A O no hydrogen 3.033 N/A HIS 149.A N LEU 146.A O no hydrogen 3.104 N/A HIS 149.A ND1 GLU 147.A O no hydrogen 2.898 N/A HIS 149.A NE2 SER 55.A OG no hydrogen 2.773 N/A ILE 151.A N HIS 149.A O no hydrogen 2.782 N/A PHE 152.A N ASN 150.A OD1 no hydrogen 3.162 N/A SER 153.A N ASN 150.A O no hydrogen 3.105 N/A LEU 155.A N PHE 152.A O no hydrogen 3.086 N/A SER 156.A N GLU 159.A OE1 no hydrogen 3.120 N/A SER 156.A OG GLU 159.A OE1 no hydrogen 3.219 N/A GLU 159.A N SER 156.A OG no hydrogen 3.110 N/A TYR 160.A N SER 156.A O no hydrogen 2.707 N/A GLU 161.A N SER 157.A O no hydrogen 3.116 N/A GLN 162.A N SER 158.A O no hydrogen 3.055 N/A GLN 162.A NE2 SER 158.A O no hydrogen 3.487 N/A VAL 163.A N GLU 159.A O no hydrogen 2.905 N/A LEU 164.A N TYR 160.A O no hydrogen 3.076 N/A GLU 165.A N GLU 161.A O no hydrogen 3.111 N/A ILE 166.A N GLN 162.A O no hydrogen 2.853 N/A ILE 167.A N VAL 163.A O no hydrogen 2.971 N/A ARG 168.A N LEU 164.A O no hydrogen 2.795 N/A ARG 168.A NE GLU 165.A OE1 no hydrogen 3.077 N/A ARG 168.A NH1 GLU 165.A OE2 no hydrogen 2.569 N/A LYS 169.A N GLU 165.A O no hydrogen 2.977 N/A LYS 169.A NZ ASP 204.A OD1 no hydrogen 3.466 N/A LYS 169.A NZ ASP 204.A OD2 no hydrogen 2.718 N/A ALA 170.A N ILE 166.A O no hydrogen 2.871 N/A ILE 171.A N ILE 167.A O no hydrogen 2.870 N/A ILE 172.A N ARG 168.A O no hydrogen 2.993 N/A ALA 173.A N LYS 169.A O no hydrogen 2.985 N/A THR 174.A N ILE 171.A O no hydrogen 3.124 N/A THR 174.A OG1 ILE 171.A O no hydrogen 2.531 N/A ASP 175.A N ILE 172.A O no hydrogen 2.932 N/A ALA 177.A N ASP 175.A OD1 no hydrogen 3.144 N/A LEU 178.A N ASP 175.A O no hydrogen 2.779 N/A TYR 179.A N LEU 176.A O no hydrogen 3.118 N/A ASN 182.A N LEU 178.A O no hydrogen 3.228 N/A ASN 182.A ND2 ARG 205.A O no hydrogen 2.833 N/A ARG 183.A N TYR 179.A O no hydrogen 2.870 N/A ARG 183.A NH2 THR 281.A OG1 no hydrogen 2.897 N/A LYS 184.A N PHE 180.A O no hydrogen 3.155 N/A GLN 185.A N GLY 181.A O no hydrogen 3.010 N/A LEU 186.A N ASN 182.A O no hydrogen 3.028 N/A GLU 187.A N ARG 183.A O no hydrogen 2.830 N/A GLU 188.A N LYS 184.A O no hydrogen 3.002 N/A MET 189.A N GLN 185.A O no hydrogen 3.005 N/A TYR 190.A N LEU 186.A O no hydrogen 2.883 N/A GLN 191.A N GLU 187.A O no hydrogen 3.009 N/A THR 192.A N GLU 188.A O no hydrogen 2.936 N/A THR 192.A OG1 GLU 188.A O no hydrogen 3.207 N/A GLY 193.A N TYR 190.A O no hydrogen 3.217 N/A SER 194.A N MET 189.A O no hydrogen 2.881 N/A LEU 195.A N MET 189.A O no hydrogen 3.067 N/A ASN 196.A N HIS 202.A ND1 no hydrogen 2.922 N/A ASN 198.A N ASN 196.A OD1 no hydrogen 2.909 N/A ASN 198.A ND2 ASN 196.A OD1 no hydrogen 3.641 N/A ASN 199.A N ASN 196.A O no hydrogen 2.741 N/A GLN 200.A NE2 GLN 200.A O no hydrogen 3.262 N/A GLN 200.A NE2 ASP 204.A OD1 no hydrogen 2.853 N/A SER 201.A OG ASN 199.A OD1 no hydrogen 2.901 N/A ARG 203.A N ASN 199.A O no hydrogen 2.824 N/A ARG 203.A NE GLU 93.A OE1 no hydrogen 2.684 N/A ARG 203.A NH1 LEU 197.A O no hydrogen 2.787 N/A ARG 203.A NH2 LEU 88.A O no hydrogen 2.705 N/A ARG 203.A NH2 GLU 93.A OE1 no hydrogen 3.531 N/A ARG 203.A NH2 GLU 93.A OE2 no hydrogen 2.759 N/A ASP 204.A N GLN 200.A O no hydrogen 2.852 N/A ARG 205.A N SER 201.A O no hydrogen 3.403 N/A ARG 205.A NH1 ASN 182.A OD1 no hydrogen 3.122 N/A VAL 206.A N HIS 202.A O no hydrogen 3.011 N/A ILE 207.A N ARG 203.A O no hydrogen 2.869 N/A GLY 208.A N ASP 204.A O no hydrogen 2.938 N/A LEU 209.A N ARG 205.A O no hydrogen 3.020 N/A MET 210.A N VAL 206.A O no hydrogen 2.872 N/A MET 211.A N ILE 207.A O no hydrogen 2.864 N/A THR 212.A N GLY 208.A O no hydrogen 3.025 N/A THR 212.A OG1 GLY 208.A O no hydrogen 3.240 N/A ALA 213.A N LEU 209.A O no hydrogen 2.943 N/A CYS 214.A N MET 210.A O no hydrogen 2.979 N/A CYS 214.A SG MET 210.A O no hydrogen 3.210 N/A ASP 215.A N MET 211.A O no hydrogen 2.925 N/A LEU 216.A N THR 212.A O no hydrogen 3.073 N/A CYS 217.A N CYS 214.A O no hydrogen 3.226 N/A CYS 217.A SG CYS 214.A O no hydrogen 3.160 N/A VAL 219.A N LEU 216.A O no hydrogen 3.060 N/A THR 220.A N CYS 217.A O no hydrogen 2.923 N/A THR 220.A OG1 CYS 217.A O no hydrogen 2.558 N/A LYS 221.A NZ PHE 17.A O no hydrogen 3.143 N/A LYS 221.A NZ PHE 19.A O no hydrogen 2.892 N/A THR 226.A N LEU 222.A O no hydrogen 3.033 N/A THR 226.A OG1 SER 218.A O no hydrogen 2.773 N/A THR 226.A OG1 LYS 221.A O no hydrogen 3.181 N/A THR 226.A OG1 LEU 222.A O no hydrogen 3.378 N/A LYS 227.A N TRP 223.A O no hydrogen 2.801 N/A LEU 228.A N PRO 224.A O no hydrogen 3.145 N/A THR 229.A N VAL 225.A O no hydrogen 2.897 N/A THR 229.A OG1 VAL 225.A O no hydrogen 2.895 N/A ALA 230.A N THR 226.A O no hydrogen 3.176 N/A ALA 230.A N LYS 227.A O no hydrogen 3.267 N/A ILE 233.A N THR 229.A O no hydrogen 3.275 N/A TYR 234.A N ALA 230.A O no hydrogen 3.147 N/A ALA 235.A N ASN 231.A O no hydrogen 3.102 N/A PHE 237.A N ILE 233.A O no hydrogen 2.842 N/A TRP 238.A N TYR 234.A O no hydrogen 2.785 N/A GLU 240.A N GLU 236.A O no hydrogen 2.962 N/A GLY 241.A N PHE 237.A O no hydrogen 2.936 N/A ASP 242.A N TRP 238.A O no hydrogen 2.914 N/A GLU 243.A N ALA 239.A O no hydrogen 3.083 N/A MET 244.A N GLU 240.A O no hydrogen 2.848 N/A LYS 245.A N GLY 241.A O no hydrogen 2.932 N/A LYS 245.A NZ ASP 256.A OD1 no hydrogen 3.051 N/A LYS 245.A NZ ASP 258.A OD2 no hydrogen 3.557 N/A LYS 246.A N ASP 242.A O no hydrogen 2.972 N/A LYS 246.A NZ GLU 243.A OE2 no hydrogen 2.936 N/A LEU 247.A N GLU 243.A O no hydrogen 3.194 N/A LEU 247.A N MET 244.A O no hydrogen 2.874 N/A GLY 248.A N LYS 245.A O no hydrogen 2.976 N/A ILE 249.A N MET 244.A O no hydrogen 3.125 N/A MET 255.A N ILE 252.A O no hydrogen 3.104 N/A ASP 256.A N PRO 253.A O no hydrogen 3.170 N/A ARG 257.A NE ASP 242.A OD1 no hydrogen 3.289 N/A ARG 257.A NE ASP 242.A OD2 no hydrogen 3.243 N/A ARG 257.A NH2 ASP 242.A OD2 no hydrogen 2.855 N/A ASP 258.A N ASP 256.A OD1 no hydrogen 2.838 N/A LYS 259.A N ASP 256.A O no hydrogen 3.014 N/A GLU 262.A N LYS 259.A O no hydrogen 2.852 N/A VAL 263.A N LYS 260.A O no hydrogen 3.363 N/A GLY 266.A N GLU 262.A O no hydrogen 2.955 N/A GLN 267.A N VAL 263.A O no hydrogen 2.801 N/A GLN 267.A NE2 TYR 234.A OH no hydrogen 2.863 N/A LEU 268.A N PRO 264.A O no hydrogen 3.026 N/A GLY 269.A N GLN 265.A O no hydrogen 2.883 N/A PHE 270.A N GLY 266.A O no hydrogen 2.949 N/A TYR 271.A N GLN 267.A O no hydrogen 2.819 N/A ASN 272.A N LEU 268.A O no hydrogen 3.077 N/A ALA 273.A N GLY 269.A O no hydrogen 3.046 N/A VAL 274.A N PHE 270.A O no hydrogen 2.961 N/A ALA 275.A N PHE 270.A O no hydrogen 3.275 N/A ILE 276.A N TYR 271.A O no hydrogen 2.821 N/A CYS 278.A N VAL 274.A O no hydrogen 2.994 N/A TYR 279.A N ALA 275.A O no hydrogen 2.976 N/A TYR 279.A OH ALA 213.A O no hydrogen 2.621 N/A THR 280.A N ILE 276.A O no hydrogen 2.736 N/A THR 280.A OG1 ILE 276.A O no hydrogen 2.681 N/A THR 281.A N PRO 277.A O no hydrogen 2.931 N/A THR 281.A OG1 GLU 187.A OE1 no hydrogen 2.759 N/A THR 281.A OG1 PRO 277.A O no hydrogen 3.199 N/A LEU 282.A N CYS 278.A O no hydrogen 3.050 N/A THR 283.A N TYR 279.A O no hydrogen 2.842 N/A THR 283.A OG1 TYR 279.A O no hydrogen 2.819 N/A GLN 284.A N THR 280.A O no hydrogen 3.163 N/A GLN 284.A NE2 GLU 187.A OE1 no hydrogen 3.098 N/A GLN 284.A NE2 GLU 187.A OE2 no hydrogen 3.567 N/A ILE 285.A N THR 281.A O no hydrogen 3.249 N/A LEU 286.A N LEU 282.A O no hydrogen 2.711 N/A THR 289.A N LEU 286.A O no hydrogen 2.983 N/A THR 289.A OG1 LEU 286.A O no hydrogen 2.759 N/A GLU 290.A N PRO 287.A O no hydrogen 3.131 N/A LEU 292.A N THR 289.A O no hydrogen 3.084 N/A LYS 294.A N GLU 290.A O no hydrogen 2.972 N/A LYS 294.A NZ ASP 298.A OD2 no hydrogen 2.870 N/A ALA 295.A N PRO 291.A O no hydrogen 2.995 N/A CYS 296.A N LEU 292.A O no hydrogen 2.927 N/A ARG 297.A N LEU 293.A O no hydrogen 2.920 N/A ASP 298.A N LYS 294.A O no hydrogen 2.926 N/A ASN 299.A N ALA 295.A O no hydrogen 3.050 N/A ASN 299.A ND2 VAL 219.A O no hydrogen 2.841 N/A ASN 299.A ND2 LYS 221.A O no hydrogen 2.923 N/A LEU 300.A N CYS 296.A O no hydrogen 3.071 N/A SER 301.A N ARG 297.A O no hydrogen 3.109 N/A SER 301.A OG ARG 297.A O no hydrogen 3.183 N/A GLN 302.A N ASP 298.A O no hydrogen 3.085 N/A TRP 303.A N ASN 299.A O no hydrogen 3.002 N/A GLU 304.A N LEU 300.A O no hydrogen 3.069 N/A LYS 305.A N SER 301.A O no hydrogen 2.863 N/A VAL 306.A N GLN 302.A O no hydrogen 2.982 N/A ILE 307.A N TRP 303.A O no hydrogen 3.001 N/A ARG 308.A N GLU 304.A O no hydrogen 3.008 N/A ARG 308.A NE GLU 310.A OE2 no hydrogen 2.716 N/A GLY 309.A N VAL 306.A O no hydrogen 2.924 N/A GLU 310.A N LYS 305.A O no hydrogen 2.956 N/A GLU 311.A N LYS 305.A O no hydrogen 3.342 N/A