Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3n8d_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 2.A NZ LYS 32.A O no hydrogen 2.456 N/A GLU 3.A N LYS 34.A O no hydrogen 2.923 N/A ASN 4.A N ASP 84.A OD2 no hydrogen 2.699 N/A ASN 4.A ND2 PRO 82.A O no hydrogen 3.539 N/A ILE 5.A N HIS 36.A O no hydrogen 2.942 N/A CYS 6.A N ALA 85.A O no hydrogen 2.966 N/A CYS 6.A SG ILE 7.A O no hydrogen 4.020 N/A CYS 6.A SG ASP 38.A O no hydrogen 3.978 N/A ILE 7.A N ASP 38.A O no hydrogen 3.127 N/A VAL 8.A N PHE 87.A O no hydrogen 2.911 N/A PHE 9.A N ILE 40.A O no hydrogen 3.037 N/A GLY 10.A N SER 19.A OG no hydrogen 3.044 N/A GLY 11.A N ILE 42.A O no hydrogen 2.919 N/A LYS 12.A NZ ASP 45.A O no hydrogen 3.431 N/A GLU 15.A N SER 13.A OG no hydrogen 2.752 N/A HIS 16.A ND1 GLY 11.A O no hydrogen 2.440 N/A HIS 16.A NE2 TYR 41.A OH no hydrogen 2.833 N/A SER 19.A N GLU 15.A O no hydrogen 2.931 N/A SER 19.A OG GLY 10.A O no hydrogen 3.430 N/A SER 19.A OG LEU 89.A O no hydrogen 2.523 N/A ILE 20.A N HIS 16.A O no hydrogen 2.955 N/A LEU 21.A N GLU 17.A O no hydrogen 3.082 N/A THR 22.A N VAL 18.A O no hydrogen 2.804 N/A THR 22.A OG1 VAL 18.A O no hydrogen 2.723 N/A ALA 23.A N SER 19.A O no hydrogen 2.845 N/A GLN 24.A N ILE 20.A O no hydrogen 2.851 N/A GLN 24.A NE2 ILE 58.A O no hydrogen 3.054 N/A ASN 25.A N LEU 21.A O no hydrogen 2.951 N/A VAL 26.A N THR 22.A O no hydrogen 2.869 N/A LEU 27.A N ALA 23.A O no hydrogen 2.853 N/A ASN 28.A N GLN 24.A O no hydrogen 3.039 N/A ASN 28.A ND2 ILE 58.A O no hydrogen 3.007 N/A ALA 29.A N VAL 26.A O no hydrogen 3.088 N/A ILE 30.A N LEU 27.A O no hydrogen 3.133 N/A LYS 32.A NZ LEU 27.A O no hydrogen 2.738 N/A ASP 33.A N ASP 31.A OD2 no hydrogen 3.438 N/A LYS 34.A N ASP 31.A O no hydrogen 3.272 N/A TYR 35.A N ASP 31.A O no hydrogen 2.991 N/A HIS 36.A N GLU 3.A O no hydrogen 2.866 N/A HIS 36.A NE2 SER 78.A OG no hydrogen 2.574 N/A ASP 38.A N ILE 5.A O no hydrogen 3.084 N/A ILE 39.A N GLN 51.A O no hydrogen 2.906 N/A ILE 40.A N ILE 7.A O no hydrogen 2.810 N/A TYR 41.A N ARG 49.A O no hydrogen 2.686 N/A TYR 41.A OH HIS 16.A NE2 no hydrogen 2.833 N/A ILE 42.A N PHE 9.A O no hydrogen 2.881 N/A THR 43.A N ASP 47.A O no hydrogen 2.817 N/A THR 43.A OG1 ASP 47.A O no hydrogen 3.277 N/A ASN 44.A ND2 SER 13.A O no hydrogen 3.553 N/A GLY 46.A N THR 43.A OG1 no hydrogen 3.149 N/A ASP 47.A N THR 43.A OG1 no hydrogen 2.661 N/A ARG 49.A N TYR 41.A O no hydrogen 2.772 N/A ARG 49.A NH1 LEU 66.A O no hydrogen 3.061 N/A LYS 50.A NZ LEU 73.A O no hydrogen 2.887 N/A LYS 50.A NZ TYR 83.A OH no hydrogen 2.741 N/A GLN 51.A N ILE 39.A O no hydrogen 2.974 N/A ASN 53.A N ASP 38.A OD1 no hydrogen 3.016 N/A ILE 54.A N VAL 37.A O no hydrogen 2.810 N/A ILE 58.A N ASN 28.A OD1 no hydrogen 2.683 N/A LYS 59.A N GLU 63.A OE2 no hydrogen 2.911 N/A SER 60.A N GLU 63.A OE2 no hydrogen 3.179 N/A GLU 63.A N SER 60.A OG no hydrogen 2.972 N/A LEU 64.A N THR 61.A O no hydrogen 2.888 N/A HIS 65.A N ASP 62.A O no hydrogen 2.909 N/A LEU 66.A N LEU 64.A O no hydrogen 2.824 N/A LEU 73.A N GLU 69.A O no hydrogen 3.041 N/A LEU 74.A N ILE 70.A O no hydrogen 3.189 N/A LYS 75.A N SER 71.A O no hydrogen 2.896 N/A LYS 75.A NZ LEU 104.A O no hydrogen 3.012 N/A SER 77.A N GLN 81.A O no hydrogen 2.905 N/A SER 77.A OG SER 79.A OG no hydrogen 2.708 N/A SER 77.A OG GLN 81.A O no hydrogen 2.268 N/A SER 78.A N ASP 38.A OD2 no hydrogen 2.991 N/A SER 78.A OG HIS 36.A NE2 no hydrogen 2.574 N/A SER 78.A OG ASP 38.A OD1 no hydrogen 2.674 N/A SER 78.A OG ASP 38.A OD2 no hydrogen 2.925 N/A SER 78.A OG ASN 53.A OD1 no hydrogen 3.407 N/A SER 79.A OG SER 77.A OG no hydrogen 2.708 N/A GLY 80.A N SER 77.A O no hydrogen 3.042 N/A GLN 81.A N SER 77.A OG no hydrogen 3.213 N/A TYR 83.A OH ASP 38.A OD2 no hydrogen 2.723 N/A ASP 84.A N ASN 4.A O no hydrogen 2.836 N/A ALA 85.A N ASN 4.A O no hydrogen 3.282 N/A VAL 86.A N PRO 107.A O no hydrogen 2.910 N/A PHE 87.A N CYS 6.A O no hydrogen 2.786 N/A LEU 89.A N VAL 8.A O no hydrogen 2.769 N/A THR 96.A N ASP 94.A OD1 no hydrogen 3.319 N/A THR 96.A OG1 ASP 94.A OD1 no hydrogen 3.002 N/A GLN 98.A N GLN 98.A OE1 no hydrogen 2.764 N/A GLY 99.A N GLY 95.A O no hydrogen 3.317 N/A LEU 100.A N THR 96.A O no hydrogen 3.139 N/A PHE 101.A N ILE 97.A O no hydrogen 3.006 N/A GLU 102.A N GLN 98.A O no hydrogen 2.900 N/A VAL 103.A N GLY 99.A O no hydrogen 3.133 N/A LEU 104.A N LEU 100.A O no hydrogen 3.039 N/A ASP 105.A N GLU 102.A O no hydrogen 3.007 N/A VAL 106.A N PHE 101.A O no hydrogen 2.959 N/A TYR 108.A OH GLU 102.A OE2 no hydrogen 2.570 N/A VAL 109.A N VAL 86.A O no hydrogen 2.838 N/A ASN 111.A ND2 LEU 265.A O no hydrogen 2.964 N/A ASN 111.A ND2 ALA 285.A O no hydrogen 2.879 N/A SER 115.A OG THR 260.A O no hydrogen 3.348 N/A SER 115.A OG ASP 261.A O no hydrogen 2.469 N/A ALA 116.A N GLY 112.A O no hydrogen 2.980 N/A ALA 117.A N VAL 113.A O no hydrogen 2.789 N/A SER 118.A N LEU 114.A O no hydrogen 2.947 N/A SER 118.A OG LEU 114.A O no hydrogen 2.480 N/A SER 119.A N SER 115.A O no hydrogen 3.286 N/A SER 119.A OG THR 283.A O no hydrogen 3.235 N/A SER 119.A OG THR 283.A OG1 no hydrogen 2.764 N/A MET 120.A N ALA 117.A O no hydrogen 3.009 N/A LYS 122.A N ALA 171.A O no hydrogen 2.755 N/A LYS 122.A NZ PRO 170.A O no hydrogen 3.309 N/A LYS 122.A NZ LEU 173.A O no hydrogen 2.875 N/A LEU 123.A N ASP 121.A OD1 no hydrogen 3.003 N/A VAL 124.A N ASP 121.A OD1 no hydrogen 3.289 N/A MET 125.A N ASP 121.A O no hydrogen 2.984 N/A LYS 126.A N LYS 122.A O no hydrogen 2.909 N/A LYS 126.A NZ GLU 205.A OE1 no hydrogen 2.668 N/A GLN 127.A N LEU 123.A O no hydrogen 3.172 N/A GLN 127.A NE2 LEU 123.A O no hydrogen 3.396 N/A LEU 128.A N VAL 124.A O no hydrogen 3.097 N/A PHE 129.A N MET 125.A O no hydrogen 3.121 N/A GLU 130.A N LYS 126.A O no hydrogen 3.100 N/A HIS 131.A N GLN 127.A O no hydrogen 2.948 N/A HIS 131.A ND1 GLU 259.A OE2 no hydrogen 2.806 N/A ARG 132.A N LEU 128.A O no hydrogen 3.132 N/A ARG 132.A NE GLU 255.A OE1 no hydrogen 2.790 N/A ARG 132.A NH1 ARG 132.A O no hydrogen 2.661 N/A ARG 132.A NH2 GLU 255.A OE1 no hydrogen 2.877 N/A GLY 133.A N GLU 130.A O no hydrogen 2.847 N/A LEU 134.A N PHE 129.A O no hydrogen 2.879 N/A GLN 136.A NE2 LYS 126.A O no hydrogen 2.696 N/A ILE 140.A N ILE 204.A O no hydrogen 2.953 N/A SER 141.A OG LEU 202.A O no hydrogen 2.799 N/A PHE 142.A N LEU 202.A O no hydrogen 3.096 N/A LEU 143.A N GLU 146.A OE1 no hydrogen 2.844 N/A ARG 144.A N ARG 200.A O no hydrogen 2.898 N/A TYR 147.A N LEU 143.A O no hydrogen 3.150 N/A GLU 148.A N ARG 144.A O no hydrogen 2.968 N/A LYS 149.A N GLU 146.A O no hydrogen 3.275 N/A LYS 149.A NZ TYR 150.A OH no hydrogen 3.335 N/A TYR 150.A N GLU 146.A O no hydrogen 2.737 N/A TYR 150.A N TYR 147.A O no hydrogen 3.218 N/A ILE 154.A N TYR 150.A O no hydrogen 3.164 N/A LEU 155.A N GLU 151.A O no hydrogen 3.105 N/A LYS 156.A N HIS 152.A O no hydrogen 3.018 N/A LYS 156.A NZ ASP 160.A OD2 no hydrogen 3.079 N/A LEU 157.A N ASN 153.A O no hydrogen 2.883 N/A VAL 158.A N ILE 154.A O no hydrogen 2.888 N/A ASN 159.A N LEU 155.A O no hydrogen 3.084 N/A ASP 160.A N LYS 156.A O no hydrogen 2.958 N/A LYS 161.A N LEU 157.A O no hydrogen 2.871 N/A LYS 161.A NZ TYR 139.A O no hydrogen 3.150 N/A LEU 162.A N VAL 158.A O no hydrogen 3.143 N/A ASN 163.A N GLN 206.A OE1 no hydrogen 2.900 N/A VAL 166.A N CYS 182.A O no hydrogen 2.862 N/A PHE 167.A N GLU 205.A O no hydrogen 2.774 N/A VAL 168.A N SER 180.A O no hydrogen 3.032 N/A LYS 169.A N VAL 203.A O no hydrogen 3.036 N/A LYS 169.A NZ GLU 205.A OE1 no hydrogen 3.139 N/A LYS 169.A NZ GLU 205.A OE2 no hydrogen 2.880 N/A ALA 171.A N LYS 201.A O no hydrogen 2.893 N/A ASN 172.A N ASP 199.A OD2 no hydrogen 2.698 N/A ASN 172.A ND2 ASP 199.A OD1 no hydrogen 2.606 N/A ASN 172.A ND2 ASP 199.A OD2 no hydrogen 3.149 N/A ILE 179.A N SER 176.A O no hydrogen 3.259 N/A SER 180.A N VAL 168.A O no hydrogen 3.175 N/A CYS 182.A N VAL 166.A O no hydrogen 2.764 N/A CYS 182.A SG SER 180.A O no hydrogen 3.882 N/A CYS 182.A SG SER 180.A OG no hydrogen 3.587 N/A CYS 182.A SG GLU 187.A O no hydrogen 3.241 N/A ASN 183.A N GLU 187.A OE1 no hydrogen 3.165 N/A LEU 188.A N ASN 184.A O no hydrogen 2.892 N/A LYS 189.A N GLU 185.A O no hydrogen 2.839 N/A GLU 190.A N ALA 186.A O no hydrogen 3.317 N/A GLY 191.A N GLU 187.A O no hydrogen 2.839 N/A ILE 192.A N LEU 188.A O no hydrogen 2.760 N/A LYS 193.A N LYS 189.A O no hydrogen 2.995 N/A GLU 194.A N GLU 190.A O no hydrogen 3.049 N/A ALA 195.A N GLY 191.A O no hydrogen 2.786 N/A PHE 196.A N ILE 192.A O no hydrogen 2.856 N/A GLN 197.A N GLU 194.A O no hydrogen 3.334 N/A GLN 197.A NE2 GLU 194.A O no hydrogen 3.259 N/A PHE 198.A N ALA 195.A O no hydrogen 3.138 N/A ARG 200.A N ASP 199.A OD1 no hydrogen 2.792 N/A LYS 201.A NZ ASP 121.A OD1 no hydrogen 3.117 N/A LYS 201.A NZ ASP 121.A OD2 no hydrogen 2.693 N/A LEU 202.A N PHE 142.A O no hydrogen 3.022 N/A VAL 203.A N LYS 169.A O no hydrogen 2.982 N/A ILE 204.A N ILE 140.A O no hydrogen 2.846 N/A GLU 205.A N PHE 167.A O no hydrogen 2.952 N/A GLN 206.A N PRO 138.A O no hydrogen 3.078 N/A GLY 207.A N PRO 165.A O no hydrogen 2.908 N/A ARG 211.A N VAL 272.A O no hydrogen 2.845 N/A ARG 211.A NH1 GLU 230.A OE2 no hydrogen 3.161 N/A ARG 211.A NH1 ASP 240.A O no hydrogen 3.014 N/A ARG 211.A NH2 ASP 240.A O no hydrogen 2.949 N/A ILE 213.A N PHE 270.A O no hydrogen 3.019 N/A GLU 214.A N GLY 229.A O no hydrogen 2.812 N/A VAL 215.A N ALA 268.A O no hydrogen 2.874 N/A ALA 216.A N THR 226.A OG1 no hydrogen 3.195 N/A VAL 217.A N VAL 266.A O no hydrogen 2.874 N/A LEU 218.A N GLU 224.A O no hydrogen 3.007 N/A GLY 219.A N GLY 264.A O no hydrogen 2.850 N/A ASN 220.A ND2 LEU 316.A O no hydrogen 2.912 N/A GLU 224.A N LEU 218.A O no hydrogen 2.901 N/A THR 226.A N ALA 216.A O no hydrogen 2.987 N/A THR 226.A OG1 ALA 216.A O no hydrogen 3.548 N/A THR 226.A OG1 TRP 227.A O no hydrogen 2.912 N/A GLY 229.A N GLU 214.A O no hydrogen 2.922 N/A GLU 230.A N LYS 236.A O no hydrogen 2.755 N/A VAL 231.A N GLU 212.A O no hydrogen 2.915 N/A VAL 232.A N GLN 234.A O no hydrogen 3.309 N/A GLN 234.A N VAL 232.A O no hydrogen 3.209 N/A LYS 236.A N GLU 230.A O no hydrogen 2.848 N/A ALA 239.A N PRO 228.A O no hydrogen 2.751 N/A GLN 246.A N ASP 242.A O no hydrogen 3.172 N/A GLN 246.A NE2 LEU 241.A O no hydrogen 3.487 N/A LEU 247.A N GLU 243.A O no hydrogen 3.122 N/A THR 248.A N ASP 244.A O no hydrogen 3.168 N/A THR 248.A OG1 ASP 244.A O no hydrogen 2.878 N/A LEU 249.A N VAL 245.A O no hydrogen 3.062 N/A ARG 250.A N GLN 246.A O no hydrogen 3.113 N/A ASN 251.A N LEU 247.A O no hydrogen 3.060 N/A MET 252.A N THR 248.A O no hydrogen 2.889 N/A ALA 253.A N LEU 249.A O no hydrogen 2.934 N/A LEU 254.A N ARG 250.A O no hydrogen 3.036 N/A GLU 255.A N ASN 251.A O no hydrogen 2.909 N/A ALA 256.A N MET 252.A O no hydrogen 2.825 N/A PHE 257.A N ALA 253.A O no hydrogen 2.952 N/A LYS 258.A N LEU 254.A O no hydrogen 3.232 N/A LYS 258.A NZ GLU 255.A OE2 no hydrogen 2.490 N/A GLU 259.A N GLU 255.A O no hydrogen 2.979 N/A THR 260.A N ALA 256.A O no hydrogen 2.995 N/A THR 260.A OG1 ALA 256.A O no hydrogen 2.753 N/A THR 260.A OG1 PHE 257.A O no hydrogen 3.338 N/A ASP 261.A N LYS 258.A O no hydrogen 2.918 N/A CYS 262.A N PHE 257.A O no hydrogen 3.003 N/A CYS 262.A SG THR 260.A OG1 no hydrogen 3.083 N/A SER 263.A N ASN 111.A OD1 no hydrogen 2.961 N/A GLY 264.A N ASN 220.A OD1 no hydrogen 3.013 N/A LEU 265.A N SER 263.A O no hydrogen 2.749 N/A VAL 266.A N VAL 217.A O no hydrogen 3.222 N/A ARG 267.A N ASN 284.A O no hydrogen 3.126 N/A ARG 267.A NE ASP 269.A OD1 no hydrogen 2.738 N/A ARG 267.A NH2 ASP 269.A OD1 no hydrogen 3.490 N/A ARG 267.A NH2 ASP 269.A OD2 no hydrogen 2.926 N/A ALA 268.A N VAL 215.A O no hydrogen 2.886 N/A ASP 269.A N GLU 282.A O no hydrogen 2.862 N/A PHE 270.A N ILE 213.A O no hydrogen 2.664 N/A PHE 271.A N TYR 279.A O no hydrogen 2.661 N/A VAL 272.A N ARG 211.A O no hydrogen 2.971 N/A THR 273.A N GLN 277.A O no hydrogen 3.066 N/A THR 273.A OG1 ASP 275.A OD2 no hydrogen 2.740 N/A ASN 276.A N THR 273.A O no hydrogen 2.728 N/A ASN 276.A ND2 ASP 242.A OD2 no hydrogen 3.520 N/A GLN 277.A N THR 273.A OG1 no hydrogen 2.972 N/A GLN 277.A NE2 TYR 279.A OH no hydrogen 2.662 N/A TYR 279.A N PHE 271.A O no hydrogen 2.855 N/A ILE 280.A N PRO 135.A O no hydrogen 2.843 N/A ASN 281.A N ASP 269.A O no hydrogen 2.707 N/A GLU 282.A N ASP 269.A O no hydrogen 3.276 N/A THR 283.A OG1 SER 119.A OG no hydrogen 2.764 N/A ASN 284.A N ARG 267.A O no hydrogen 2.787 N/A MET 286.A N ASN 284.A OD1 no hydrogen 3.080 N/A THR 290.A N SER 293.A OG no hydrogen 3.202 N/A THR 290.A OG1 SER 293.A OG no hydrogen 2.600 N/A ALA 291.A N ASN 25.A OD1 no hydrogen 2.833 N/A PHE 292.A N THR 290.A OG1 no hydrogen 3.347 N/A SER 293.A N THR 290.A O no hydrogen 3.122 N/A SER 293.A OG THR 290.A OG1 no hydrogen 2.600 N/A TYR 295.A OH VAL 217.A O no hydrogen 2.711 N/A LYS 297.A N SER 293.A O no hydrogen 3.091 N/A LYS 297.A NZ GLU 300.A OE2 no hydrogen 2.819 N/A LEU 298.A N MET 294.A O no hydrogen 2.818 N/A TRP 299.A N TYR 295.A O no hydrogen 3.389 N/A GLU 300.A N PRO 296.A O no hydrogen 2.901 N/A ASN 301.A N LYS 297.A O no hydrogen 3.238 N/A MET 302.A N TRP 299.A O no hydrogen 3.059 N/A GLY 303.A N GLU 300.A O no hydrogen 2.620 N/A LEU 304.A N TRP 299.A O no hydrogen 2.912 N/A SER 305.A N GLU 308.A OE2 no hydrogen 2.744 N/A SER 305.A OG GLU 308.A OE2 no hydrogen 2.745 N/A TYR 306.A OH PHE 289.A O no hydrogen 2.588 N/A GLU 308.A N SER 305.A OG no hydrogen 3.327 N/A LEU 309.A N SER 305.A O no hydrogen 2.809 N/A ILE 310.A N TYR 306.A O no hydrogen 2.967 N/A THR 311.A N PRO 307.A O no hydrogen 3.035 N/A THR 311.A OG1 PRO 307.A O no hydrogen 3.271 N/A LYS 312.A N GLU 308.A O no hydrogen 2.824 N/A LEU 313.A N LEU 309.A O no hydrogen 2.843 N/A ILE 314.A N ILE 310.A O no hydrogen 2.943 N/A GLU 315.A N THR 311.A O no hydrogen 2.905 N/A LEU 316.A N LYS 312.A O no hydrogen 2.847 N/A ALA 317.A N LEU 313.A O no hydrogen 2.997 N/A LYS 318.A N ILE 314.A O no hydrogen 3.031 N/A LYS 318.A NZ ASP 84.A OD1 no hydrogen 3.060 N/A GLU 319.A N GLU 315.A O no hydrogen 2.850 N/A ARG 320.A N LEU 316.A O no hydrogen 2.909 N/A ARG 320.A NH2 TYR 108.A OH no hydrogen 3.068 N/A HIS 321.A N ALA 317.A O no hydrogen 3.088 N/A HIS 321.A NE2 ASP 105.A OD1 no hydrogen 3.046 N/A GLN 322.A N LYS 318.A O no hydrogen 2.930 N/A ASP 323.A N GLU 319.A O no hydrogen 2.951 N/A LYS 324.A N ARG 320.A O no hydrogen 2.979 N/A LYS 324.A NZ GLU 102.A O no hydrogen 3.452 N/A LYS 324.A NZ GLU 102.A OE1 no hydrogen 2.787 N/A LYS 324.A NZ ASP 105.A OD1 no hydrogen 3.253 N/A GLN 325.A N HIS 321.A O no hydrogen 3.030 N/A LYS 326.A N GLN 322.A O no hydrogen 3.001 N/A LYS 328.A N GLN 325.A O no hydrogen 3.066 N/A