Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3dss_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 2.A NZ GLU 230.A O no hydrogen 2.774 N/A VAL 4.A N ASP 3.A OD1 no hydrogen 2.848 N/A ALA 10.A N LYS 7.A O no hydrogen 3.075 N/A HIS 19.A N LEU 15.A O no hydrogen 3.079 N/A ALA 20.A N LEU 16.A O no hydrogen 2.978 N/A ASP 21.A N GLU 17.A O no hydrogen 3.021 N/A TYR 22.A N LYS 18.A O no hydrogen 2.908 N/A ILE 23.A N HIS 19.A O no hydrogen 3.041 N/A ALA 24.A N ALA 20.A O no hydrogen 2.902 N/A SER 25.A N ASP 21.A O no hydrogen 3.027 N/A SER 25.A OG ASP 21.A O no hydrogen 3.559 N/A TYR 26.A N ILE 23.A O no hydrogen 3.184 N/A SER 28.A N SER 25.A O no hydrogen 3.119 N/A SER 28.A OG SER 25.A O no hydrogen 2.869 N/A ASP 31.A N GLU 34.A OE2 no hydrogen 3.182 N/A GLU 34.A N ASP 31.A O no hydrogen 2.959 N/A TYR 35.A N ASP 32.A O no hydrogen 3.256 N/A SER 38.A N TYR 35.A O no hydrogen 3.461 N/A SER 38.A OG TYR 35.A O no hydrogen 2.545 N/A LEU 41.A N SER 38.A O no hydrogen 3.031 N/A ARG 42.A N GLU 39.A O no hydrogen 3.132 N/A ARG 42.A NH2 TYR 35.A O no hydrogen 2.889 N/A ARG 42.A NH2 SER 38.A OG no hydrogen 3.326 N/A MET 43.A N ALA 83.A O no hydrogen 2.842 N/A SER 44.A OG SER 96.A OG no hydrogen 2.669 N/A GLY 45.A N LEU 41.A O no hydrogen 2.918 N/A VAL 46.A N ARG 42.A O no hydrogen 2.801 N/A TYR 47.A N MET 43.A O no hydrogen 3.072 N/A TYR 47.A OH PHE 309.A O no hydrogen 3.321 N/A TYR 47.A OH CYS 310.A O no hydrogen 2.686 N/A TRP 48.A N SER 44.A O no hydrogen 2.827 N/A GLY 49.A N GLY 45.A O no hydrogen 3.125 N/A LEU 50.A N VAL 46.A O no hydrogen 2.951 N/A THR 51.A N TYR 47.A O no hydrogen 2.924 N/A THR 51.A OG1 TYR 47.A O no hydrogen 2.817 N/A VAL 52.A N TRP 48.A O no hydrogen 3.109 N/A MET 53.A N GLY 49.A O no hydrogen 3.082 N/A ASP 54.A N LEU 50.A O no hydrogen 2.936 N/A LEU 55.A N THR 51.A O no hydrogen 2.955 N/A MET 56.A N VAL 52.A O no hydrogen 3.069 N/A MET 56.A N MET 53.A O no hydrogen 3.084 N/A GLY 57.A N ASP 54.A O no hydrogen 2.950 N/A GLN 58.A N MET 53.A O no hydrogen 2.770 N/A GLN 58.A NE2 MET 56.A O no hydrogen 3.628 N/A ARG 61.A N GLN 58.A O no hydrogen 3.080 N/A ARG 61.A NH1 ASP 21.A OD2 no hydrogen 3.526 N/A ARG 61.A NH1 GLN 58.A OE1 no hydrogen 3.540 N/A ARG 61.A NH2 ASP 21.A OD2 no hydrogen 2.750 N/A MET 62.A N LEU 59.A O no hydrogen 3.001 N/A ASN 63.A ND2.B GLU 66.A OE1 no hydrogen 3.295 N/A GLU 66.A N ASN 63.A OD1.A no hydrogen 3.190 N/A ILE 67.A N ASN 63.A O no hydrogen 3.141 N/A LEU 68.A N LYS 64.A O no hydrogen 2.973 N/A VAL 69.A N GLU 65.A O no hydrogen 3.178 N/A PHE 70.A N GLU 66.A O no hydrogen 3.025 N/A ILE 71.A N ILE 67.A O no hydrogen 2.916 N/A LYS 72.A N LEU 68.A O no hydrogen 3.073 N/A LYS 72.A NZ VAL 109.A O no hydrogen 2.761 N/A SER 73.A N VAL 69.A O no hydrogen 3.041 N/A SER 73.A OG.A PHE 70.A O no hydrogen 2.668 N/A SER 73.A OG.B VAL 69.A O no hydrogen 3.095 N/A CYS 74.A N ILE 71.A O no hydrogen 2.942 N/A CYS 74.A SG PHE 70.A O no hydrogen 3.430 N/A GLN 75.A N LYS 72.A O no hydrogen 3.308 N/A GLN 75.A NE2 GLY 79.A O no hydrogen 2.931 N/A GLN 75.A NE2 ASN 111.A O no hydrogen 3.038 N/A HIS 76.A N GLY 80.A O no hydrogen 2.835 N/A HIS 76.A NE2 SER 82.A OG no hydrogen 3.012 N/A GLY 79.A N HIS 76.A O no hydrogen 2.933 N/A VAL 81.A N THR 94.A OG1 no hydrogen 2.992 N/A SER 82.A N CYS 74.A O no hydrogen 2.973 N/A SER 82.A OG CYS 74.A O no hydrogen 3.382 N/A SER 82.A OG HIS 76.A NE2 no hydrogen 3.012 N/A SER 82.A OG SER 84.A O no hydrogen 2.795 N/A HIS 87.A N SER 84.A O no hydrogen 3.111 N/A HIS 87.A NE2 GLU 39.A OE2 no hydrogen 2.751 N/A HIS 90.A N VAL 81.A O no hydrogen 3.072 N/A LEU 91.A N GLY 131.A O no hydrogen 2.872 N/A TYR 93.A N HIS 90.A O no hydrogen 3.223 N/A THR 94.A N HIS 90.A O no hydrogen 2.991 N/A THR 94.A OG1 VAL 81.A O no hydrogen 3.548 N/A THR 94.A OG1 HIS 90.A O no hydrogen 2.872 N/A LEU 95.A N LEU 91.A O no hydrogen 2.979 N/A SER 96.A N LEU 92.A O no hydrogen 3.122 N/A SER 96.A OG SER 44.A OG no hydrogen 2.669 N/A SER 96.A OG LEU 92.A O no hydrogen 3.344 N/A ALA 97.A N TYR 93.A O no hydrogen 2.946 N/A VAL 98.A N THR 94.A O no hydrogen 3.062 N/A GLN 99.A N LEU 95.A O no hydrogen 2.831 N/A ILE 100.A N SER 96.A O no hydrogen 2.940 N/A LEU 101.A N ALA 97.A O no hydrogen 2.896 N/A THR 102.A N VAL 98.A O no hydrogen 2.952 N/A THR 102.A OG1 VAL 98.A O no hydrogen 2.661 N/A LEU 103.A N GLN 99.A O no hydrogen 2.984 N/A TYR 104.A N ILE 100.A O no hydrogen 3.076 N/A ASP 105.A N THR 102.A O no hydrogen 3.141 N/A SER 106.A N LEU 101.A O no hydrogen 2.820 N/A SER 106.A OG.A TYR 104.A O no hydrogen 2.669 N/A SER 106.A OG.B TYR 104.A O no hydrogen 2.819 N/A VAL 109.A N SER 106.A O no hydrogen 3.103 N/A ILE 110.A N ILE 107.A O no hydrogen 3.401 N/A ASN 111.A N GLN 75.A OE1 no hydrogen 2.954 N/A VAL 115.A N ASN 111.A O no hydrogen 3.160 N/A VAL 116.A N VAL 112.A O no hydrogen 2.994 N/A ALA 117.A N ASP 113.A O no hydrogen 3.032 N/A TYR 118.A N LYS 114.A O no hydrogen 2.913 N/A VAL 119.A N VAL 115.A O no hydrogen 2.961 N/A GLN 120.A N VAL 116.A O no hydrogen 2.944 N/A GLN 120.A NE2 ALA 157.A O no hydrogen 2.693 N/A SER 121.A N ALA 117.A O no hydrogen 2.973 N/A SER 121.A OG TYR 118.A O no hydrogen 2.684 N/A LEU 122.A N VAL 119.A O no hydrogen 3.089 N/A GLN 123.A N GLN 120.A O no hydrogen 3.425 N/A GLN 123.A NE2 GLY 127.A O no hydrogen 3.122 N/A GLN 123.A NE2 ASN 159.A O no hydrogen 2.935 N/A LYS 124.A N SER 128.A O no hydrogen 2.810 N/A GLY 127.A N LYS 124.A O no hydrogen 2.942 N/A SER 128.A N ASP 126.A OD1 no hydrogen 3.040 N/A SER 128.A OG ASP 126.A OD1 no hydrogen 2.632 N/A ALA 130.A N LEU 122.A O no hydrogen 3.041 N/A GLY 131.A N GLU 136.A O no hydrogen 3.059 N/A TRP 134.A N ASP 132.A OD1 no hydrogen 2.878 N/A GLY 135.A N ASP 132.A O no hydrogen 3.176 N/A THR 139.A N CYS 179.A O no hydrogen 2.846 N/A THR 139.A OG1 GLY 178.A O no hydrogen 2.938 N/A THR 139.A OG1 CYS 179.A O no hydrogen 3.570 N/A ARG 140.A N ASP 138.A OD1 no hydrogen 2.890 N/A ARG 140.A NE ASP 138.A OD2 no hydrogen 3.080 N/A ARG 140.A NH2 ASP 138.A OD2 no hydrogen 3.044 N/A PHE 141.A N ASP 138.A O no hydrogen 2.808 N/A PHE 143.A N THR 139.A O no hydrogen 3.160 N/A CYS 144.A N ARG 140.A O no hydrogen 2.991 N/A CYS 144.A SG ARG 140.A O no hydrogen 3.352 N/A ALA 145.A N PHE 141.A O no hydrogen 2.885 N/A VAL 146.A N SER 142.A O no hydrogen 3.092 N/A ALA 147.A N PHE 143.A O no hydrogen 2.818 N/A THR 148.A N CYS 144.A O no hydrogen 3.018 N/A THR 148.A OG1 CYS 144.A O no hydrogen 2.693 N/A LEU 149.A N ALA 145.A O no hydrogen 3.083 N/A ALA 150.A N VAL 146.A O no hydrogen 2.829 N/A LEU 151.A N ALA 147.A O no hydrogen 3.094 N/A LEU 152.A N THR 148.A O no hydrogen 3.207 N/A GLY 153.A N ALA 150.A O no hydrogen 3.131 N/A LYS 154.A N LEU 149.A O no hydrogen 2.832 N/A ALA 157.A N LYS 154.A O no hydrogen 3.028 N/A ILE 158.A N LEU 155.A O no hydrogen 3.470 N/A ASN 159.A N GLN 123.A OE1 no hydrogen 2.972 N/A LYS 162.A N ASN 159.A OD1 no hydrogen 3.143 N/A ALA 163.A N ASN 159.A O no hydrogen 2.993 N/A ILE 164.A N VAL 160.A O no hydrogen 2.886 N/A GLU 165.A N GLU 161.A O no hydrogen 2.940 N/A PHE 166.A N LYS 162.A O no hydrogen 2.984 N/A VAL 167.A N ALA 163.A O no hydrogen 3.123 N/A LEU 168.A N ILE 164.A O no hydrogen 2.887 N/A SER 169.A N GLU 165.A O no hydrogen 2.960 N/A SER 169.A OG PHE 166.A O no hydrogen 2.592 N/A CYS 170.A N VAL 167.A O no hydrogen 2.955 N/A CYS 170.A SG PHE 166.A O no hydrogen 3.519 N/A MET 171.A N LEU 168.A O no hydrogen 3.122 N/A ASN 172.A N GLY 176.A O no hydrogen 2.796 N/A ASN 172.A ND2 SER 183.A O no hydrogen 2.898 N/A ASN 172.A ND2 SER 185.A OG no hydrogen 2.902 N/A GLY 175.A N ASN 172.A O no hydrogen 3.030 N/A GLY 176.A N ASP 174.A OD1 no hydrogen 3.048 N/A CYS 179.A SG ASP 138.A OD2 no hydrogen 3.452 N/A ARG 180.A N SER 183.A OG no hydrogen 3.169 N/A ARG 180.A NH1 ILE 137.A O no hydrogen 2.813 N/A SER 183.A N ARG 180.A O no hydrogen 2.884 N/A SER 183.A OG ARG 180.A O no hydrogen 3.094 N/A SER 185.A OG ASP 174.A OD1 no hydrogen 2.647 N/A SER 185.A OG ASP 174.A OD2 no hydrogen 3.327 N/A HIS 186.A N PHE 177.A O no hydrogen 3.233 N/A ALA 187.A N GLY 227.A O no hydrogen 2.925 N/A GLN 189.A NE2 ASP 138.A OD1 no hydrogen 3.190 N/A ILE 190.A N HIS 186.A O no hydrogen 2.873 N/A TYR 191.A N ALA 187.A O no hydrogen 2.876 N/A CYS 192.A N GLY 188.A O no hydrogen 3.139 N/A CYS 192.A SG.A GLY 188.A O no hydrogen 3.416 N/A CYS 192.A SG.B GLY 188.A O no hydrogen 3.625 N/A CYS 192.A SG.B GLN 189.A O no hydrogen 3.304 N/A CYS 193.A N GLN 189.A O no hydrogen 2.819 N/A CYS 193.A SG GLN 189.A O no hydrogen 3.311 N/A THR 194.A N ILE 190.A O no hydrogen 2.799 N/A THR 194.A OG1 ILE 190.A O no hydrogen 2.809 N/A THR 194.A OG1 TYR 191.A O no hydrogen 3.338 N/A GLY 195.A N TYR 191.A O no hydrogen 2.941 N/A PHE 196.A N CYS 192.A O no hydrogen 2.867 N/A LEU 197.A N CYS 193.A O no hydrogen 2.914 N/A ALA 198.A N THR 194.A O no hydrogen 2.873 N/A ILE 199.A N GLY 195.A O no hydrogen 2.985 N/A THR 200.A N PHE 196.A O no hydrogen 2.982 N/A THR 200.A OG1 PHE 196.A O no hydrogen 2.870 N/A THR 200.A OG1 LEU 197.A O no hydrogen 3.569 N/A SER 201.A N ALA 198.A O no hydrogen 3.178 N/A GLN 202.A N LEU 197.A O no hydrogen 2.793 N/A GLN 202.A NE2 THR 200.A O no hydrogen 3.676 N/A GLN 205.A N GLN 202.A O no hydrogen 2.982 N/A GLN 205.A NE2 GLN 202.A OE1 no hydrogen 2.804 N/A VAL 206.A N LEU 203.A O no hydrogen 3.122 N/A LEU 210.A N ASN 207.A OD1 no hydrogen 3.157 N/A LEU 211.A N ASN 207.A O no hydrogen 2.820 N/A GLY 212.A N SER 208.A O no hydrogen 2.768 N/A TRP 213.A N ASP 209.A O no hydrogen 3.173 N/A TRP 213.A NE1 GLU 217.A OE1 no hydrogen 2.922 N/A TRP 214.A N LEU 210.A O no hydrogen 3.159 N/A LEU 215.A N LEU 211.A O no hydrogen 2.884 N/A CYS 216.A N GLY 212.A O no hydrogen 2.847 N/A CYS 216.A SG GLY 212.A O no hydrogen 3.704 N/A CYS 216.A SG TRP 213.A O no hydrogen 3.525 N/A GLU 217.A N TRP 213.A O no hydrogen 2.999 N/A ARG 218.A N LEU 215.A O no hydrogen 2.972 N/A ARG 218.A NE TRP 214.A O no hydrogen 2.923 N/A ARG 218.A NH1 ASN 226.A OD1 no hydrogen 3.354 N/A ARG 218.A NH2 TRP 214.A O no hydrogen 3.073 N/A GLN 219.A N CYS 216.A O no hydrogen 3.244 N/A GLN 219.A NE2 GLY 223.A O no hydrogen 2.953 N/A GLN 219.A NE2 ASP 255.A O no hydrogen 3.004 N/A LEU 220.A N GLY 224.A O no hydrogen 2.905 N/A SER 222.A N ASP 3.A OD2 no hydrogen 2.828 N/A SER 222.A OG ASP 3.A OD1 no hydrogen 2.732 N/A SER 222.A OG ASP 3.A OD2 no hydrogen 3.499 N/A GLY 223.A N LEU 220.A O no hydrogen 2.787 N/A GLY 224.A N SER 222.A OG no hydrogen 3.297 N/A LEU 225.A N SER 238.A OG no hydrogen 3.030 N/A ASN 226.A N ARG 218.A O no hydrogen 2.982 N/A ASN 226.A ND2 LYS 231.A O no hydrogen 2.925 N/A ARG 228.A NH1 GLU 184.A OE2 no hydrogen 3.386 N/A LYS 231.A N ARG 228.A O no hydrogen 3.314 N/A ASP 234.A N LEU 225.A O no hydrogen 3.135 N/A VAL 235.A N ASP 276.A O no hydrogen 2.915 N/A TYR 237.A N ASP 234.A OD1 no hydrogen 2.872 N/A SER 238.A N ASP 234.A O no hydrogen 2.898 N/A SER 238.A OG LEU 225.A O no hydrogen 3.397 N/A SER 238.A OG ASP 234.A O no hydrogen 2.763 N/A TRP 239.A N VAL 235.A O no hydrogen 3.072 N/A TRP 239.A NE1 TYR 191.A OH no hydrogen 3.150 N/A TRP 240.A N CYS 236.A O no hydrogen 3.051 N/A VAL 241.A N TYR 237.A O no hydrogen 2.848 N/A LEU 242.A N SER 238.A O no hydrogen 2.984 N/A ALA 243.A N TRP 239.A O no hydrogen 2.833 N/A SER 244.A N TRP 240.A O no hydrogen 3.064 N/A SER 244.A OG TRP 240.A O no hydrogen 2.798 N/A LEU 245.A N VAL 241.A O no hydrogen 2.930 N/A LYS 246.A N LEU 242.A O no hydrogen 2.894 N/A ILE 247.A N ALA 243.A O no hydrogen 2.924 N/A ILE 248.A N SER 244.A O no hydrogen 3.074 N/A GLY 249.A N LYS 246.A O no hydrogen 3.119 N/A ARG 250.A N LEU 245.A O no hydrogen 2.870 N/A ARG 250.A NE ASP 209.A OD2 no hydrogen 3.145 N/A ARG 250.A NH2 ASP 209.A OD2 no hydrogen 2.828 N/A TRP 253.A N ARG 250.A O no hydrogen 2.961 N/A ILE 254.A N LEU 251.A O no hydrogen 3.438 N/A ASP 255.A N GLN 219.A OE1 no hydrogen 2.798 N/A LYS 258.A N ASP 255.A OD1 no hydrogen 3.036 N/A LYS 258.A NZ PRO 221.A O no hydrogen 2.775 N/A LEU 259.A N ASP 255.A O no hydrogen 3.072 N/A ARG 260.A N ARG 256.A O no hydrogen 2.907 N/A ARG 260.A NH1 GLU 299.A OE1 no hydrogen 2.899 N/A SER 261.A N GLU 257.A O no hydrogen 3.017 N/A SER 261.A OG GLU 257.A O no hydrogen 3.150 N/A PHE 262.A N LYS 258.A O no hydrogen 3.027 N/A ILE 263.A N LEU 259.A O no hydrogen 2.906 N/A LEU 264.A N ARG 260.A O no hydrogen 2.954 N/A ALA 265.A N SER 261.A O no hydrogen 3.041 N/A CYS 266.A N ILE 263.A O no hydrogen 3.002 N/A CYS 266.A SG PHE 262.A O no hydrogen 3.434 N/A CYS 266.A SG ASP 276.A O no hydrogen 3.958 N/A GLN 267.A N LEU 264.A O no hydrogen 3.163 N/A GLN 267.A NE2 HIS 19.A NE2 no hydrogen 2.722 N/A ASP 268.A N GLY 273.A O no hydrogen 3.037 N/A GLU 270.A N ASP 268.A OD2 no hydrogen 2.796 N/A THR 271.A N ASP 268.A OD2 no hydrogen 2.921 N/A THR 271.A OG1 GLY 272.A O no hydrogen 2.759 N/A GLY 272.A N ASP 268.A O no hydrogen 2.907 N/A GLY 273.A N HIS 19.A ND1 no hydrogen 2.908 N/A PHE 274.A N THR 287.A OG1 no hydrogen 2.986 N/A ALA 275.A N CYS 266.A O no hydrogen 2.932 N/A ARG 277.A N ASP 276.A OD2 no hydrogen 2.949 N/A ARG 277.A NH2 PRO 233.A O no hydrogen 2.698 N/A ASP 280.A N ARG 277.A O no hydrogen 3.113 N/A ASP 283.A N PHE 274.A O no hydrogen 3.120 N/A HIS 286.A N ASP 283.A OD1 no hydrogen 2.875 N/A HIS 286.A ND1 ASP 283.A OD1 no hydrogen 2.859 N/A HIS 286.A ND1 ASP 283.A OD2 no hydrogen 3.147 N/A THR 287.A N ASP 283.A O no hydrogen 3.011 N/A THR 287.A OG1 ASP 283.A O no hydrogen 2.708 N/A LEU 288.A N PRO 284.A O no hydrogen 2.930 N/A PHE 289.A N PHE 285.A O no hydrogen 3.130 N/A GLY 290.A N HIS 286.A O no hydrogen 2.811 N/A ILE 291.A N THR 287.A O no hydrogen 3.080 N/A ALA 292.A N LEU 288.A O no hydrogen 2.823 N/A GLY 293.A N PHE 289.A O no hydrogen 2.945 N/A LEU 294.A N GLY 290.A O no hydrogen 2.974 N/A SER 295.A N ILE 291.A O no hydrogen 2.951 N/A SER 295.A OG LYS 303.A O no hydrogen 2.649 N/A LEU 296.A N ALA 292.A O no hydrogen 3.058 N/A LEU 297.A N GLY 293.A O no hydrogen 2.956 N/A GLY 298.A N SER 295.A O no hydrogen 2.941 N/A GLU 299.A N LEU 294.A O no hydrogen 3.087 N/A GLN 301.A N GLU 299.A OE2 no hydrogen 2.958 N/A ILE 302.A N GLU 299.A O no hydrogen 3.211 N/A LYS 303.A N LEU 55.A O no hydrogen 2.957 N/A LYS 303.A NZ ASP 54.A O no hydrogen 2.994 N/A LYS 303.A NZ ASP 54.A OD2 no hydrogen 3.033 N/A LYS 303.A NZ GLU 314.A OE1 no hydrogen 3.187 N/A SER 306.A N MET 311.A O no hydrogen 2.829 N/A VAL 308.A N SER 306.A OG no hydrogen 3.148 N/A PHE 309.A N SER 306.A OG no hydrogen 3.020 N/A CYS 310.A N SER 306.A O no hydrogen 2.896 N/A GLU 313.A N PRO 304.A O no hydrogen 2.921 N/A VAL 315.A N PRO 312.A O no hydrogen 3.110 N/A LEU 316.A N PRO 312.A O no hydrogen 3.412 N/A GLN 317.A N GLU 313.A O no hydrogen 2.829 N/A ARG 318.A N GLU 314.A O no hydrogen 3.229 N/A ARG 318.A NH1 THR 102.A O no hydrogen 2.651 N/A ARG 318.A NH2 THR 102.A O no hydrogen 2.927 N/A ARG 318.A NH2 LEU 103.A O no hydrogen 3.321 N/A VAL 319.A N VAL 315.A O no hydrogen 3.373 N/A ASN 320.A N GLN 317.A O no hydrogen 3.051 N/A VAL 321.A N LEU 316.A O no hydrogen 2.961 N/A GLN 322.A NE2 GLU 313.A OE2 no hydrogen 2.997 N/A VAL 326.A N ILE 247.A O no hydrogen 2.987 N/A