Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8pvf_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 2.A N GLN 90.A OE1 no hydrogen 3.229 N/A THR 2.A OG1 GLY 88.A O no hydrogen 2.680 N/A LEU 3.A N THR 26.A O no hydrogen 2.829 N/A GLY 4.A N ILE 91.A O no hydrogen 2.753 N/A ILE 5.A N ALA 29.A O no hydrogen 2.904 N/A ASN 6.A N CYS 93.A O no hydrogen 2.877 N/A ASN 6.A ND2 GLU 94.A OE1 no hydrogen 2.679 N/A GLY 7.A N ASN 31.A O no hydrogen 2.750 N/A PHE 8.A N ASP 32.A OD2 no hydrogen 2.742 N/A ARG 10.A NE GLU 318.A OE2 no hydrogen 2.776 N/A ARG 10.A NH1 ASP 47.A OD1 no hydrogen 2.776 N/A ARG 10.A NH2 ASP 47.A OD1 no hydrogen 3.248 N/A ARG 10.A NH2 ASP 47.A OD2 no hydrogen 2.964 N/A ARG 10.A NH2 GLU 318.A OE1 no hydrogen 2.949 N/A ARG 10.A NH2 GLU 318.A OE2 no hydrogen 3.532 N/A ARG 13.A N GLY 9.A O no hydrogen 2.857 N/A ARG 13.A NH1 PHE 8.A O no hydrogen 2.840 N/A LEU 14.A N ARG 10.A O no hydrogen 3.255 N/A VAL 15.A N ILE 11.A O no hydrogen 2.775 N/A LEU 16.A N GLY 12.A O no hydrogen 3.246 N/A ARG 17.A N ARG 13.A O no hydrogen 3.010 N/A ARG 17.A NH1 GLY 51.A O no hydrogen 2.863 N/A ARG 17.A NH2 LEU 44.A O no hydrogen 2.944 N/A ARG 17.A NH2 GLY 51.A O no hydrogen 2.871 N/A ALA 18.A N LEU 14.A O no hydrogen 2.898 N/A CYS 19.A N VAL 15.A O no hydrogen 3.015 N/A CYS 19.A SG VAL 15.A O no hydrogen 3.435 N/A MET 20.A N LEU 16.A O no hydrogen 3.156 N/A GLU 21.A N ALA 18.A O no hydrogen 3.234 N/A ARG 22.A N CYS 19.A O no hydrogen 2.901 N/A ARG 22.A NH1 ASP 327.A OD1 no hydrogen 2.907 N/A ARG 22.A NH2 ASN 323.A O no hydrogen 3.113 N/A ARG 22.A NH2 ASP 327.A OD1 no hydrogen 3.162 N/A THR 26.A N GLY 1.A O no hydrogen 3.254 N/A VAL 28.A N LEU 3.A O no hydrogen 2.887 N/A ILE 30.A N LYS 72.A O no hydrogen 2.844 N/A ASN 31.A N ILE 5.A O no hydrogen 2.824 N/A ASN 31.A ND2 ASN 6.A OD1 no hydrogen 2.751 N/A ASN 31.A ND2 ALA 76.A O no hydrogen 2.880 N/A ASP 32.A N PHE 74.A O no hydrogen 3.138 N/A PHE 34.A N ASP 32.A OD1 no hydrogen 3.179 N/A MET 35.A N ASP 32.A O no hydrogen 3.494 N/A GLU 38.A N GLU 38.A OE1 no hydrogen 2.881 N/A TYR 39.A N ASP 36.A OD1 no hydrogen 2.804 N/A MET 40.A N ASP 36.A O no hydrogen 2.901 N/A ALA 41.A N VAL 37.A O no hydrogen 2.983 N/A TYR 42.A N GLU 38.A O no hydrogen 3.167 N/A LEU 43.A N TYR 39.A O no hydrogen 3.017 N/A LEU 44.A N MET 40.A O no hydrogen 3.013 N/A LYS 45.A N ALA 41.A O no hydrogen 3.064 N/A TYR 46.A N TYR 42.A O no hydrogen 3.141 N/A VAL 49.A N ASP 47.A OD2 no hydrogen 2.923 N/A HIS 50.A N ASP 47.A OD2 no hydrogen 2.744 N/A HIS 50.A NE2 GLU 318.A OE1 no hydrogen 2.781 N/A GLY 51.A N ASP 47.A O no hydrogen 3.206 N/A PHE 53.A N LYS 45.A O no hydrogen 3.096 N/A THR 56.A N ASN 67.A OD1 no hydrogen 3.122 N/A GLU 58.A N CYS 65.A O no hydrogen 3.144 N/A SER 60.A N ASP 63.A O no hydrogen 2.986 N/A LEU 64.A N VAL 71.A O no hydrogen 2.900 N/A CYS 65.A N GLU 58.A O no hydrogen 3.068 N/A CYS 65.A SG GLU 58.A OE1 no hydrogen 3.736 N/A ILE 66.A N LYS 69.A O no hydrogen 2.986 N/A ASN 67.A N THR 56.A O no hydrogen 2.986 N/A LYS 69.A N ILE 66.A O no hydrogen 3.196 N/A VAL 71.A N LEU 64.A O no hydrogen 2.984 N/A LYS 72.A N VAL 28.A O no hydrogen 3.072 N/A PHE 74.A N ILE 30.A O no hydrogen 2.804 N/A GLN 75.A NE2 ASP 32.A O no hydrogen 3.336 N/A GLN 75.A NE2 MET 35.A O no hydrogen 2.702 N/A ALA 76.A N ASN 31.A OD1 no hydrogen 2.859 N/A ALA 80.A N ASP 78.A OD1 no hydrogen 3.237 N/A GLU 81.A N ASP 78.A O no hydrogen 3.169 N/A ILE 82.A N PRO 79.A O no hydrogen 3.279 N/A TRP 84.A N ILE 82.A O no hydrogen 2.871 N/A TRP 84.A NE1 HIS 108.A ND1 no hydrogen 2.995 N/A GLY 85.A N GLY 111.A O no hydrogen 2.869 N/A SER 87.A N PRO 83.A O no hydrogen 3.174 N/A SER 87.A OG PRO 83.A O no hydrogen 3.101 N/A GLY 88.A N GLY 85.A O no hydrogen 3.182 N/A ALA 89.A N TRP 84.A O no hydrogen 2.917 N/A GLN 90.A N THR 2.A OG1 no hydrogen 3.055 N/A ILE 91.A N THR 2.A O no hydrogen 3.182 N/A VAL 92.A N LYS 115.A O no hydrogen 2.914 N/A CYS 93.A N GLY 4.A O no hydrogen 2.749 N/A CYS 93.A SG SER 95.A OG no hydrogen 3.414 N/A GLU 94.A N ILE 117.A O no hydrogen 2.850 N/A SER 95.A N ASN 6.A O no hydrogen 2.794 N/A SER 95.A OG ASN 6.A O no hydrogen 3.072 N/A SER 95.A OG GLY 7.A O no hydrogen 3.045 N/A THR 96.A N GLU 94.A OE2 no hydrogen 3.078 N/A THR 96.A OG1 GLU 94.A OE2 no hydrogen 2.712 N/A VAL 98.A N THR 96.A OG1 no hydrogen 3.011 N/A GLU 102.A N ASP 124.A OD2 no hydrogen 2.795 N/A LYS 104.A N THR 101.A OG1 no hydrogen 3.128 N/A ALA 105.A N THR 101.A O no hydrogen 2.841 N/A SER 106.A N GLU 102.A O no hydrogen 2.764 N/A SER 106.A OG GLU 102.A O no hydrogen 2.998 N/A SER 106.A OG GLU 103.A O no hydrogen 3.193 N/A HIS 108.A NE2 GLU 94.A OE1 no hydrogen 2.710 N/A LEU 109.A N SER 106.A O no hydrogen 2.952 N/A LYS 110.A N LEU 107.A O no hydrogen 3.105 N/A GLY 112.A N LEU 109.A O no hydrogen 3.103 N/A LYS 114.A N GLN 90.A O no hydrogen 2.861 N/A LYS 115.A N GLN 90.A O no hydrogen 3.194 N/A LYS 115.A NZ PRO 140.A O no hydrogen 3.007 N/A LYS 115.A NZ PHE 143.A O no hydrogen 3.035 N/A LYS 115.A NZ ASN 144.A OD1 no hydrogen 2.729 N/A VAL 116.A N ASN 144.A O no hydrogen 2.896 N/A ILE 117.A N VAL 92.A O no hydrogen 2.845 N/A ILE 118.A N ILE 146.A O no hydrogen 2.705 N/A SER 119.A N GLU 94.A O no hydrogen 2.966 N/A SER 119.A OG GLU 94.A O no hydrogen 3.346 N/A LYS 123.A N THR 100.A O no hydrogen 3.003 N/A VAL 126.A N ASP 124.A OD1 no hydrogen 3.189 N/A TYR 129.A N SER 147.A O no hydrogen 3.022 N/A VAL 130.A N ASN 134.A OD1 no hydrogen 2.737 N/A GLY 132.A N ASN 135.A OD1 no hydrogen 2.939 N/A VAL 133.A N VAL 130.A O no hydrogen 3.029 N/A ASN 134.A N VAL 130.A O no hydrogen 3.111 N/A ASN 134.A ND2 MET 128.A O no hydrogen 3.079 N/A GLU 137.A N ASN 134.A O no hydrogen 3.047 N/A TYR 138.A N ASN 135.A O no hydrogen 3.187 N/A SER 141.A N ASP 139.A OD1 no hydrogen 3.276 N/A SER 141.A OG ASP 139.A OD1 no hydrogen 2.855 N/A SER 141.A OG ASP 139.A OD2 no hydrogen 3.485 N/A LYS 142.A N ASP 139.A O no hydrogen 3.034 N/A PHE 143.A N ASP 139.A O no hydrogen 3.284 N/A ILE 146.A N VAL 116.A O no hydrogen 2.884 N/A SER 147.A N PRO 127.A O no hydrogen 2.944 N/A SER 147.A OG ALA 120.A O no hydrogen 2.413 N/A ASN 148.A N ILE 118.A O no hydrogen 3.010 N/A ALA 149.A N SER 147.A OG no hydrogen 2.982 N/A SER 150.A OG THR 153.A OG1 no hydrogen 3.043 N/A CYS 151.A SG HIS 178.A NE2 no hydrogen 3.474 N/A THR 152.A OG1 TYR 315.A OH no hydrogen 2.769 N/A THR 153.A N SER 150.A OG no hydrogen 2.999 N/A THR 153.A OG1 SER 150.A OG no hydrogen 3.043 N/A THR 153.A OG1 ALA 214.A O no hydrogen 3.149 N/A ASN 154.A N SER 150.A O no hydrogen 3.095 N/A ASN 154.A ND2 ASN 148.A O no hydrogen 2.870 N/A ASN 154.A ND2 SER 150.A O no hydrogen 2.896 N/A CYS 155.A N CYS 151.A O no hydrogen 3.044 N/A CYS 155.A SG SER 294.A OG no hydrogen 3.386 N/A CYS 155.A SG SER 313.A O no hydrogen 3.775 N/A CYS 155.A SG TRP 314.A O no hydrogen 3.869 N/A LEU 156.A N THR 152.A O no hydrogen 2.879 N/A ALA 157.A N THR 153.A O no hydrogen 2.923 N/A ALA 160.A N LEU 156.A O no hydrogen 2.691 N/A LYS 161.A N ALA 157.A O no hydrogen 2.791 N/A LYS 161.A NZ ASP 165.A OD2 no hydrogen 3.261 N/A ILE 162.A N PRO 158.A O no hydrogen 3.092 N/A ILE 163.A N LEU 159.A O no hydrogen 3.070 N/A ASN 164.A N ALA 160.A O no hydrogen 2.801 N/A ASP 165.A N LYS 161.A O no hydrogen 2.914 N/A LYS 166.A N ILE 162.A O no hydrogen 3.274 N/A PHE 167.A N ILE 163.A O no hydrogen 2.876 N/A GLY 168.A N ILE 163.A O no hydrogen 3.165 N/A ILE 169.A N ASN 164.A OD1 no hydrogen 3.104 N/A VAL 170.A N LYS 249.A O no hydrogen 2.817 N/A GLY 172.A N LYS 228.A O no hydrogen 2.807 N/A LEU 173.A N THR 247.A O no hydrogen 2.764 N/A MET 174.A N THR 230.A O no hydrogen 2.908 N/A THR 175.A N ASP 245.A O no hydrogen 2.840 N/A THR 176.A N MET 232.A O no hydrogen 2.993 N/A THR 176.A OG1 VAL 243.A O no hydrogen 3.416 N/A THR 176.A OG1 TYR 315.A OH no hydrogen 2.669 N/A VAL 177.A N VAL 243.A O no hydrogen 2.864 N/A HIS 178.A N ILE 234.A O no hydrogen 2.810 N/A HIS 178.A ND1 SER 179.A O no hydrogen 2.706 N/A SER 179.A N SER 242.A OG no hydrogen 3.039 N/A SER 179.A OG THR 238.A O no hydrogen 3.228 N/A SER 179.A OG THR 238.A OG1 no hydrogen 2.585 N/A SER 179.A OG VAL 241.A O no hydrogen 2.557 N/A LEU 180.A N THR 238.A O no hydrogen 3.047 N/A GLN 184.A N THR 181.A O no hydrogen 3.192 N/A GLY 189.A N GLY 200.A O no hydrogen 2.913 N/A SER 191.A OG ASP 196.A O no hydrogen 2.792 N/A GLY 194.A N SER 191.A O no hydrogen 3.113 N/A ALA 199.A N ASP 196.A O no hydrogen 3.054 N/A ARG 201.A N ARG 198.A O no hydrogen 3.155 N/A ARG 201.A NE ASP 188.A OD1 no hydrogen 3.170 N/A CYS 202.A N ASP 188.A OD1 no hydrogen 2.869 N/A CYS 202.A SG THR 186.A O no hydrogen 3.245 N/A CYS 202.A SG ASN 205.A OD1 no hydrogen 3.124 N/A ALA 203.A N LEU 185.A O no hydrogen 2.850 N/A ASN 206.A ND2 CYS 202.A O no hydrogen 2.848 N/A ILE 208.A N ARG 235.A O no hydrogen 2.936 N/A ALA 210.A N ALA 233.A O no hydrogen 2.792 N/A ALA 214.A N THR 212.A OG1 no hydrogen 3.191 N/A ALA 217.A N GLY 213.A O no hydrogen 2.930 N/A VAL 218.A N ALA 214.A O no hydrogen 3.256 N/A VAL 218.A N ALA 215.A O no hydrogen 3.238 N/A GLY 219.A N LYS 216.A O no hydrogen 2.977 N/A LYS 220.A N ALA 217.A O no hydrogen 3.019 N/A LYS 220.A NZ LYS 216.A O no hydrogen 2.894 N/A VAL 221.A N ALA 217.A O no hydrogen 3.240 N/A ILE 222.A N VAL 218.A O no hydrogen 2.790 N/A LEU 225.A N ILE 222.A O no hydrogen 2.977 N/A ASN 226.A N PRO 223.A O no hydrogen 3.104 N/A ASN 226.A ND2 GLY 219.A O no hydrogen 3.518 N/A LYS 228.A N LEU 225.A O no hydrogen 3.069 N/A LYS 228.A NZ ALA 224.A O no hydrogen 3.231 N/A THR 230.A N GLY 172.A O no hydrogen 3.452 N/A GLY 231.A N THR 230.A OG1 no hydrogen 2.908 N/A MET 232.A N MET 174.A O no hydrogen 2.925 N/A ALA 233.A N ALA 210.A O no hydrogen 2.959 N/A ILE 234.A N THR 176.A O no hydrogen 2.727 N/A ARG 235.A N ILE 208.A O no hydrogen 2.705 N/A VAL 236.A N HIS 178.A O no hydrogen 2.946 N/A THR 238.A OG1 SER 179.A OG no hydrogen 2.585 N/A VAL 241.A N ASN 317.A OD1 no hydrogen 3.169 N/A SER 242.A N TYR 315.A O no hydrogen 2.854 N/A SER 242.A OG ASN 317.A OD1 no hydrogen 2.904 N/A VAL 243.A N VAL 177.A O no hydrogen 2.821 N/A VAL 244.A N SER 313.A O no hydrogen 2.728 N/A ASP 245.A N THR 175.A O no hydrogen 2.726 N/A LEU 246.A N LEU 311.A O no hydrogen 2.788 N/A THR 247.A N LEU 173.A O no hydrogen 2.902 N/A CYS 248.A N VAL 309.A O no hydrogen 2.947 N/A LYS 249.A N GLU 171.A O no hydrogen 2.934 N/A LEU 250.A N SER 307.A O no hydrogen 2.803 N/A ALA 251.A N GLY 168.A O no hydrogen 2.915 N/A LYS 252.A N PHE 167.A O no hydrogen 3.163 N/A ALA 254.A N ASP 306.A O no hydrogen 2.798 N/A SER 255.A N GLU 258.A OE1 no hydrogen 3.067 N/A SER 255.A OG GLU 258.A OE1 no hydrogen 3.451 N/A GLU 258.A N SER 255.A OG no hydrogen 3.065 N/A ILE 259.A N SER 255.A O no hydrogen 3.005 N/A TYR 260.A N ILE 256.A O no hydrogen 2.752 N/A GLN 261.A N GLU 257.A O no hydrogen 3.028 N/A GLN 261.A NE2 GLU 257.A OE2 no hydrogen 3.187 N/A ALA 262.A N GLU 258.A O no hydrogen 3.107 N/A VAL 263.A N ILE 259.A O no hydrogen 2.984 N/A LYS 264.A N TYR 260.A O no hydrogen 2.945 N/A GLU 265.A N GLN 261.A O no hydrogen 2.810 N/A ALA 266.A N ALA 262.A O no hydrogen 3.200 N/A SER 267.A N VAL 263.A O no hydrogen 2.798 N/A SER 267.A OG VAL 263.A O no hydrogen 2.956 N/A SER 267.A OG MET 275.A O no hydrogen 3.099 N/A ASN 268.A N LYS 264.A O no hydrogen 3.082 N/A ASN 268.A ND2 TYR 277.A OH no hydrogen 3.330 N/A GLY 269.A N ALA 266.A O no hydrogen 3.287 N/A MET 271.A N ALA 266.A O no hydrogen 2.843 N/A LYS 272.A N GLY 269.A O no hydrogen 3.243 N/A ILE 274.A N MET 271.A O no hydrogen 2.997 N/A MET 275.A N MET 271.A O no hydrogen 3.034 N/A GLY 276.A N SER 294.A O no hydrogen 2.813 N/A THR 278.A N PHE 296.A O no hydrogen 2.835 N/A ASP 280.A N THR 278.A OG1 no hydrogen 3.203 N/A VAL 283.A N ASP 286.A OD2 no hydrogen 2.960 N/A ASP 286.A N VAL 283.A O no hydrogen 3.001 N/A PHE 287.A N SER 284.A O no hydrogen 3.016 N/A ILE 288.A N THR 285.A O no hydrogen 3.226 N/A GLY 289.A N ASP 316.A OD2 no hydrogen 2.705 N/A CYS 290.A N PHE 287.A O no hydrogen 2.971 N/A LYS 291.A NZ GLU 21.A OE2 no hydrogen 3.366 N/A SER 293.A N ILE 274.A O no hydrogen 2.793 N/A SER 294.A OG CYS 155.A O no hydrogen 2.726 N/A SER 294.A OG SER 313.A OG no hydrogen 2.726 N/A ILE 295.A N TRP 314.A O no hydrogen 2.904 N/A PHE 296.A N GLY 276.A O no hydrogen 2.964 N/A ASP 297.A N ILE 312.A O no hydrogen 2.980 N/A LYS 298.A N THR 278.A O no hydrogen 3.093 N/A LYS 298.A NZ GLU 257.A OE1 no hydrogen 2.710 N/A ASN 299.A ND2 SER 279.A O no hydrogen 2.860 N/A ALA 300.A N ASP 297.A O no hydrogen 3.329 N/A CYS 301.A N LYS 298.A O no hydrogen 3.362 N/A CYS 301.A SG ASP 297.A O no hydrogen 3.258 N/A ILE 302.A N LYS 310.A O no hydrogen 3.137 N/A LEU 304.A N PHE 308.A O no hydrogen 2.981 N/A SER 307.A N ASN 305.A OD1 no hydrogen 2.913 N/A SER 307.A OG LEU 250.A O no hydrogen 3.027 N/A PHE 308.A N ASN 305.A O no hydrogen 3.365 N/A VAL 309.A N CYS 248.A O no hydrogen 3.001 N/A LYS 310.A N ILE 302.A O no hydrogen 2.835 N/A LYS 310.A NZ ASP 245.A OD1 no hydrogen 2.914 N/A LYS 310.A NZ ASP 245.A OD2 no hydrogen 3.516 N/A LYS 310.A NZ THR 247.A OG1 no hydrogen 3.028 N/A LEU 311.A N LEU 246.A O no hydrogen 2.840 N/A SER 313.A N VAL 244.A O no hydrogen 2.879 N/A SER 313.A OG SER 294.A OG no hydrogen 2.726 N/A TRP 314.A N ILE 295.A O no hydrogen 3.015 N/A TRP 314.A NE1 ASP 297.A OD2 no hydrogen 2.932 N/A TYR 315.A N SER 242.A O no hydrogen 2.947 N/A TYR 315.A OH THR 152.A OG1 no hydrogen 2.769 N/A TYR 315.A OH THR 176.A OG1 no hydrogen 2.669 N/A GLU 318.A N ASP 316.A OD1 no hydrogen 3.054 N/A SER 319.A N ASP 316.A OD1 no hydrogen 2.893 N/A GLY 320.A N ASP 316.A O no hydrogen 2.888 N/A TYR 321.A OH ALA 149.A O no hydrogen 2.520 N/A SER 322.A N GLU 318.A O no hydrogen 3.303 N/A SER 322.A OG GLU 318.A O no hydrogen 2.751 N/A ASN 323.A N SER 319.A O no hydrogen 3.253 N/A ARG 324.A N GLY 320.A O no hydrogen 3.208 N/A ARG 324.A NE ASP 327.A OD2 no hydrogen 2.809 N/A ARG 324.A NH1 LYS 291.A O no hydrogen 3.125 N/A ARG 324.A NH1 ASP 327.A OD2 no hydrogen 3.149 N/A ARG 324.A NH2 LYS 291.A O no hydrogen 2.699 N/A ARG 324.A NH2 SER 293.A OG no hydrogen 3.031 N/A LEU 325.A N TYR 321.A O no hydrogen 2.968 N/A VAL 326.A N SER 322.A O no hydrogen 3.120 N/A ASP 327.A N ASN 323.A O no hydrogen 2.810 N/A LEU 328.A N ARG 324.A O no hydrogen 2.863 N/A ALA 329.A N LEU 325.A O no hydrogen 3.006 N/A VAL 330.A N VAL 326.A O no hydrogen 2.969 N/A TYR 331.A N ASP 327.A O no hydrogen 2.913 N/A VAL 332.A N LEU 328.A O no hydrogen 2.723 N/A ALA 333.A N ALA 329.A O no hydrogen 3.051 N/A SER 334.A N VAL 330.A O no hydrogen 3.164 N/A SER 334.A OG TYR 331.A O no hydrogen 2.665 N/A ARG 335.A N VAL 332.A O no hydrogen 3.285 N/A ARG 335.A NH1 TYR 138.A O no hydrogen 2.872 N/A ARG 335.A NH1 TYR 331.A OH no hydrogen 2.928 N/A ARG 335.A NH2 TYR 138.A O no hydrogen 3.228 N/A GLY 336.A N ALA 333.A O no hydrogen 3.363 N/A