Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ct9_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 1.A OH ASP 333.A OD2 no hydrogen 2.679 N/A THR 5.A N ASP 2.A OD1 no hydrogen 3.195 N/A THR 5.A OG1 ASP 2.A OD2 no hydrogen 2.470 N/A THR 6.A OG1 ILE 3.A O no hydrogen 3.011 N/A ALA 7.A N PRO 4.A O no hydrogen 3.024 N/A GLU 8.A N THR 5.A O no hydrogen 3.118 N/A VAL 10.A N THR 6.A O no hydrogen 2.956 N/A SER 11.A N ALA 7.A O no hydrogen 2.974 N/A LEU 12.A N GLU 8.A O no hydrogen 3.062 N/A LEU 13.A N ALA 9.A O no hydrogen 3.037 N/A LYS 14.A N VAL 10.A O no hydrogen 3.311 N/A SER 15.A N SER 11.A O no hydrogen 3.489 N/A SER 15.A OG SER 11.A O no hydrogen 3.314 N/A LEU 16.A N LEU 12.A O no hydrogen 2.961 N/A ILE 17.A N LEU 13.A O no hydrogen 2.982 N/A SER 18.A N LYS 14.A O no hydrogen 3.196 N/A SER 18.A OG LYS 14.A O no hydrogen 2.964 N/A ILE 19.A N LEU 16.A O no hydrogen 3.067 N/A SER 21.A OG ILE 69.A O no hydrogen 2.775 N/A SER 23.A N THR 71.A O no hydrogen 3.143 N/A SER 23.A OG ASP 70.A OD2 no hydrogen 2.443 N/A SER 23.A OG THR 71.A O no hydrogen 3.516 N/A ARG 24.A N GLU 26.A OE2 no hydrogen 2.775 N/A GLU 25.A N ILE 22.A O no hydrogen 2.892 N/A GLU 26.A N GLU 26.A OE1 no hydrogen 2.762 N/A ALA 30.A N GLU 26.A O no hydrogen 2.997 N/A ASP 31.A N THR 27.A O no hydrogen 2.954 N/A PHE 32.A N GLN 28.A O no hydrogen 3.066 N/A LEU 33.A N ALA 29.A O no hydrogen 3.089 N/A GLN 34.A N ALA 30.A O no hydrogen 2.971 N/A GLN 34.A NE2 THR 43.A OG1 no hydrogen 3.157 N/A ASN 35.A N ASP 31.A O no hydrogen 3.099 N/A TYR 36.A N PHE 32.A O no hydrogen 2.967 N/A ILE 37.A N LEU 33.A O no hydrogen 3.145 N/A GLU 38.A N GLN 34.A O no hydrogen 3.105 N/A ALA 39.A N ASN 35.A O no hydrogen 2.944 N/A GLU 40.A N TYR 36.A O no hydrogen 3.234 N/A GLY 41.A N GLU 38.A O no hydrogen 2.904 N/A THR 43.A N GLU 38.A OE2 no hydrogen 3.046 N/A THR 43.A OG1 GLU 38.A OE2 no hydrogen 2.509 N/A GLY 44.A N TRP 51.A O no hydrogen 2.750 N/A ARG 45.A NE GLY 47.A O no hydrogen 2.954 N/A ARG 45.A NH1 ASP 31.A OD1 no hydrogen 2.948 N/A ARG 45.A NH1 GLN 34.A OE1 no hydrogen 3.219 N/A ARG 45.A NH2 ASP 31.A OD1 no hydrogen 3.546 N/A ARG 45.A NH2 ASN 48.A OD1 no hydrogen 2.929 N/A LYS 46.A N ASN 49.A O no hydrogen 3.094 N/A LYS 46.A NZ SER 134.A O no hydrogen 2.971 N/A ASN 48.A ND2 GLU 26.A OE1 no hydrogen 3.215 N/A ASN 49.A N LYS 46.A O no hydrogen 2.946 N/A ASN 49.A ND2 LYS 46.A O no hydrogen 2.881 N/A ASN 49.A ND2 GLU 130.A O no hydrogen 2.870 N/A ASN 49.A ND2 GLY 131.A O no hydrogen 3.377 N/A VAL 50.A N ALA 120.A O no hydrogen 2.823 N/A TRP 51.A N GLY 44.A O no hydrogen 2.995 N/A CYS 52.A N.A TYR 118.A O no hydrogen 2.901 N/A CYS 52.A N.B TYR 118.A O no hydrogen 2.879 N/A CYS 52.A SG.B GLN 42.A O no hydrogen 3.318 N/A CYS 52.A SG.B LEU 53.A O no hydrogen 3.909 N/A SER 54.A N LEU 116.A O no hydrogen 2.785 N/A SER 54.A OG LEU 116.A O no hydrogen 3.161 N/A ASP 57.A N ASN 115.A OD1 no hydrogen 3.081 N/A LYS 60.A N ASP 57.A O no hydrogen 3.103 N/A LYS 60.A NZ GLN 112.A O no hydrogen 2.945 N/A ILE 63.A N ASN 115.A O no hydrogen 3.157 N/A LEU 64.A N PHE 144.A O no hydrogen 3.091 N/A LEU 65.A N ILE 117.A O no hydrogen 2.890 N/A ASN 66.A N ILE 146.A O no hydrogen 2.964 N/A ASN 66.A ND2 LEU 119.A O no hydrogen 3.176 N/A ASN 66.A ND2 SER 121.A OG no hydrogen 3.314 N/A SER 67.A N LEU 119.A O no hydrogen 3.350 N/A SER 67.A OG GLY 148.A O no hydrogen 2.661 N/A HIS 68.A ND1 ASP 70.A OD1 no hydrogen 2.950 N/A HIS 68.A NE2 ASP 92.A OD1 no hydrogen 3.180 N/A ILE 69.A N SER 121.A O no hydrogen 2.926 N/A THR 71.A N SER 21.A O no hydrogen 3.015 N/A ARG 79.A N TYR 86.A O no hydrogen 3.332 N/A GLU 81.A N LYS 84.A O no hydrogen 2.942 N/A LEU 85.A N ILE 317.A O no hydrogen 2.964 N/A TYR 86.A N ARG 79.A O no hydrogen 2.783 N/A GLY 87.A N GLU 315.A O no hydrogen 2.987 N/A GLY 89.A N GLU 315.A OE1 no hydrogen 2.587 N/A SER 90.A N GLY 87.A O no hydrogen 3.252 N/A SER 90.A OG GLY 87.A O no hydrogen 2.805 N/A ASN 91.A N GLU 315.A OE2 no hydrogen 2.989 N/A ASN 91.A ND2 ARG 306.A O no hydrogen 2.869 N/A ASN 91.A ND2 SER 310.A OG no hydrogen 3.060 N/A ASP 92.A N GLU 315.A OE2 no hydrogen 3.039 N/A GLY 94.A N GLY 89.A O no hydrogen 2.774 N/A SER 96.A N ALA 93.A O no hydrogen 3.171 N/A VAL 97.A N ALA 93.A O no hydrogen 3.071 N/A VAL 98.A N GLY 94.A O no hydrogen 2.953 N/A SER 99.A N ALA 95.A O no hydrogen 3.211 N/A SER 99.A OG ALA 95.A O no hydrogen 2.630 N/A LEU 100.A N SER 96.A O no hydrogen 2.821 N/A LEU 101.A N VAL 97.A O no hydrogen 3.173 N/A GLN 102.A N VAL 98.A O no hydrogen 3.256 N/A VAL 103.A N SER 99.A O no hydrogen 3.066 N/A PHE 104.A N LEU 100.A O no hydrogen 2.867 N/A LEU 105.A N LEU 101.A O no hydrogen 3.010 N/A GLN 106.A N GLN 102.A O no hydrogen 3.186 N/A LEU 107.A N VAL 103.A O no hydrogen 3.048 N/A CYS 108.A N PHE 104.A O no hydrogen 3.141 N/A CYS 108.A SG PHE 104.A O no hydrogen 3.145 N/A ARG 109.A N GLN 106.A O no hydrogen 3.159 N/A THR 110.A N LEU 107.A O no hydrogen 3.138 N/A THR 110.A OG1 LEU 107.A O no hydrogen 2.596 N/A GLN 112.A NE2 THR 110.A OG1 no hydrogen 3.255 N/A GLN 112.A NE2 ASP 333.A OD1 no hydrogen 2.818 N/A TYR 114.A OH LEU 332.A O no hydrogen 2.509 N/A ASN 115.A N PRO 61.A O no hydrogen 2.813 N/A ASN 115.A ND2 ASP 57.A O no hydrogen 2.869 N/A ASN 115.A ND2 THR 62.A OG1 no hydrogen 3.111 N/A LEU 116.A N SER 54.A OG no hydrogen 2.821 N/A ILE 117.A N ILE 63.A O no hydrogen 3.234 N/A TYR 118.A N CYS 52.A O.A no hydrogen 2.901 N/A TYR 118.A N CYS 52.A O.B no hydrogen 2.883 N/A TYR 118.A OH VAL 97.A O no hydrogen 3.075 N/A LEU 119.A N LEU 65.A O no hydrogen 2.927 N/A ALA 120.A N VAL 50.A O no hydrogen 2.678 N/A SER 121.A N SER 67.A O no hydrogen 3.077 N/A SER 121.A OG SER 67.A O no hydrogen 3.228 N/A SER 121.A OG ASP 292.A OD2 no hydrogen 2.935 N/A CYS 122.A N ASN 49.A OD1 no hydrogen 2.983 N/A CYS 122.A SG ASN 49.A OD1 no hydrogen 3.531 N/A CYS 122.A SG GLU 130.A O no hydrogen 3.571 N/A GLU 123.A N GLU 26.A OE2 no hydrogen 3.147 N/A GLU 124.A N ASP 70.A OD1 no hydrogen 3.159 N/A GLU 125.A N ASP 70.A OD2 no hydrogen 3.200 N/A SER 127.A N GLU 124.A O no hydrogen 2.849 N/A GLY 128.A N GLU 123.A O no hydrogen 2.856 N/A GLU 130.A N GLU 123.A OE1 no hydrogen 3.230 N/A GLY 131.A N GLY 128.A O no hydrogen 3.231 N/A SER 134.A N GLY 131.A O no hydrogen 3.088 N/A SER 134.A OG GLY 131.A O no hydrogen 2.674 N/A VAL 135.A N ILE 132.A O no hydrogen 3.028 N/A LEU 136.A N ILE 132.A O no hydrogen 3.218 N/A GLY 138.A N VAL 135.A O no hydrogen 3.033 N/A LEU 139.A N LEU 136.A O no hydrogen 3.297 N/A SER 143.A N THR 62.A O no hydrogen 2.776 N/A ALA 145.A N ALA 298.A O no hydrogen 3.181 N/A ILE 146.A N LEU 64.A O no hydrogen 2.812 N/A VAL 147.A N VAL 300.A O no hydrogen 2.847 N/A GLY 148.A N ASN 66.A O no hydrogen 2.840 N/A THR 151.A N GLY 303.A O no hydrogen 3.125 N/A THR 151.A OG1 GLN 153.A O no hydrogen 2.726 N/A THR 151.A OG1 GLY 303.A O no hydrogen 3.362 N/A GLU 152.A N GLY 305.A O no hydrogen 2.824 N/A ALA 155.A N LYS 301.A O no hydrogen 2.860 N/A ILE 156.A N PHE 285.A O no hydrogen 2.968 N/A GLU 158.A N SER 266.A O no hydrogen 3.054 N/A LYS 159.A N SER 287.A O no hydrogen 3.177 N/A GLY 160.A N SER 235.A O no hydrogen 3.365 N/A LEU 161.A N LEU 263.A O no hydrogen 2.834 N/A LEU 163.A N VAL 231.A O no hydrogen 2.948 N/A ASP 164.A N LYS 257.A O no hydrogen 3.070 N/A VAL 165.A N PHE 229.A O no hydrogen 3.002 N/A THR 166.A N ASP 255.A O no hydrogen 2.979 N/A THR 166.A OG1 THR 228.A OG1 no hydrogen 3.404 N/A ALA 167.A N CYS 227.A O no hydrogen 2.913 N/A GLY 169.A N ASP 225.A O no hydrogen 2.778 N/A LYS 170.A N ASP 180.A O no hydrogen 2.935 N/A HIS 173.A N GLU 178.A OE1 no hydrogen 3.030 N/A HIS 173.A ND1 GLU 178.A OE1 no hydrogen 3.037 N/A ALA 174.A N ASN 221.A O no hydrogen 2.973 N/A ARG 176.A N HIS 173.A O no hydrogen 3.243 N/A ASP 180.A N LYS 170.A O no hydrogen 2.850 N/A ALA 182.A N PRO 224.A O no hydrogen 2.935 N/A ILE 183.A N ASN 181.A OD1 no hydrogen 2.940 N/A TYR 184.A N ASN 181.A OD1 no hydrogen 3.322 N/A LYS 185.A NZ THR 168.A O no hydrogen 3.376 N/A LYS 185.A NZ ASP 180.A OD1 no hydrogen 2.685 N/A LYS 185.A NZ ASP 180.A OD2 no hydrogen 2.641 N/A VAL 186.A N ILE 183.A O no hydrogen 3.238 N/A ILE 190.A N VAL 186.A O no hydrogen 3.059 N/A ALA 191.A N LEU 187.A O no hydrogen 3.302 N/A TRP 192.A N ASN 188.A O no hydrogen 3.081 N/A PHE 193.A N ASP 189.A O no hydrogen 3.004 N/A ARG 194.A N ILE 190.A O no hydrogen 3.179 N/A ARG 194.A NE ASP 195.A OD1 no hydrogen 2.881 N/A ARG 194.A NH2 ASP 195.A OD2 no hydrogen 3.294 N/A ASP 195.A N ALA 191.A O no hydrogen 2.937 N/A TYR 196.A N TRP 192.A O no hydrogen 2.897 N/A ARG 197.A NH1 ARG 194.A O no hydrogen 2.801 N/A ARG 197.A NH1 TYR 196.A O no hydrogen 3.022 N/A ARG 197.A NH2 ARG 194.A O no hydrogen 3.394 N/A LYS 200.A N TYR 239.A OH no hydrogen 3.002 N/A SER 202.A N GLY 206.A O no hydrogen 3.487 N/A SER 202.A OG GLU 237.A OE1 no hydrogen 2.954 N/A SER 202.A OG GLU 237.A OE2 no hydrogen 2.529 N/A LEU 204.A N SER 202.A OG no hydrogen 3.027 N/A LEU 205.A N SER 202.A OG no hydrogen 3.082 N/A GLY 206.A N SER 202.A O no hydrogen 2.899 N/A LYS 209.A N ARG 234.A O no hydrogen 2.982 N/A THR 212.A N VAL 230.A O no hydrogen 3.014 N/A ASN 215.A N THR 228.A O no hydrogen 3.039 N/A THR 218.A OG1 GLN 219.A OE1 no hydrogen 2.635 N/A ASN 221.A N ASN 221.A OD1 no hydrogen 2.628 N/A VAL 222.A N GLN 219.A O no hydrogen 3.372 N/A VAL 223.A N GLY 172.A O no hydrogen 3.002 N/A LYS 226.A NZ THR 168.A OG1 no hydrogen 3.349 N/A CYS 227.A N ALA 167.A O no hydrogen 3.216 N/A CYS 227.A SG ASN 215.A O no hydrogen 3.958 N/A THR 228.A N ASN 215.A O no hydrogen 3.123 N/A THR 228.A OG1 THR 166.A OG1 no hydrogen 3.404 N/A PHE 229.A N VAL 165.A O no hydrogen 3.010 N/A VAL 230.A N VAL 213.A O no hydrogen 2.964 N/A VAL 231.A N LEU 163.A O no hydrogen 2.985 N/A ASP 232.A N SER 210.A O no hydrogen 2.994 N/A ARG 234.A N LYS 209.A O no hydrogen 2.871 N/A ARG 234.A NH1 ASP 232.A OD1 no hydrogen 3.204 N/A SER 235.A OG ASN 236.A O no hydrogen 3.506 N/A ASN 236.A ND2 LYS 200.A O no hydrogen 2.910 N/A ASN 236.A ND2 GLY 206.A O no hydrogen 3.101 N/A GLU 237.A N GLU 237.A OE1 no hydrogen 2.593 N/A LEU 238.A N ASN 236.A OD1 no hydrogen 3.059 N/A SER 240.A N ASP 243.A OD2 no hydrogen 2.896 N/A ASN 241.A N ASN 264.A OD1 no hydrogen 2.918 N/A ASN 241.A ND2 LEU 161.A O no hydrogen 3.085 N/A ASN 241.A ND2 PHE 261.A O no hydrogen 2.929 N/A ASN 241.A ND2 LEU 263.A O no hydrogen 3.183 N/A ASP 243.A N SER 240.A O no hydrogen 3.078 N/A ASP 243.A N SER 240.A OG no hydrogen 3.263 N/A LEU 244.A N SER 240.A O no hydrogen 3.341 N/A PHE 245.A N ASN 241.A O no hydrogen 3.019 N/A ALA 246.A N GLU 242.A O no hydrogen 3.021 N/A GLU 247.A N ASP 243.A O no hydrogen 3.371 N/A ILE 248.A N LEU 244.A O no hydrogen 2.985 N/A ARG 249.A N PHE 245.A O no hydrogen 2.986 N/A LYS 250.A N GLU 247.A O no hydrogen 3.080 N/A HIS 251.A N ILE 248.A O no hydrogen 3.017 N/A HIS 251.A ND1 GLU 247.A O no hydrogen 2.966 N/A ILE 252.A N ILE 248.A O no hydrogen 3.085 N/A CYS 254.A SG ASP 189.A OD2 no hydrogen 3.336 N/A LYS 257.A N ASP 164.A O no hydrogen 2.996 N/A ARG 259.A N VAL 162.A O no hydrogen 2.882 N/A ARG 259.A NE ASP 164.A OD2 no hydrogen 2.830 N/A ARG 259.A NH2 ASP 164.A OD1 no hydrogen 2.883 N/A ARG 262.A NH1 SER 127.A O no hydrogen 3.348 N/A ARG 262.A NH1 GLU 133.A OE2 no hydrogen 3.339 N/A ARG 262.A NH2 SER 127.A O no hydrogen 2.641 N/A SER 265.A OG ASN 236.A O no hydrogen 2.945 N/A SER 265.A OG TYR 239.A O no hydrogen 2.898 N/A SER 266.A N GLU 158.A O no hydrogen 2.983 N/A SER 266.A OG GLN 293.A O no hydrogen 3.130 N/A ARG 267.A NH2 ASP 269.A OD1 no hydrogen 3.208 N/A ILE 268.A N ILE 156.A O no hydrogen 2.987 N/A LYS 271.A N ASP 269.A OD2 no hydrogen 3.072 N/A HIS 272.A N ASP 269.A O no hydrogen 3.069 N/A PHE 274.A N HIS 272.A ND1 no hydrogen 3.169 N/A GLN 276.A N HIS 272.A O no hydrogen 3.022 N/A LYS 277.A N PRO 273.A O no hydrogen 2.919 N/A ALA 278.A N PHE 274.A O no hydrogen 2.957 N/A VAL 279.A N VAL 275.A O no hydrogen 2.931 N/A LYS 280.A N GLN 276.A O no hydrogen 2.947 N/A ARG 282.A N ALA 278.A O no hydrogen 3.064 N/A ILE 283.A N GLN 153.A OE1 no hydrogen 2.759 N/A PHE 285.A N PRO 154.A O no hydrogen 3.038 N/A SER 287.A N ALA 157.A O no hydrogen 2.724 N/A SER 287.A OG THR 289.A O no hydrogen 3.543 N/A THR 289.A N SER 287.A OG no hydrogen 3.074 N/A SER 291.A N GLU 158.A OE2 no hydrogen 3.179 N/A SER 291.A OG GLU 158.A OE1 no hydrogen 2.595 N/A SER 291.A OG GLU 158.A OE2 no hydrogen 3.520 N/A GLN 293.A N SER 291.A OG no hydrogen 3.388 N/A GLN 293.A NE2 GLU 158.A OE1 no hydrogen 2.752 N/A ALA 294.A N SER 291.A O no hydrogen 3.010 N/A LEU 295.A N ASP 292.A O no hydrogen 3.198 N/A SER 299.A OG GLN 293.A OE1 no hydrogen 2.705 N/A VAL 300.A N ALA 145.A O no hydrogen 3.119 N/A LYS 301.A N ALA 155.A O no hydrogen 3.172 N/A LYS 301.A NZ GLU 158.A OE1 no hydrogen 2.947 N/A LYS 301.A NZ SER 287.A OG no hydrogen 2.964 N/A ILE 302.A N VAL 147.A O no hydrogen 2.958 N/A GLY 303.A N THR 151.A OG1 no hydrogen 3.152 N/A ARG 309.A N ARG 306.A O no hydrogen 2.852 N/A ARG 309.A NE TYR 316.A O no hydrogen 3.235 N/A ARG 309.A NH2 GLU 320.A OE2 no hydrogen 3.215 N/A SER 310.A N SER 307.A O no hydrogen 3.210 N/A THR 312.A OG1 SER 308.A O no hydrogen 3.505 N/A THR 312.A OG1 ARG 309.A O no hydrogen 3.497 N/A THR 312.A OG1 SER 310.A O no hydrogen 3.016 N/A ILE 317.A N LEU 85.A O no hydrogen 3.205 N/A ILE 321.A N LEU 318.A O no hydrogen 3.126 N/A GLU 322.A N LEU 318.A O no hydrogen 3.202 N/A GLU 323.A N LYS 319.A O no hydrogen 2.912 N/A ALA 324.A N GLU 320.A O no hydrogen 3.074 N/A ILE 325.A N ILE 321.A O no hydrogen 3.123 N/A GLY 326.A N GLU 322.A O no hydrogen 3.486 N/A ILE 327.A N GLU 323.A O no hydrogen 3.015 N/A TYR 328.A N ALA 324.A O no hydrogen 2.844 N/A TYR 328.A OH ILE 302.A O no hydrogen 2.715 N/A LEU 329.A N ILE 325.A O no hydrogen 3.090 N/A ASP 330.A N GLY 326.A O no hydrogen 3.113 N/A LEU 331.A N ILE 327.A O no hydrogen 3.091 N/A LEU 332.A N TYR 328.A O no hydrogen 2.988 N/A ASP 333.A N LEU 329.A O no hydrogen 2.954 N/A GLY 334.A N GLN 112.A OE1 no hydrogen 3.198 N/A LEU 335.A N LEU 332.A O no hydrogen 3.158 N/A