Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4k25_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 1.A N ASP 68.A OD2 no hydrogen 2.821 N/A TYR 1.A OH GLU 315.A OE2 no hydrogen 2.719 N/A VAL 3.A N LEU 18.A O no hydrogen 3.181 N/A LEU 4.A N LEU 69.A O no hydrogen 2.977 N/A ALA 5.A N SER 16.A O no hydrogen 2.909 N/A ILE 6.A N CYS 71.A O no hydrogen 3.033 N/A GLU 7.A N CYS 14.A O no hydrogen 3.046 N/A SER 9.A N GLU 7.A OE2 no hydrogen 3.165 N/A SER 9.A OG GLU 7.A OE2 no hydrogen 2.617 N/A SER 9.A OG HIS 104.A ND1 no hydrogen 3.135 N/A CYS 10.A SG ASP 302.A OD2 no hydrogen 3.188 N/A THR 13.A N LYS 34.A O no hydrogen 2.920 N/A THR 13.A OG1 LYS 34.A O no hydrogen 3.101 N/A CYS 14.A N GLU 7.A O no hydrogen 2.864 N/A CYS 14.A SG ASP 302.A O no hydrogen 3.775 N/A VAL 15.A N ASN 32.A O no hydrogen 3.232 N/A SER 16.A N ALA 5.A O no hydrogen 2.996 N/A SER 16.A OG SER 304.A OG no hydrogen 2.830 N/A VAL 17.A N LEU 30.A O no hydrogen 2.940 N/A LEU 18.A N VAL 3.A O no hydrogen 2.779 N/A ASP 19.A N PRO 27.A O no hydrogen 3.041 N/A ARG 20.A N TYR 1.A O no hydrogen 3.128 N/A ARG 20.A NE GLU 315.A OE2 no hydrogen 2.782 N/A ARG 20.A NH1 ASN 115.A OD1 no hydrogen 2.978 N/A ARG 20.A NH2 ASN 115.A OD1 no hydrogen 2.823 N/A ALA 25.A N SER 22.A O no hydrogen 3.514 N/A LEU 30.A N VAL 17.A O no hydrogen 2.904 N/A ASN 32.A N VAL 15.A O no hydrogen 2.732 N/A LYS 34.A N THR 13.A O no hydrogen 3.054 N/A THR 36.A N ASP 11.A O no hydrogen 3.330 N/A THR 36.A OG1 ASP 38.A OD2 no hydrogen 3.545 N/A HIS 45.A N LYS 41.A O no hydrogen 2.967 N/A HIS 46.A N ALA 42.A O no hydrogen 3.007 N/A GLN 47.A N HIS 43.A O no hydrogen 3.005 N/A ALA 48.A N ILE 44.A O no hydrogen 3.032 N/A ALA 48.A N HIS 45.A O no hydrogen 2.944 N/A ARG 49.A N HIS 45.A O no hydrogen 2.910 N/A ARG 49.A N HIS 46.A O no hydrogen 3.130 N/A ILE 50.A N HIS 46.A O no hydrogen 2.937 N/A LEU 53.A N ARG 49.A O no hydrogen 2.835 N/A THR 54.A N GLY 51.A O no hydrogen 3.004 N/A THR 54.A OG1 ILE 50.A O no hydrogen 2.652 N/A GLU 55.A N GLY 51.A O no hydrogen 3.303 N/A ARG 56.A N PRO 52.A O no hydrogen 3.375 N/A LEU 58.A N GLU 55.A O no hydrogen 3.212 N/A ILE 59.A N GLU 55.A O no hydrogen 2.790 N/A GLU 60.A N ARG 56.A O no hydrogen 2.937 N/A SER 61.A OG ALA 57.A O no hydrogen 3.122 N/A SER 61.A OG LEU 58.A O no hydrogen 3.006 N/A ASP 68.A N LYS 2.A O no hydrogen 2.920 N/A ILE 70.A N PRO 98.A O no hydrogen 3.050 N/A CYS 71.A N LEU 4.A O no hydrogen 2.744 N/A CYS 71.A SG ILE 306.A O no hydrogen 3.748 N/A VAL 72.A N ILE 100.A O no hydrogen 3.333 N/A ARG 74.A N VAL 102.A O no hydrogen 2.831 N/A ARG 74.A NE CYS 326.A O no hydrogen 3.328 N/A ARG 74.A NH1 ASP 340.A O no hydrogen 2.988 N/A ARG 74.A NH2 ASP 340.A O no hydrogen 2.832 N/A GLY 75.A N VAL 102.A O no hydrogen 2.816 N/A GLY 77.A N ARG 329.A O no hydrogen 2.989 N/A SER 80.A OG HIS 46.A ND1 no hydrogen 3.390 N/A SER 82.A N PRO 78.A O no hydrogen 2.860 N/A SER 82.A OG GLY 79.A O no hydrogen 2.896 N/A LEU 85.A N LEU 81.A O no hydrogen 3.088 N/A ASP 86.A N SER 82.A O no hydrogen 2.864 N/A ALA 88.A N GLY 84.A O no hydrogen 2.858 N/A LYS 89.A N LEU 85.A O no hydrogen 2.902 N/A LYS 89.A NZ ASP 86.A OD1 no hydrogen 3.414 N/A LYS 89.A NZ ILE 325.A O no hydrogen 2.649 N/A GLY 90.A N ASP 86.A O no hydrogen 3.091 N/A LEU 91.A N PHE 87.A O no hydrogen 3.092 N/A ALA 92.A N ALA 88.A O no hydrogen 2.974 N/A VAL 93.A N LYS 89.A O no hydrogen 2.833 N/A ALA 94.A N GLY 90.A O no hydrogen 3.217 N/A TRP 95.A N LEU 91.A O no hydrogen 2.838 N/A ASN 96.A N ALA 92.A O no hydrogen 2.774 N/A LYS 97.A N ALA 92.A O no hydrogen 3.083 N/A LYS 97.A NZ TRP 95.A O no hydrogen 3.180 N/A ILE 100.A N ILE 70.A O no hydrogen 2.992 N/A GLY 101.A N SER 321.A OG no hydrogen 3.140 N/A VAL 102.A N VAL 72.A O no hydrogen 2.740 N/A HIS 103.A NE2 TRP 331.A O no hydrogen 2.767 N/A HIS 104.A NE2 ASP 302.A OD1 no hydrogen 2.832 N/A GLY 106.A N HIS 103.A O no hydrogen 3.331 N/A GLY 106.A N HIS 104.A O no hydrogen 3.045 N/A HIS 107.A NE2 HIS 104.A NE2 no hydrogen 3.079 N/A LEU 109.A N LEU 105.A O no hydrogen 2.898 N/A ILE 110.A N GLY 106.A O no hydrogen 2.827 N/A ARG 112.A N LEU 109.A O no hydrogen 3.001 N/A ARG 112.A NE GLU 312.A OE1 no hydrogen 3.264 N/A ARG 112.A NE GLU 312.A OE2 no hydrogen 2.890 N/A ARG 112.A NH1 PRO 119.A O no hydrogen 3.067 N/A ARG 112.A NH2 GLU 312.A OE1 no hydrogen 3.279 N/A THR 114.A OG1 ARG 112.A O no hydrogen 3.561 N/A GLY 116.A N ARG 112.A O no hydrogen 2.723 N/A GLN 120.A N VAL 118.A O no hydrogen 2.789 N/A PHE 123.A N SER 138.A O no hydrogen 3.360 N/A VAL 124.A N GLU 261.A O no hydrogen 3.486 N/A SER 125.A N VAL 136.A O no hydrogen 2.683 N/A LEU 126.A N VAL 263.A O no hydrogen 2.873 N/A LEU 127.A N THR 134.A O no hydrogen 2.750 N/A SER 129.A N HIS 132.A O no hydrogen 3.262 N/A THR 133.A OG1 HIS 132.A O no hydrogen 2.534 N/A THR 134.A N LEU 127.A O no hydrogen 3.329 N/A THR 134.A OG1 ASP 149.A OD1 no hydrogen 2.731 N/A PHE 135.A N CYS 148.A O no hydrogen 2.704 N/A VAL 136.A N SER 125.A O no hydrogen 2.734 N/A LEU 137.A N GLU 145.A O no hydrogen 2.890 N/A SER 138.A N PHE 123.A O no hydrogen 3.044 N/A SER 138.A OG HIS 144.A ND1 no hydrogen 2.845 N/A ARG 139.A N ASP 143.A O no hydrogen 3.210 N/A HIS 144.A NE2 ILE 141.A O no hydrogen 2.873 N/A GLU 145.A N LEU 137.A O no hydrogen 2.668 N/A LEU 147.A N PHE 135.A O no hydrogen 2.842 N/A ASP 149.A N LEU 195.A O no hydrogen 3.152 N/A THR 150.A N THR 133.A O no hydrogen 3.044 N/A THR 150.A OG1 ILE 153.A O no hydrogen 2.741 N/A ILE 151.A N PHE 197.A O no hydrogen 2.885 N/A VAL 155.A N THR 133.A OG1 no hydrogen 3.291 N/A GLY 156.A N SER 129.A O no hydrogen 3.339 N/A SER 158.A N ALA 154.A O no hydrogen 2.880 N/A SER 158.A OG PHE 199.A O no hydrogen 3.213 N/A LEU 159.A N VAL 155.A O no hydrogen 2.750 N/A ASP 160.A N GLY 156.A O no hydrogen 3.021 N/A LYS 161.A N ASP 157.A O no hydrogen 2.752 N/A CYS 162.A N SER 158.A O no hydrogen 3.102 N/A CYS 162.A SG SER 158.A O no hydrogen 3.289 N/A GLY 163.A N LEU 159.A O no hydrogen 3.076 N/A ARG 164.A N ASP 160.A O no hydrogen 3.167 N/A LEU 166.A N GLY 163.A O no hydrogen 3.105 N/A GLY 167.A N GLY 163.A O no hydrogen 3.252 N/A LYS 177.A N ARG 174.A O no hydrogen 2.999 N/A PHE 178.A N GLU 175.A O no hydrogen 3.072 N/A ASN 180.A N GLU 176.A O no hydrogen 2.907 N/A LEU 190.A N ASP 187.A O no hydrogen 3.138 N/A LEU 192.A N LEU 190.A O no hydrogen 3.179 N/A LEU 192.A N GLN 232.A OE1 no hydrogen 3.321 N/A PHE 197.A N ASP 149.A O no hydrogen 2.820 N/A SER 200.A N ASP 152.A OD2 no hydrogen 3.277 N/A PHE 202.A N PHE 199.A O no hydrogen 3.200 N/A ALA 205.A N ALA 201.A O no hydrogen 2.800 N/A LEU 206.A N PHE 202.A O no hydrogen 2.951 N/A ARG 207.A N ILE 203.A O no hydrogen 3.275 N/A ARG 207.A NE GLU 165.A OE2 no hydrogen 3.294 N/A ARG 207.A NH2 GLU 165.A OE2 no hydrogen 3.285 N/A THR 208.A N THR 204.A O no hydrogen 3.363 N/A THR 208.A OG1 THR 204.A O no hydrogen 3.289 N/A THR 208.A OG1 ALA 205.A O no hydrogen 2.875 N/A ASN 209.A N ALA 205.A O no hydrogen 3.147 N/A ASN 209.A ND2 GLU 193.A O no hydrogen 3.461 N/A ASN 209.A ND2 ALA 205.A O no hydrogen 2.807 N/A LEU 210.A N LEU 206.A O no hydrogen 2.807 N/A THR 211.A N ARG 207.A O no hydrogen 2.968 N/A THR 211.A OG1 ARG 207.A O no hydrogen 3.068 N/A THR 211.A OG1 THR 208.A O no hydrogen 3.016 N/A LYS 212.A N THR 208.A O no hydrogen 3.092 N/A LEU 213.A N ASN 209.A O no hydrogen 3.083 N/A THR 216.A OG1 GLU 217.A OE2 no hydrogen 3.554 N/A LEU 221.A N GLU 217.A O no hydrogen 3.269 N/A ILE 226.A N PRO 222.A O no hydrogen 3.357 N/A ARG 227.A NH1 ASP 182.A O no hydrogen 3.418 N/A SER 228.A N ARG 224.A O no hydrogen 3.294 N/A SER 228.A N GLU 225.A O no hydrogen 3.159 N/A SER 228.A OG ASP 187.A O no hydrogen 3.256 N/A SER 228.A OG GLU 225.A O no hydrogen 2.719 N/A ILE 229.A N GLU 225.A O no hydrogen 3.247 N/A ALA 230.A N ILE 226.A O no hydrogen 3.161 N/A TYR 231.A N ARG 227.A O no hydrogen 3.044 N/A GLN 232.A N SER 228.A O no hydrogen 3.251 N/A VAL 233.A N ILE 229.A O no hydrogen 2.806 N/A GLN 234.A N ALA 230.A O no hydrogen 3.193 N/A GLU 235.A N TYR 231.A O no hydrogen 2.839 N/A SER 236.A N GLN 232.A O no hydrogen 3.059 N/A SER 236.A OG GLN 232.A O no hydrogen 3.037 N/A SER 236.A OG VAL 233.A O no hydrogen 2.678 N/A VAL 237.A N VAL 233.A O no hydrogen 2.972 N/A PHE 238.A N GLN 234.A O no hydrogen 3.224 N/A ASP 239.A N GLU 235.A O no hydrogen 2.819 N/A HIS 240.A N SER 236.A O no hydrogen 3.173 N/A ILE 242.A N PHE 238.A O no hydrogen 3.005 N/A ASN 243.A N ASP 239.A O no hydrogen 2.984 N/A ASN 243.A ND2 ASP 239.A O no hydrogen 2.784 N/A LYS 244.A N HIS 240.A O no hydrogen 3.169 N/A LYS 244.A N ILE 241.A O no hydrogen 3.133 N/A LYS 244.A NZ ASN 194.A O no hydrogen 2.875 N/A LEU 245.A N ILE 241.A O no hydrogen 3.016 N/A LYS 246.A N ILE 242.A O no hydrogen 2.797 N/A LYS 246.A NZ GLU 281.A OE1 no hydrogen 2.780 N/A HIS 247.A N ASN 243.A O no hydrogen 3.108 N/A VAL 248.A N LYS 244.A O no hydrogen 3.105 N/A LEU 249.A N LEU 245.A O no hydrogen 3.153 N/A LYS 250.A N LYS 246.A O no hydrogen 3.257 N/A SER 251.A N HIS 247.A O no hydrogen 3.040 N/A GLN 252.A N VAL 248.A O no hydrogen 3.315 N/A LYS 255.A NZ GLU 145.A OE2 no hydrogen 2.818 N/A PHE 256.A N PRO 253.A O no hydrogen 3.192 N/A PHE 262.A N ASN 292.A O no hydrogen 3.098 N/A VAL 263.A N VAL 124.A O no hydrogen 3.226 N/A CYS 264.A SG SER 269.A OG no hydrogen 3.131 N/A SER 265.A N LEU 126.A O no hydrogen 3.004 N/A VAL 268.A N VAL 128.A O no hydrogen 3.140 N/A SER 269.A OG GLY 266.A O no hydrogen 3.551 N/A ASN 271.A N VAL 268.A O no hydrogen 3.046 N/A GLN 272.A N GLU 176.A OE2 no hydrogen 3.007 N/A ARG 273.A NE GLU 235.A OE1 no hydrogen 3.326 N/A ARG 273.A NE GLU 235.A OE2 no hydrogen 3.058 N/A ARG 273.A NH2 GLU 235.A OE2 no hydrogen 2.664 N/A LEU 274.A N ASN 271.A OD1 no hydrogen 3.041 N/A ARG 275.A N ASN 271.A O no hydrogen 3.293 N/A ARG 275.A NE SER 269.A O no hydrogen 2.778 N/A ARG 275.A NH2 SER 269.A O no hydrogen 3.417 N/A THR 276.A N GLN 272.A O no hydrogen 2.966 N/A THR 276.A OG1 GLN 272.A O no hydrogen 2.838 N/A THR 276.A OG1 ARG 273.A O no hydrogen 3.233 N/A LYS 277.A N ARG 273.A O no hydrogen 2.801 N/A LYS 277.A NZ GLU 235.A OE2 no hydrogen 2.769 N/A LYS 277.A NZ ASP 239.A OD1 no hydrogen 2.990 N/A LEU 278.A N LEU 274.A O no hydrogen 2.983 N/A GLU 279.A N ARG 275.A O no hydrogen 3.037 N/A THR 280.A N THR 276.A O no hydrogen 3.074 N/A THR 280.A OG1 THR 276.A O no hydrogen 2.703 N/A GLU 281.A N LYS 277.A O no hydrogen 3.201 N/A LEU 282.A N LEU 278.A O no hydrogen 3.334 N/A THR 284.A N GLU 281.A O no hydrogen 3.475 N/A THR 288.A OG1 LEU 282.A O no hydrogen 3.246 N/A THR 288.A OG1 LEU 285.A O no hydrogen 2.688 N/A SER 289.A OG PHE 256.A O no hydrogen 2.905 N/A TYR 294.A N PHE 262.A O no hydrogen 2.879 N/A CYS 300.A N PRO 297.A O no hydrogen 3.050 N/A CYS 300.A SG PRO 296.A O no hydrogen 3.628 N/A CYS 300.A SG PRO 297.A O no hydrogen 3.378 N/A SER 301.A OG ASP 298.A O no hydrogen 3.503 N/A ASN 303.A ND2 LEU 299.A O no hydrogen 2.783 N/A ASN 303.A ND2 SER 301.A O no hydrogen 2.924 N/A SER 304.A OG SER 16.A OG no hydrogen 2.830 N/A GLY 307.A N SER 304.A O no hydrogen 3.157 N/A TRP 308.A N ILE 305.A O no hydrogen 2.832 N/A GLY 310.A N ILE 306.A O no hydrogen 2.917 N/A ILE 311.A N GLY 307.A O no hydrogen 3.192 N/A GLU 312.A N TRP 308.A O no hydrogen 2.983 N/A ILE 313.A N ALA 309.A O no hydrogen 2.995 N/A TRP 314.A N GLY 310.A O no hydrogen 2.778 N/A GLU 315.A N ILE 311.A O no hydrogen 2.985 N/A SER 316.A N GLU 312.A O no hydrogen 2.804 N/A LEU 317.A N ILE 313.A O no hydrogen 3.166 N/A LEU 319.A N ILE 313.A O no hydrogen 3.479 N/A VAL 320.A N ARG 343.A O no hydrogen 2.790 N/A SER 321.A N LEU 99.A O no hydrogen 2.735 N/A ASP 322.A N GLY 341.A O no hydrogen 2.551 N/A ILE 325.A N ASP 322.A O no hydrogen 3.304 N/A CYS 326.A SG ASP 324.A O no hydrogen 3.719 N/A TRP 331.A NE1 ASP 335.A O no hydrogen 2.728 N/A ASN 334.A ND2 HIS 144.A O no hydrogen 3.341 N/A ASP 335.A N PRO 332.A O no hydrogen 3.158 N/A TRP 342.A NE1 LEU 336.A O no hydrogen 2.793 N/A ARG 343.A N VAL 320.A O no hydrogen 2.788 N/A ASP 345.A N ARG 318.A O no hydrogen 3.040 N/A