Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4jay_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 4.A N SER 1.A O no hydrogen 3.387 N/A GLN 5.A N LEU 25.A O no hydrogen 2.860 N/A HIS 7.A N ARG 23.A O no hydrogen 3.003 N/A CYS 8.A N ALA 22.A O no hydrogen 3.052 N/A CYS 8.A SG SER 9.A O no hydrogen 3.640 N/A SER 9.A OG ASP 19.A OD1 no hydrogen 2.638 N/A LEU 10.A N VAL 20.A O no hydrogen 2.947 N/A LYS 11.A N SER 9.A OG no hydrogen 3.262 N/A TYR 13.A N LEU 10.A O no hydrogen 2.950 N/A ASN 14.A ND2 LEU 10.A O no hydrogen 2.949 N/A ASN 14.A ND2 ILE 18.A O no hydrogen 2.928 N/A THR 15.A N GLY 54.A O no hydrogen 2.664 N/A THR 15.A OG1 GLY 54.A O no hydrogen 3.309 N/A THR 15.A OG1 ASN 235.A O no hydrogen 2.652 N/A GLY 17.A N ASN 14.A O no hydrogen 3.010 N/A ILE 18.A N ASN 14.A OD1 no hydrogen 2.927 N/A ARG 21.A N ASP 62.A OD1 no hydrogen 3.013 N/A ALA 22.A N CYS 8.A O no hydrogen 2.814 N/A ARG 23.A N VAL 63.A O no hydrogen 2.940 N/A LEU 24.A N ALA 65.A O no hydrogen 3.396 N/A LEU 25.A N GLN 5.A O no hydrogen 2.598 N/A ALA 26.A N VAL 67.A O no hydrogen 2.817 N/A HIS 27.A NE2 GLN 5.A OE1 no hydrogen 3.254 N/A ALA 28.A N ARG 69.A O no hydrogen 2.820 N/A ARG 29.A N ASP 33.A OD2 no hydrogen 2.859 N/A ASP 33.A N ASP 30.A OD1 no hydrogen 3.187 N/A VAL 34.A N ASP 30.A O no hydrogen 3.152 N/A ARG 35.A N GLU 31.A O no hydrogen 3.136 N/A ARG 35.A NE GLU 31.A OE1 no hydrogen 3.432 N/A ARG 35.A NH1 GLY 150.A O no hydrogen 2.785 N/A ARG 35.A NH2 GLY 150.A O no hydrogen 2.794 N/A GLU 36.A N ALA 32.A O no hydrogen 3.060 N/A ALA 37.A N ASP 33.A O no hydrogen 2.917 N/A LEU 38.A N VAL 34.A O no hydrogen 2.920 N/A ALA 39.A N ARG 35.A O no hydrogen 2.889 N/A LEU 40.A N GLU 36.A O no hydrogen 2.840 N/A ALA 41.A N ALA 37.A O no hydrogen 2.904 N/A ARG 42.A N LEU 38.A O no hydrogen 3.065 N/A GLU 43.A N ALA 39.A O no hydrogen 2.803 N/A ARG 44.A N LEU 40.A O no hydrogen 2.810 N/A GLY 45.A N ARG 42.A O no hydrogen 3.174 N/A LEU 46.A N ALA 41.A O no hydrogen 2.763 N/A LEU 49.A N LEU 66.A O no hydrogen 2.844 N/A ILE 51.A N LEU 68.A O no hydrogen 2.926 N/A ASN 56.A ND2 GLN 126.A OE1 no hydrogen 3.453 N/A ASN 56.A ND2 GLU 334.A O no hydrogen 3.337 N/A LEU 58.A N ASN 336.A O no hydrogen 2.780 N/A THR 60.A N TYR 338.A O no hydrogen 3.018 N/A THR 60.A OG1 TYR 338.A O no hydrogen 2.460 N/A VAL 63.A N ARG 21.A O no hydrogen 2.740 N/A GLU 64.A N TYR 338.A OH no hydrogen 3.392 N/A LEU 66.A N PRO 47.A O no hydrogen 2.889 N/A VAL 67.A N LEU 24.A O no hydrogen 2.817 N/A LEU 68.A N LEU 49.A O no hydrogen 2.743 N/A ARG 69.A N ALA 26.A O no hydrogen 2.802 N/A ARG 69.A NE HIS 27.A ND1 no hydrogen 3.075 N/A ARG 69.A NH2 HIS 27.A ND1 no hydrogen 3.230 N/A MET 70.A N ILE 51.A O no hydrogen 2.906 N/A ALA 71.A N ALA 28.A O no hydrogen 2.606 N/A GLY 74.A N GLU 93.A OE2 no hydrogen 2.581 N/A ARG 76.A N GLU 88.A O no hydrogen 2.903 N/A ARG 76.A NE GLU 88.A OE1 no hydrogen 2.798 N/A VAL 78.A N LEU 86.A O no hydrogen 2.813 N/A SER 79.A N LEU 86.A O no hydrogen 3.403 N/A ALA 81.A N SER 84.A O no hydrogen 2.940 N/A SER 84.A N ALA 81.A O no hydrogen 3.129 N/A VAL 85.A N LEU 185.A O no hydrogen 2.727 N/A LEU 86.A N SER 79.A O no hydrogen 2.785 N/A VAL 87.A N LEU 183.A O no hydrogen 2.814 N/A GLU 88.A N ARG 76.A O no hydrogen 2.869 N/A ALA 89.A N VAL 181.A O no hydrogen 2.916 N/A GLU 90.A N GLY 74.A O no hydrogen 2.882 N/A ALA 91.A N LEU 179.A O no hydrogen 2.858 N/A GLY 92.A N SER 72.A OG no hydrogen 2.851 N/A GLU 93.A N GLU 90.A O no hydrogen 3.056 N/A TRP 95.A N GLY 118.A O no hydrogen 2.750 N/A TRP 95.A NE1 LEU 113.A O no hydrogen 2.959 N/A PHE 98.A N ALA 94.A O no hydrogen 3.238 N/A VAL 99.A N TRP 95.A O no hydrogen 2.990 N/A GLN 100.A N ASP 96.A O no hydrogen 2.991 N/A GLN 100.A NE2 ASP 96.A OD1 no hydrogen 3.238 N/A TRP 101.A N PRO 97.A O no hydrogen 2.854 N/A SER 102.A N PHE 98.A O no hydrogen 2.970 N/A SER 102.A OG VAL 99.A O no hydrogen 2.930 N/A LEU 103.A N VAL 99.A O no hydrogen 2.983 N/A GLU 104.A N GLN 100.A O no hydrogen 2.842 N/A ARG 105.A N TRP 101.A O no hydrogen 3.281 N/A ARG 105.A N SER 102.A O no hydrogen 3.220 N/A GLY 106.A N LEU 103.A O no hydrogen 2.876 N/A LEU 107.A N SER 102.A O no hydrogen 3.039 N/A ALA 108.A N THR 186.A O no hydrogen 2.829 N/A GLY 109.A N GLU 111.A OE1 no hydrogen 2.770 N/A GLU 111.A N GLU 111.A OE1 no hydrogen 2.719 N/A ASN 112.A ND2 TYR 131.A O no hydrogen 2.723 N/A ASN 112.A ND2 HIS 192.A O no hydrogen 3.096 N/A LEU 113.A N LEU 110.A O no hydrogen 2.735 N/A SER 114.A N GLU 111.A O no hydrogen 3.121 N/A SER 114.A OG GLU 111.A O no hydrogen 2.772 N/A SER 114.A OG SER 216.A OG no hydrogen 2.707 N/A LEU 115.A N ASP 96.A OD1 no hydrogen 2.755 N/A VAL 120.A N GLU 93.A O no hydrogen 2.833 N/A GLY 121.A N ALA 91.A O no hydrogen 2.871 N/A ALA 122.A N THR 119.A OG1 no hydrogen 3.308 N/A ALA 123.A N VAL 120.A O no hydrogen 3.173 N/A MET 125.A N ALA 122.A O no hydrogen 2.864 N/A GLN 126.A NE2 GLU 334.A OE2 no hydrogen 2.836 N/A ASN 127.A N PRO 124.A O no hydrogen 3.284 N/A ASN 127.A ND2 GLY 163.A O no hydrogen 2.940 N/A ILE 128.A N ALA 123.A O no hydrogen 3.028 N/A ALA 130.A N VAL 133.A O no hydrogen 3.006 N/A VAL 133.A N ALA 130.A O no hydrogen 3.198 N/A GLU 134.A N ASP 137.A OD2 no hydrogen 2.969 N/A LEU 135.A N ILE 128.A O no hydrogen 2.859 N/A LYS 136.A N ASN 127.A OD1 no hydrogen 2.908 N/A LYS 136.A NZ GLU 134.A OE1 no hydrogen 3.333 N/A ASP 137.A N GLU 134.A O no hydrogen 2.867 N/A VAL 138.A N LEU 135.A O no hydrogen 3.019 N/A PHE 139.A N LYS 136.A O no hydrogen 3.283 N/A ASP 140.A N ARG 182.A O no hydrogen 2.992 N/A SER 141.A N ARG 182.A O no hydrogen 3.179 N/A SER 141.A OG ASP 140.A OD2 no hydrogen 2.801 N/A LEU 142.A N PHE 155.A O no hydrogen 2.828 N/A THR 143.A N ARG 180.A O no hydrogen 3.063 N/A ALA 144.A N ARG 153.A O no hydrogen 2.919 N/A LEU 145.A N LEU 177.A O no hydrogen 2.730 N/A ASP 146.A N THR 151.A O no hydrogen 2.688 N/A ARG 147.A N ARG 175.A O no hydrogen 2.861 N/A ARG 147.A NH2 LEU 48.A O no hydrogen 3.418 N/A GLN 148.A N ASP 146.A OD1 no hydrogen 2.990 N/A ASP 149.A N ASP 146.A O no hydrogen 3.286 N/A GLY 150.A N ASP 146.A O no hydrogen 2.704 N/A ARG 153.A N ALA 144.A O no hydrogen 2.863 N/A PHE 155.A N LEU 142.A O no hydrogen 2.723 N/A ALA 159.A N ASP 156.A OD1 no hydrogen 2.950 N/A CYS 160.A N ASP 156.A O no hydrogen 3.306 N/A CYS 160.A N ARG 157.A O no hydrogen 3.185 N/A CYS 160.A SG ASP 156.A O no hydrogen 3.547 N/A ARG 161.A N GLN 158.A O no hydrogen 3.045 N/A GLY 163.A N ASP 166.A O no hydrogen 2.983 N/A ARG 165.A NE GLU 334.A OE1 no hydrogen 3.350 N/A ASP 166.A N GLY 163.A O no hydrogen 3.361 N/A SER 167.A OG PRO 124.A O no hydrogen 3.433 N/A SER 167.A OG MET 125.A O no hydrogen 2.716 N/A LEU 168.A N CYS 160.A O no hydrogen 2.735 N/A PHE 169.A N SER 167.A OG no hydrogen 3.097 N/A LYS 170.A N SER 167.A OG no hydrogen 3.141 N/A LYS 170.A NZ GLU 334.A O no hydrogen 3.495 N/A GLN 171.A N SER 167.A O no hydrogen 3.130 N/A GLU 172.A N LEU 168.A O no hydrogen 2.795 N/A ARG 175.A NE ASP 146.A OD1 no hydrogen 2.553 N/A ARG 175.A NH2 ASP 146.A OD1 no hydrogen 3.283 N/A ARG 175.A NH2 ASP 146.A OD2 no hydrogen 2.800 N/A TRP 176.A NE1 GLU 172.A OE1 no hydrogen 3.217 N/A LEU 177.A N LEU 145.A O no hydrogen 3.040 N/A LEU 179.A N THR 143.A O no hydrogen 2.934 N/A ARG 180.A N THR 143.A O no hydrogen 3.494 N/A ARG 180.A NE GLU 90.A OE2 no hydrogen 2.834 N/A ARG 180.A NH1 GLU 90.A OE1 no hydrogen 3.526 N/A VAL 181.A N ALA 89.A O no hydrogen 2.971 N/A ARG 182.A N SER 141.A O no hydrogen 2.707 N/A ARG 182.A NE SER 141.A OG no hydrogen 2.860 N/A ARG 182.A NH1 GLU 88.A OE2 no hydrogen 2.913 N/A ARG 182.A NH1 THR 143.A OG1 no hydrogen 3.417 N/A ARG 182.A NH2 SER 141.A OG no hydrogen 3.313 N/A ARG 182.A NH2 THR 143.A OG1 no hydrogen 3.254 N/A LEU 183.A N VAL 87.A O no hydrogen 2.839 N/A ARG 184.A N VAL 138.A O no hydrogen 2.803 N/A ARG 184.A NH2 SER 84.A OG no hydrogen 2.857 N/A LEU 185.A N VAL 85.A O no hydrogen 2.612 N/A THR 186.A N ALA 108.A O no hydrogen 3.131 N/A ARG 187.A N ASP 83.A O no hydrogen 2.873 N/A ARG 187.A NE ASP 80.A OD1 no hydrogen 3.317 N/A ARG 187.A NE ASP 80.A OD2 no hydrogen 3.412 N/A ARG 187.A NH1 ARG 105.A O no hydrogen 3.003 N/A ARG 187.A NH2 ASP 80.A OD2 no hydrogen 3.088 N/A VAL 198.A N TYR 195.A O no hydrogen 3.120 N/A ARG 199.A N TYR 195.A O no hydrogen 3.459 N/A ARG 199.A NH2 LEU 193.A O no hydrogen 2.792 N/A ARG 199.A NH2 ASP 194.A O no hydrogen 2.967 N/A GLN 200.A N GLY 196.A O no hydrogen 2.676 N/A ARG 201.A N PRO 197.A O no hydrogen 2.995 N/A ARG 201.A NH1 GLU 225.A OE2 no hydrogen 2.828 N/A ARG 201.A NH2 GLU 225.A OE1 no hydrogen 2.676 N/A LEU 202.A N VAL 198.A O no hydrogen 3.079 N/A GLU 203.A N ARG 199.A O no hydrogen 3.114 N/A GLU 204.A N GLN 200.A O no hydrogen 2.989 N/A GLU 205.A N ARG 201.A O no hydrogen 3.055 N/A GLY 206.A N GLU 203.A O no hydrogen 3.017 N/A ILE 207.A N LEU 202.A O no hydrogen 2.931 N/A THR 211.A N ASP 214.A OD2 no hydrogen 3.083 N/A THR 211.A OG1 ASP 214.A OD2 no hydrogen 3.212 N/A ASP 214.A N THR 211.A OG1 no hydrogen 3.297 N/A VAL 215.A N THR 211.A O no hydrogen 3.161 N/A SER 216.A N ALA 212.A O no hydrogen 2.986 N/A SER 216.A OG SER 114.A OG no hydrogen 2.707 N/A ARG 217.A N ARG 213.A O no hydrogen 2.993 N/A VAL 218.A N ASP 214.A O no hydrogen 2.997 N/A ILE 219.A N VAL 215.A O no hydrogen 2.804 N/A CYS 220.A N SER 216.A O no hydrogen 2.860 N/A CYS 220.A SG SER 216.A O no hydrogen 3.341 N/A ALA 221.A N ARG 217.A O no hydrogen 2.922 N/A ILE 222.A N VAL 218.A O no hydrogen 2.958 N/A ARG 223.A N ILE 219.A O no hydrogen 2.977 N/A ARG 224.A N CYS 220.A O no hydrogen 2.849 N/A GLU 225.A N ALA 221.A O no hydrogen 2.984 N/A LYS 226.A N ILE 222.A O no hydrogen 3.033 N/A LEU 227.A N ARG 223.A O no hydrogen 3.053 N/A ALA 231.A N ASP 229.A OD1 no hydrogen 2.934 N/A VAL 232.A N ASP 229.A O no hydrogen 2.935 N/A LEU 233.A N ASP 229.A O no hydrogen 3.105 N/A ASN 235.A N THR 15.A O no hydrogen 3.303 N/A ASN 235.A ND2 PRO 228.A O no hydrogen 3.216 N/A ASN 235.A ND2 LEU 233.A O no hydrogen 2.875 N/A GLY 237.A N ASN 235.A OD1 no hydrogen 2.763 N/A PHE 239.A N LEU 299.A O no hydrogen 2.820 N/A LYS 241.A N GLU 332.A O no hydrogen 2.836 N/A VAL 245.A N LEU 270.A O no hydrogen 2.804 N/A ALA 250.A N ASP 246.A O no hydrogen 2.753 N/A GLU 251.A N ALA 247.A O no hydrogen 2.762 N/A ARG 252.A N THR 248.A O no hydrogen 3.079 N/A LEU 253.A N GLN 249.A O no hydrogen 2.724 N/A ARG 254.A N ALA 250.A O no hydrogen 3.058 N/A GLN 255.A N GLU 251.A O no hydrogen 3.167 N/A ALA 256.A N ARG 252.A O no hydrogen 3.404 N/A PHE 257.A N LEU 253.A O no hydrogen 2.686 N/A LEU 260.A N PHE 257.A O no hydrogen 3.157 N/A TYR 263.A N LYS 271.A O no hydrogen 2.701 N/A GLN 265.A N ARG 269.A O no hydrogen 2.692 N/A GLN 265.A NE2 TYR 263.A O no hydrogen 3.204 N/A GLY 268.A N GLN 265.A O no hydrogen 2.542 N/A ARG 269.A N ASP 267.A OD1 no hydrogen 2.948 N/A LEU 270.A N VAL 245.A O no hydrogen 2.627 N/A LYS 271.A N TYR 263.A O no hydrogen 2.860 N/A LEU 272.A N PRO 243.A O no hydrogen 2.980 N/A ALA 273.A N VAL 261.A O no hydrogen 2.926 N/A ALA 274.A N ASN 242.A OD1 no hydrogen 2.947 N/A TRP 276.A N ALA 273.A O no hydrogen 3.008 N/A LEU 277.A N ALA 273.A O no hydrogen 3.304 N/A ILE 278.A N ALA 274.A O no hydrogen 3.000 N/A ASP 279.A N GLY 275.A O no hydrogen 2.935 N/A LYS 280.A N TRP 276.A O no hydrogen 2.926 N/A LYS 280.A NZ ASP 259.A OD2 no hydrogen 3.138 N/A GLY 281.A N LEU 277.A O no hydrogen 3.196 N/A GLY 282.A N ASP 279.A O no hydrogen 2.743 N/A TRP 283.A N ILE 278.A O no hydrogen 3.459 N/A TRP 283.A NE1 ASP 322.A OD2 no hydrogen 2.741 N/A GLY 285.A N HIS 294.A O no hydrogen 3.232 N/A PHE 286.A N TRP 283.A O no hydrogen 2.964 N/A ARG 287.A NE GLY 289.A O no hydrogen 2.693 N/A ARG 287.A NH2 GLY 289.A O no hydrogen 3.113 N/A ASP 288.A N VAL 291.A O no hydrogen 2.901 N/A VAL 291.A N ASP 288.A O no hydrogen 3.280 N/A GLY 292.A N VAL 302.A O no hydrogen 3.044 N/A VAL 293.A N PHE 286.A O no hydrogen 2.906 N/A HIS 294.A N VAL 300.A O no hydrogen 2.927 N/A GLN 297.A N HIS 294.A ND1 no hydrogen 3.229 N/A VAL 300.A N GLN 297.A O no hydrogen 2.937 N/A VAL 302.A N GLY 292.A O no hydrogen 2.748 N/A ASN 303.A N GLY 234.A O no hydrogen 2.853 N/A ASN 303.A ND2 PHE 16.A O no hydrogen 2.870 N/A HIS 304.A N PRO 290.A O no hydrogen 2.732 N/A GLY 305.A N ASN 303.A OD1 no hydrogen 2.970 N/A ALA 307.A N ASN 303.A OD1 no hydrogen 2.950 N/A THR 308.A N GLN 311.A OE1 no hydrogen 2.955 N/A THR 308.A OG1 GLN 311.A OE1 no hydrogen 3.241 N/A GLN 311.A N THR 308.A OG1 no hydrogen 3.120 N/A VAL 312.A N THR 308.A O no hydrogen 3.387 N/A ARG 313.A N GLY 309.A O no hydrogen 2.895 N/A ALA 314.A N ALA 310.A O no hydrogen 2.841 N/A LEU 315.A N GLN 311.A O no hydrogen 3.025 N/A ALA 316.A N VAL 312.A O no hydrogen 2.981 N/A GLU 317.A N ARG 313.A O no hydrogen 2.883 N/A ARG 318.A N ALA 314.A O no hydrogen 3.060 N/A ILE 319.A N LEU 315.A O no hydrogen 3.136 N/A GLN 320.A N ALA 316.A O no hydrogen 2.889 N/A GLN 320.A NE2 LEU 331.A O no hydrogen 2.861 N/A GLU 321.A N GLU 317.A O no hydrogen 3.046 N/A ASP 322.A N ARG 318.A O no hydrogen 3.083 N/A VAL 323.A N ILE 319.A O no hydrogen 3.034 N/A ARG 324.A N GLN 320.A O no hydrogen 2.964 N/A ARG 325.A N GLU 321.A O no hydrogen 2.919 N/A ARG 326.A N ASP 322.A O no hydrogen 2.884 N/A ARG 326.A NH2 ASP 322.A OD1 no hydrogen 2.788 N/A PHE 327.A N VAL 323.A O no hydrogen 2.821 N/A GLY 328.A N ARG 324.A O no hydrogen 2.779 N/A GLU 334.A N PHE 239.A O no hydrogen 2.844 N/A ASN 336.A N ASN 56.A O no hydrogen 2.821 N/A TYR 338.A N LEU 58.A O no hydrogen 3.015 N/A