Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3reo_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 5.A N SER 1.A O no hydrogen 3.118 N/A ASN 6.A N ASP 2.A O no hydrogen 3.008 N/A LEU 7.A N GLU 3.A O no hydrogen 2.883 N/A PHE 8.A N GLU 4.A O no hydrogen 2.943 N/A ALA 9.A N ALA 5.A O no hydrogen 3.013 N/A MET 10.A N ASN 6.A O no hydrogen 3.102 N/A GLN 11.A N LEU 7.A O no hydrogen 2.909 N/A GLN 11.A NE2 TYR 74.A OH no hydrogen 2.925 N/A LEU 12.A N PHE 8.A O no hydrogen 2.870 N/A ALA 13.A N ALA 9.A O no hydrogen 3.011 N/A SER 14.A N MET 10.A O no hydrogen 3.441 N/A SER 14.A OG MET 10.A O no hydrogen 3.227 N/A ALA 15.A N LEU 12.A O no hydrogen 3.094 N/A VAL 17.A N SER 14.A O no hydrogen 3.052 N/A LEU 18.A N ALA 15.A O no hydrogen 3.147 N/A MET 20.A N ALA 16.A O no hydrogen 3.062 N/A ALA 21.A N VAL 17.A O no hydrogen 2.839 N/A LEU 22.A N LEU 18.A O no hydrogen 2.887 N/A LYS 23.A N PRO 19.A O no hydrogen 2.852 N/A ALA 24.A N MET 20.A O no hydrogen 3.212 N/A ALA 25.A N ALA 21.A O no hydrogen 3.077 N/A ILE 26.A N LEU 22.A O no hydrogen 2.928 N/A GLU 27.A N LYS 23.A O no hydrogen 2.737 N/A LEU 28.A N ALA 24.A O no hydrogen 2.797 N/A ASP 29.A N ILE 26.A O no hydrogen 2.851 N/A VAL 30.A N ALA 25.A O no hydrogen 2.797 N/A ILE 33.A N ASP 29.A O no hydrogen 2.867 N/A MET 34.A N VAL 30.A O no hydrogen 2.906 N/A ALA 35.A N LEU 31.A O no hydrogen 2.880 N/A LYS 36.A N GLU 32.A O no hydrogen 3.050 N/A SER 37.A N MET 34.A O no hydrogen 3.134 N/A SER 37.A OG ILE 33.A O no hydrogen 2.733 N/A SER 37.A OG GLN 52.A OE1 no hydrogen 3.343 N/A VAL 38.A N MET 34.A O no hydrogen 2.854 N/A ILE 44.A N TYR 93.A O no hydrogen 2.781 N/A SER 45.A N GLU 48.A OE1 no hydrogen 2.774 N/A GLU 48.A N SER 45.A OG no hydrogen 2.915 N/A ILE 49.A N SER 45.A O no hydrogen 3.020 N/A ALA 50.A N PRO 46.A O no hydrogen 2.763 N/A ALA 51.A N ALA 47.A O no hydrogen 3.031 N/A GLN 52.A N ILE 49.A O no hydrogen 2.855 N/A GLN 52.A NE2 SER 37.A OG no hydrogen 2.997 N/A LEU 53.A N ALA 50.A O no hydrogen 2.853 N/A THR 55.A N LEU 53.A O no hydrogen 2.819 N/A ASN 57.A N THR 55.A OG1 no hydrogen 2.796 N/A GLU 59.A N ASN 57.A OD1 no hydrogen 3.070 N/A ALA 60.A N ASN 57.A O no hydrogen 2.961 N/A MET 63.A N GLU 59.A O no hydrogen 3.016 N/A LEU 64.A N ALA 60.A O no hydrogen 2.802 N/A ASP 65.A N PRO 61.A O no hydrogen 2.770 N/A ARG 66.A N VAL 62.A O no hydrogen 3.063 N/A VAL 67.A N MET 63.A O no hydrogen 3.097 N/A LEU 68.A N LEU 64.A O no hydrogen 2.774 N/A ARG 69.A N ASP 65.A O no hydrogen 2.764 N/A LEU 70.A N ARG 66.A O no hydrogen 3.470 N/A LEU 71.A N VAL 67.A O no hydrogen 3.065 N/A ALA 72.A N LEU 68.A O no hydrogen 2.823 N/A SER 73.A N ARG 69.A O no hydrogen 3.009 N/A SER 73.A OG LEU 70.A O no hydrogen 2.824 N/A TYR 74.A N LEU 70.A O no hydrogen 3.345 N/A TYR 74.A N LEU 71.A O no hydrogen 3.146 N/A SER 75.A N ALA 72.A O no hydrogen 2.965 N/A VAL 76.A N LEU 71.A O no hydrogen 2.874 N/A THR 78.A N GLY 94.A O no hydrogen 2.836 N/A THR 80.A N LEU 92.A O no hydrogen 2.999 N/A ARG 82.A N GLU 90.A O no hydrogen 2.891 N/A ARG 82.A NH1 GLU 90.A OE2 no hydrogen 2.893 N/A LEU 84.A N LYS 88.A O no hydrogen 2.762 N/A GLY 87.A N LEU 84.A O no hydrogen 3.074 N/A LYS 88.A N SER 86.A O no hydrogen 2.937 N/A GLU 90.A N ARG 82.A O no hydrogen 2.886 N/A ARG 91.A NE ASP 65.A OD1 no hydrogen 3.111 N/A ARG 91.A NH1 VAL 89.A O no hydrogen 3.462 N/A ARG 91.A NH2 ASP 65.A OD2 no hydrogen 2.818 N/A LEU 92.A N THR 80.A O no hydrogen 2.881 N/A TYR 93.A N ILE 44.A O no hydrogen 2.846 N/A TYR 93.A OH ASP 65.A OD1 no hydrogen 2.809 N/A GLY 94.A N THR 78.A O no hydrogen 2.954 N/A CYS 99.A N ALA 96.A O no hydrogen 2.918 N/A CYS 99.A SG VAL 76.A O no hydrogen 3.237 N/A LYS 100.A N PRO 97.A O no hydrogen 3.073 N/A PHE 101.A N VAL 98.A O no hydrogen 2.748 N/A LEU 102.A N CYS 99.A O no hydrogen 3.030 N/A THR 103.A OG1 CYS 99.A O no hydrogen 2.754 N/A LYS 104.A N GLU 32.A OE2 no hydrogen 2.899 N/A ASN 105.A N VAL 109.A O no hydrogen 2.883 N/A GLY 108.A N ASN 105.A O no hydrogen 2.901 N/A VAL 109.A N ASN 105.A OD1 no hydrogen 2.716 N/A LEU 111.A N PHE 101.A O no hydrogen 2.689 N/A ALA 112.A N SER 110.A OG no hydrogen 2.990 N/A LEU 115.A N LEU 111.A O no hydrogen 3.071 N/A LEU 116.A N ALA 112.A O no hydrogen 2.878 N/A LEU 117.A N PRO 113.A O no hydrogen 3.015 N/A ALA 118.A N PHE 114.A O no hydrogen 2.978 N/A THR 119.A N LEU 115.A O no hydrogen 3.031 N/A THR 119.A OG1 LEU 115.A O no hydrogen 2.778 N/A ASP 120.A N LEU 117.A O no hydrogen 3.170 N/A VAL 122.A N ASP 120.A OD1 no hydrogen 2.991 N/A LEU 123.A N ASP 120.A O no hydrogen 2.786 N/A LEU 124.A N LYS 121.A O no hydrogen 3.088 N/A GLU 125.A N LYS 121.A O no hydrogen 3.415 N/A TRP 127.A N LEU 124.A O no hydrogen 3.144 N/A TRP 127.A NE1 TYR 310.A OH no hydrogen 2.978 N/A PHE 128.A N GLU 125.A O no hydrogen 3.072 N/A TYR 129.A N PRO 126.A O no hydrogen 2.767 N/A LEU 130.A N TRP 127.A O no hydrogen 3.413 N/A ALA 133.A N TYR 129.A O no hydrogen 2.893 N/A ILE 134.A N LEU 130.A O no hydrogen 2.884 N/A LEU 135.A N LYS 131.A O no hydrogen 3.065 N/A GLU 136.A N ASP 132.A O no hydrogen 2.848 N/A GLY 137.A N ALA 133.A O no hydrogen 2.879 N/A LYS 143.A N ILE 139.A O no hydrogen 3.088 N/A LYS 143.A NZ GLU 136.A OE1 no hydrogen 2.914 N/A LYS 143.A NZ GLY 137.A O no hydrogen 3.071 N/A ALA 144.A N PRO 140.A O no hydrogen 3.112 N/A ALA 144.A N PHE 141.A O no hydrogen 3.003 N/A TYR 145.A N PHE 141.A O no hydrogen 2.916 N/A TYR 145.A OH VAL 122.A O no hydrogen 2.689 N/A PHE 150.A N ASN 148.A OD1 no hydrogen 2.867 N/A ASP 151.A N ASN 148.A OD1 no hydrogen 2.959 N/A TYR 152.A N ASN 148.A O no hydrogen 2.879 N/A TYR 152.A OH ASP 156.A OD2 no hydrogen 2.847 N/A HIS 153.A N ILE 149.A O no hydrogen 2.966 N/A GLY 154.A N PHE 150.A O no hydrogen 3.194 N/A THR 155.A N TYR 152.A O no hydrogen 2.753 N/A THR 155.A OG1 TYR 152.A O no hydrogen 2.783 N/A ASP 156.A N TYR 152.A O no hydrogen 2.847 N/A ARG 158.A N ASP 156.A OD1 no hydrogen 3.140 N/A ARG 158.A NH1 ASP 120.A OD2 no hydrogen 2.940 N/A ARG 158.A NH2 ASP 120.A OD1 no hydrogen 2.891 N/A ARG 158.A NH2 ASP 120.A OD2 no hydrogen 3.542 N/A ILE 159.A N ASP 156.A OD1 no hydrogen 3.161 N/A ASN 160.A N ASP 156.A O no hydrogen 2.932 N/A ASN 160.A ND2 HIS 221.A O no hydrogen 3.186 N/A LYS 161.A N HIS 157.A O no hydrogen 3.053 N/A VAL 162.A N ARG 158.A O no hydrogen 3.016 N/A PHE 163.A N ILE 159.A O no hydrogen 2.798 N/A ASN 164.A N ASN 160.A O no hydrogen 2.859 N/A LYS 165.A N LYS 161.A O no hydrogen 2.939 N/A GLY 166.A N VAL 162.A O no hydrogen 2.890 N/A MET 167.A N PHE 163.A O no hydrogen 2.893 N/A SER 168.A N ASN 164.A O no hydrogen 2.903 N/A SER 169.A N LYS 165.A O no hydrogen 2.762 N/A SER 169.A OG LYS 165.A O no hydrogen 3.087 N/A ASN 170.A N GLY 166.A O no hydrogen 3.136 N/A SER 171.A N MET 167.A O no hydrogen 2.820 N/A SER 171.A OG MET 167.A O no hydrogen 2.929 N/A THR 172.A N SER 168.A O no hydrogen 2.868 N/A THR 172.A OG1 SER 168.A O no hydrogen 2.925 N/A ILE 173.A N SER 169.A O no hydrogen 3.133 N/A THR 174.A N ASN 170.A O no hydrogen 3.191 N/A THR 174.A OG1 ASN 170.A O no hydrogen 3.508 N/A MET 175.A N SER 171.A O no hydrogen 2.717 N/A LYS 176.A N THR 172.A O no hydrogen 2.953 N/A ILE 178.A N THR 174.A O no hydrogen 2.999 N/A LEU 179.A N MET 175.A O no hydrogen 2.775 N/A GLU 180.A N LYS 176.A O no hydrogen 3.356 N/A GLU 180.A N LYS 177.A O no hydrogen 3.100 N/A MET 181.A N ILE 178.A O no hydrogen 2.917 N/A TYR 182.A N ILE 178.A O no hydrogen 2.733 N/A TYR 182.A OH GLU 347.A OE2 no hydrogen 2.323 N/A LEU 188.A N PHE 185.A O no hydrogen 3.264 N/A THR 189.A N ASP 247.A OD2 no hydrogen 2.585 N/A THR 189.A OG1 ASP 247.A OD2 no hydrogen 2.628 N/A THR 190.A N ASP 247.A OD2 no hydrogen 2.837 N/A ILE 191.A N ASN 213.A O no hydrogen 3.079 N/A VAL 192.A N ALA 248.A O no hydrogen 2.859 N/A ASP 193.A N ILE 215.A O no hydrogen 2.802 N/A VAL 194.A N PHE 250.A O no hydrogen 3.004 N/A GLY 196.A N PHE 217.A O no hydrogen 3.057 N/A GLY 197.A N ASP 218.A OD2 no hydrogen 2.818 N/A GLY 199.A N GLY 196.A O no hydrogen 3.251 N/A SER 203.A N GLY 199.A O no hydrogen 2.833 N/A SER 203.A OG GLY 199.A O no hydrogen 3.383 N/A SER 203.A OG ALA 200.A O no hydrogen 2.810 N/A MET 204.A N ALA 200.A O no hydrogen 3.033 N/A ILE 205.A N VAL 201.A O no hydrogen 3.136 N/A VAL 206.A N ALA 202.A O no hydrogen 3.148 N/A ALA 207.A N SER 203.A O no hydrogen 2.890 N/A LYS 208.A N MET 204.A O no hydrogen 3.061 N/A LYS 208.A NZ LEU 179.A O no hydrogen 2.975 N/A TYR 209.A N ILE 205.A O no hydrogen 2.721 N/A ILE 212.A N TYR 209.A O no hydrogen 2.768 N/A ASN 213.A N THR 189.A O no hydrogen 2.925 N/A ALA 214.A N GLY 231.A O no hydrogen 2.979 N/A ILE 215.A N ILE 191.A O no hydrogen 2.892 N/A ASN 216.A N GLU 233.A O no hydrogen 2.770 N/A PHE 217.A N ASP 193.A O no hydrogen 2.795 N/A ASP 218.A N LEU 235.A O no hydrogen 3.153 N/A LEU 219.A N ASP 218.A OD1 no hydrogen 2.723 N/A VAL 222.A N LEU 219.A O no hydrogen 3.054 N/A ILE 223.A N LEU 219.A O no hydrogen 3.115 N/A GLN 224.A N PRO 220.A O no hydrogen 2.911 N/A GLN 224.A NE2 GLN 224.A O no hydrogen 3.486 N/A ASP 225.A N VAL 222.A O no hydrogen 2.910 N/A ALA 226.A N ILE 223.A O no hydrogen 2.939 N/A VAL 232.A N PHE 229.A O no hydrogen 3.180 N/A GLU 233.A N ALA 214.A O no hydrogen 2.765 N/A HIS 234.A ND1 ASN 216.A OD1 no hydrogen 2.864 N/A HIS 234.A NE2 PRO 227.A O no hydrogen 2.975 N/A LEU 235.A N ASN 216.A O no hydrogen 2.857 N/A GLY 237.A N ASP 218.A O no hydrogen 2.820 N/A PHE 240.A N ASP 238.A OD2 no hydrogen 2.984 N/A ASP 241.A N ASP 238.A O no hydrogen 2.955 N/A GLY 242.A N ASP 238.A O no hydrogen 3.364 N/A ASP 247.A N THR 190.A O no hydrogen 3.193 N/A ILE 249.A N LYS 279.A O no hydrogen 3.206 N/A PHE 250.A N VAL 192.A O no hydrogen 2.747 N/A ILE 251.A N ILE 281.A O no hydrogen 2.877 N/A LYS 252.A NZ SER 171.A OG no hydrogen 3.043 N/A TRP 253.A N ALA 283.A O no hydrogen 2.897 N/A HIS 256.A N GLU 284.A OE2 no hydrogen 3.156 N/A HIS 256.A ND1 GLU 316.A OE2 no hydrogen 2.526 N/A ASP 257.A N ILE 254.A O no hydrogen 2.870 N/A TRP 258.A N CYS 255.A O no hydrogen 3.110 N/A SER 259.A OG GLU 261.A OE1 no hydrogen 3.377 N/A HIS 262.A N SER 259.A OG no hydrogen 3.276 N/A CYS 263.A N SER 259.A O no hydrogen 2.853 N/A CYS 263.A SG CYS 255.A O no hydrogen 3.318 N/A CYS 263.A SG TRP 258.A O no hydrogen 3.741 N/A CYS 263.A SG SER 259.A O no hydrogen 3.492 N/A LEU 264.A N ASP 260.A O no hydrogen 2.870 N/A LYS 265.A N GLU 261.A O no hydrogen 3.172 N/A LEU 266.A N HIS 262.A O no hydrogen 2.886 N/A LEU 267.A N CYS 263.A O no hydrogen 2.817 N/A LYS 268.A N LEU 264.A O no hydrogen 2.880 N/A ASN 269.A N LYS 265.A O no hydrogen 3.036 N/A ASN 269.A ND2 MET 239.A O no hydrogen 2.887 N/A CYS 270.A N LEU 266.A O no hydrogen 2.910 N/A CYS 270.A SG LEU 266.A O no hydrogen 3.325 N/A TYR 271.A N LEU 267.A O no hydrogen 2.808 N/A ALA 272.A N LYS 268.A O no hydrogen 3.091 N/A ALA 273.A N ASN 269.A O no hydrogen 2.836 N/A ALA 273.A N CYS 270.A O no hydrogen 2.992 N/A LEU 274.A N TYR 271.A O no hydrogen 3.254 N/A GLY 278.A N PRO 275.A O no hydrogen 3.230 N/A LYS 279.A NZ GLY 184.A O no hydrogen 2.834 N/A LYS 279.A NZ GLU 347.A OE2 no hydrogen 3.007 N/A VAL 280.A N PHE 348.A O no hydrogen 2.885 N/A ILE 281.A N ILE 249.A O no hydrogen 2.780 N/A VAL 282.A N MET 346.A O no hydrogen 2.697 N/A ALA 283.A N ILE 251.A O no hydrogen 2.963 N/A GLU 284.A N TYR 344.A O no hydrogen 3.033 N/A LEU 287.A N ARG 317.A O no hydrogen 2.907 N/A ASP 292.A N SER 290.A O no hydrogen 2.863 N/A SER 294.A N ASP 292.A OD2 no hydrogen 2.946 N/A SER 294.A OG ASP 292.A OD2 no hydrogen 2.827 N/A SER 294.A OG THR 297.A OG1 no hydrogen 3.102 N/A THR 297.A N SER 294.A OG no hydrogen 3.172 N/A THR 297.A OG1 ASP 292.A OD1 no hydrogen 2.653 N/A THR 297.A OG1 ASP 292.A OD2 no hydrogen 3.113 N/A THR 297.A OG1 SER 294.A OG no hydrogen 3.102 N/A LYS 298.A N SER 294.A O no hydrogen 2.965 N/A LYS 298.A NZ PRO 293.A O no hydrogen 3.042 N/A VAL 299.A N ILE 295.A O no hydrogen 2.857 N/A VAL 300.A N ALA 296.A O no hydrogen 3.310 N/A ILE 301.A N THR 297.A O no hydrogen 2.909 N/A HIS 302.A N LYS 298.A O no hydrogen 2.718 N/A THR 303.A N VAL 299.A O no hydrogen 3.123 N/A THR 303.A OG1 VAL 299.A O no hydrogen 2.942 N/A ASP 304.A N VAL 300.A O no hydrogen 2.887 N/A ALA 305.A N ILE 301.A O no hydrogen 2.932 N/A LEU 306.A N HIS 302.A O no hydrogen 2.913 N/A MET 307.A N THR 303.A O no hydrogen 2.900 N/A LEU 308.A N ASP 304.A O no hydrogen 3.160 N/A ALA 309.A N ALA 305.A O no hydrogen 3.100 N/A TYR 310.A N MET 307.A O no hydrogen 3.299 N/A TYR 310.A OH LEU 123.A O no hydrogen 2.858 N/A ASN 311.A N MET 307.A O no hydrogen 2.893 N/A GLY 313.A N ASN 311.A O no hydrogen 2.351 N/A LYS 315.A NZ ASP 260.A OD1 no hydrogen 3.334 N/A LYS 315.A NZ ASP 260.A OD2 no hydrogen 3.261 N/A GLU 316.A N ASP 304.A OD1 no hydrogen 2.890 N/A ARG 317.A NE ASP 260.A OD1 no hydrogen 3.010 N/A ARG 317.A NH1 CYS 255.A O no hydrogen 2.876 N/A ARG 317.A NH2 TRP 258.A O no hydrogen 2.920 N/A ARG 317.A NH2 ASP 260.A OD1 no hydrogen 2.749 N/A THR 318.A N GLU 321.A OE1 no hydrogen 2.900 N/A GLU 321.A N THR 318.A OG1 no hydrogen 3.137 N/A PHE 322.A N THR 318.A O no hydrogen 3.092 N/A GLN 323.A N GLU 319.A O no hydrogen 2.921 N/A GLN 323.A NE2 GLU 319.A OE2 no hydrogen 2.773 N/A ALA 324.A N LYS 320.A O no hydrogen 2.975 N/A LEU 325.A N GLU 321.A O no hydrogen 3.039 N/A ALA 326.A N PHE 322.A O no hydrogen 2.918 N/A MET 327.A N GLN 323.A O no hydrogen 2.947 N/A ALA 328.A N ALA 324.A O no hydrogen 2.867 N/A SER 329.A N ALA 326.A O no hydrogen 3.022 N/A SER 329.A OG LEU 325.A O no hydrogen 2.841 N/A SER 329.A OG ALA 326.A O no hydrogen 3.014 N/A GLY 330.A N MET 327.A O no hydrogen 3.141 N/A PHE 331.A N ALA 326.A O no hydrogen 2.988 N/A ARG 332.A N LEU 349.A O no hydrogen 3.095 N/A GLY 333.A N LEU 349.A O no hydrogen 3.258 N/A LYS 335.A N GLU 347.A O no hydrogen 3.063 N/A ALA 337.A N VAL 345.A O no hydrogen 2.760 N/A CYS 339.A SG THR 343.A O no hydrogen 3.671 N/A ALA 340.A N THR 343.A O no hydrogen 2.913 N/A ASN 342.A ND2 ALA 296.A O no hydrogen 2.958 N/A THR 343.A N ALA 340.A O no hydrogen 2.849 N/A TYR 344.A N GLU 284.A O no hydrogen 2.836 N/A VAL 345.A N SER 338.A O no hydrogen 2.839 N/A MET 346.A N VAL 282.A O no hydrogen 2.762 N/A GLU 347.A N LYS 335.A O no hydrogen 2.893 N/A PHE 348.A N VAL 280.A O no hydrogen 2.739 N/A LEU 349.A N GLY 333.A O no hydrogen 2.813 N/A LYS 350.A N GLY 278.A O no hydrogen 3.116 N/A LYS 350.A NZ TYR 271.A O no hydrogen 2.755 N/A LYS 350.A NZ LEU 274.A O no hydrogen 3.144 N/A LYS 350.A NZ PRO 275.A O no hydrogen 3.286 N/A