Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5vai_R.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 3.A OG SER 5.A OG no hydrogen 2.789 N/A SER 5.A OG SER 3.A OG no hydrogen 2.789 N/A THR 7.A N SER 3.A O no hydrogen 3.295 N/A THR 7.A OG1 SER 3.A O no hydrogen 2.669 N/A VAL 8.A N LEU 4.A O no hydrogen 2.873 N/A GLN 9.A N SER 5.A O no hydrogen 2.931 N/A LYS 10.A N GLU 6.A O no hydrogen 2.818 N/A TRP 11.A N THR 7.A O no hydrogen 2.924 N/A TRP 11.A NE1 ASP 40.A O no hydrogen 2.499 N/A ARG 12.A N VAL 8.A O no hydrogen 2.852 N/A ARG 12.A NH2 GLN 179.A OE1 no hydrogen 2.526 N/A GLU 13.A N GLN 9.A O no hydrogen 2.956 N/A TYR 14.A N LYS 10.A O no hydrogen 2.853 N/A ARG 15.A N TRP 11.A O no hydrogen 2.855 N/A ARG 16.A N ARG 12.A O no hydrogen 2.849 N/A ARG 16.A NE GLU 13.A OE1 no hydrogen 3.171 N/A ARG 16.A NE GLU 13.A OE2 no hydrogen 2.852 N/A ARG 16.A NH2 GLU 13.A OE2 no hydrogen 2.371 N/A GLN 17.A N GLU 13.A O no hydrogen 2.851 N/A CYS 18.A N TYR 14.A O no hydrogen 2.934 N/A GLN 19.A N ARG 15.A O no hydrogen 2.838 N/A HIS 20.A N ARG 16.A O no hydrogen 3.000 N/A PHE 21.A N GLN 17.A O no hydrogen 2.998 N/A LEU 22.A N CYS 18.A O no hydrogen 2.796 N/A THR 23.A N GLN 19.A O no hydrogen 3.002 N/A THR 23.A OG1 GLN 19.A O no hydrogen 3.108 N/A GLU 24.A N HIS 20.A O no hydrogen 2.806 N/A ALA 25.A N PHE 21.A O no hydrogen 2.550 N/A CYS 34.A N GLY 47.A O no hydrogen 2.573 N/A THR 37.A N TRP 44.A O no hydrogen 2.714 N/A ASP 39.A N ALA 42.A O no hydrogen 2.924 N/A TRP 44.A N THR 37.A O no hydrogen 2.410 N/A GLY 47.A N CYS 34.A O no hydrogen 2.931 N/A SER 51.A N CYS 76.A O no hydrogen 2.887 N/A VAL 53.A N ARG 74.A O no hydrogen 2.889 N/A VAL 55.A N VAL 72.A O no hydrogen 2.911 N/A CYS 57.A N GLY 70.A O no hydrogen 3.393 N/A CYS 57.A SG GLU 97.A O no hydrogen 3.737 N/A LEU 61.A N PRO 58.A O no hydrogen 3.363 N/A ALA 64.A N LEU 61.A O no hydrogen 2.823 N/A ASN 66.A N TRP 63.A O no hydrogen 2.575 N/A VAL 67.A N TRP 63.A O no hydrogen 2.946 N/A VAL 67.A N ALA 64.A O no hydrogen 2.921 N/A GLY 70.A N VAL 67.A O no hydrogen 3.300 N/A VAL 72.A N VAL 55.A O no hydrogen 2.876 N/A TYR 73.A N ASP 94.A O no hydrogen 3.276 N/A ARG 74.A N VAL 53.A O no hydrogen 2.875 N/A CYS 76.A N SER 51.A O no hydrogen 2.961 N/A CYS 76.A SG GLY 47.A O no hydrogen 3.660 N/A CYS 76.A SG ALA 48.A O no hydrogen 3.034 N/A CYS 76.A SG THR 77.A O no hydrogen 3.719 N/A THR 77.A N HIS 81.A O no hydrogen 2.623 N/A GLY 80.A N THR 77.A O no hydrogen 3.068 N/A LEU 83.A N PHE 75.A O no hydrogen 2.336 N/A SER 88.A N LYS 85.A O no hydrogen 3.104 N/A TRP 92.A N LEU 83.A O no hydrogen 3.042 N/A ASP 94.A N TYR 73.A O no hydrogen 3.389 N/A CYS 98.A N LEU 95.A O no hydrogen 2.918 N/A GLU 99.A N SER 96.A O no hydrogen 3.242 N/A SER 101.A OG SER 102.A OG no hydrogen 2.886 N/A SER 102.A OG SER 101.A OG no hydrogen 2.886 N/A GLU 105.A N SER 102.A O no hydrogen 3.153 N/A ARG 106.A N PRO 103.A O no hydrogen 2.949 N/A LEU 108.A N GLU 104.A O no hydrogen 2.350 N/A SER 109.A N GLU 105.A O no hydrogen 2.132 N/A TYR 114.A N LEU 110.A O no hydrogen 2.516 N/A THR 115.A N TYR 111.A O no hydrogen 2.354 N/A THR 115.A OG1 TYR 111.A O no hydrogen 2.756 N/A VAL 116.A N ILE 112.A O no hydrogen 2.962 N/A VAL 116.A N ILE 113.A O no hydrogen 2.909 N/A GLY 117.A N TYR 114.A O no hydrogen 2.907 N/A ALA 119.A N THR 115.A O no hydrogen 3.036 N/A ALA 119.A N VAL 116.A O no hydrogen 2.932 N/A LEU 120.A N GLY 117.A O no hydrogen 2.931 N/A SER 121.A N TYR 118.A O no hydrogen 2.913 N/A PHE 122.A N ALA 119.A O no hydrogen 2.926 N/A SER 123.A OG LEU 120.A O no hydrogen 3.547 N/A ALA 124.A N LEU 120.A O no hydrogen 3.278 N/A LEU 125.A N SER 121.A O no hydrogen 2.847 N/A VAL 126.A N PHE 122.A O no hydrogen 2.763 N/A ILE 127.A N SER 123.A O no hydrogen 2.975 N/A ALA 128.A N ALA 124.A O no hydrogen 2.594 N/A SER 129.A N LEU 125.A O no hydrogen 2.810 N/A SER 129.A OG LEU 125.A O no hydrogen 3.291 N/A ALA 130.A N VAL 126.A O no hydrogen 2.851 N/A ILE 131.A N ILE 127.A O no hydrogen 2.743 N/A LEU 132.A N ALA 128.A O no hydrogen 2.851 N/A LEU 133.A N SER 129.A O no hydrogen 2.791 N/A GLY 134.A N ILE 131.A O no hydrogen 2.916 N/A CYS 140.A SG LEU 138.A O no hydrogen 3.822 N/A CYS 140.A SG HIS 139.A O no hydrogen 2.924 N/A THR 141.A OG1 TYR 216.A OH no hydrogen 2.113 N/A ASN 143.A ND2 LEU 138.A O no hydrogen 2.627 N/A TYR 144.A N CYS 140.A O no hydrogen 2.828 N/A ILE 145.A N THR 141.A O no hydrogen 2.972 N/A HIS 146.A N ARG 142.A O no hydrogen 2.999 N/A HIS 146.A ND1 GLU 213.A OE2 no hydrogen 2.830 N/A LEU 147.A N ASN 143.A O no hydrogen 2.904 N/A ASN 148.A N TYR 144.A O no hydrogen 2.989 N/A LEU 149.A N ILE 145.A O no hydrogen 2.943 N/A PHE 150.A N HIS 146.A O no hydrogen 2.869 N/A ALA 151.A N LEU 147.A O no hydrogen 2.856 N/A SER 152.A N ASN 148.A O no hydrogen 2.950 N/A SER 152.A OG LEU 149.A O no hydrogen 2.330 N/A PHE 153.A N LEU 149.A O no hydrogen 2.913 N/A ILE 154.A N PHE 150.A O no hydrogen 2.834 N/A LEU 155.A N ALA 151.A O no hydrogen 2.775 N/A ARG 156.A N SER 152.A O no hydrogen 2.952 N/A ARG 156.A NH1 ASN 206.A OD1 no hydrogen 2.769 N/A ALA 157.A N PHE 153.A O no hydrogen 2.853 N/A LEU 158.A N ILE 154.A O no hydrogen 2.803 N/A SER 159.A N LEU 155.A O no hydrogen 2.846 N/A VAL 160.A N ARG 156.A O no hydrogen 2.826 N/A PHE 161.A N ALA 157.A O no hydrogen 2.885 N/A ILE 162.A N LEU 158.A O no hydrogen 2.816 N/A LYS 163.A N SER 159.A O no hydrogen 2.754 N/A ASP 164.A N VAL 160.A O no hydrogen 2.824 N/A ALA 165.A N PHE 161.A O no hydrogen 2.975 N/A ALA 166.A N ILE 162.A O no hydrogen 2.783 N/A LEU 167.A N LYS 163.A O no hydrogen 2.989 N/A LYS 168.A N ASP 164.A O no hydrogen 2.883 N/A TRP 169.A N ALA 165.A O no hydrogen 2.871 N/A TYR 171.A N LEU 167.A O no hydrogen 2.990 N/A SER 172.A N LYS 168.A O no hydrogen 2.755 N/A THR 173.A N TRP 169.A O no hydrogen 2.929 N/A THR 173.A OG1 GLN 177.A O no hydrogen 2.356 N/A ALA 174.A N MET 170.A O no hydrogen 2.987 N/A ALA 175.A N TYR 171.A O no hydrogen 2.914 N/A GLN 176.A N SER 172.A O no hydrogen 2.889 N/A GLN 177.A N THR 173.A O no hydrogen 2.351 N/A GLY 182.A N HIS 178.A O no hydrogen 3.451 N/A LEU 184.A N TRP 180.A O no hydrogen 2.253 N/A SER 185.A N ASP 181.A O no hydrogen 2.760 N/A TYR 186.A N GLY 182.A O no hydrogen 2.936 N/A GLN 187.A N LEU 183.A O no hydrogen 2.924 N/A ASP 188.A N LEU 184.A O no hydrogen 2.818 N/A SER 189.A OG TYR 255.A OH no hydrogen 2.436 N/A SER 189.A OG ASP 259.A OD2 no hydrogen 2.842 N/A LEU 190.A N GLN 187.A O no hydrogen 3.019 N/A GLY 191.A N GLN 187.A O no hydrogen 2.404 N/A CYS 192.A SG ASP 188.A O no hydrogen 2.971 N/A ARG 193.A N ASP 188.A O no hydrogen 2.670 N/A LEU 194.A N LEU 190.A O no hydrogen 3.154 N/A VAL 195.A N GLY 191.A O no hydrogen 2.981 N/A PHE 196.A N CYS 192.A O no hydrogen 2.839 N/A LEU 197.A N ARG 193.A O no hydrogen 2.938 N/A LEU 198.A N LEU 194.A O no hydrogen 2.912 N/A MET 199.A N VAL 195.A O no hydrogen 2.881 N/A GLN 200.A N PHE 196.A O no hydrogen 2.896 N/A TYR 201.A N LEU 197.A O no hydrogen 2.953 N/A TYR 201.A OH TRP 240.A O no hydrogen 3.153 N/A CYS 202.A N LEU 198.A O no hydrogen 2.768 N/A CYS 202.A SG LEU 155.A O no hydrogen 3.131 N/A CYS 202.A SG LEU 198.A O no hydrogen 3.106 N/A VAL 203.A N MET 199.A O no hydrogen 3.017 N/A ALA 204.A N GLN 200.A O no hydrogen 2.959 N/A ALA 205.A N TYR 201.A O no hydrogen 2.839 N/A ASN 206.A N CYS 202.A O no hydrogen 2.883 N/A TYR 207.A N VAL 203.A O no hydrogen 3.035 N/A TYR 208.A N ALA 204.A O no hydrogen 2.848 N/A TRP 209.A N ALA 205.A O no hydrogen 2.817 N/A LEU 210.A N ASN 206.A O no hydrogen 3.050 N/A LEU 211.A N TYR 207.A O no hydrogen 2.939 N/A VAL 212.A N TYR 208.A O no hydrogen 2.933 N/A GLU 213.A N TRP 209.A O no hydrogen 2.947 N/A GLY 214.A N LEU 210.A O no hydrogen 2.950 N/A ALA 215.A N LEU 211.A O no hydrogen 2.905 N/A TYR 216.A N VAL 212.A O no hydrogen 2.798 N/A TYR 216.A OH THR 141.A OG1 no hydrogen 2.113 N/A LEU 217.A N GLU 213.A O no hydrogen 2.944 N/A TYR 218.A N GLY 214.A O no hydrogen 2.886 N/A THR 219.A N ALA 215.A O no hydrogen 2.781 N/A THR 219.A OG1 ALA 215.A O no hydrogen 2.601 N/A LEU 220.A N TYR 216.A O no hydrogen 2.851 N/A LEU 221.A N LEU 217.A O no hydrogen 2.858 N/A ALA 222.A N TYR 218.A O no hydrogen 2.918 N/A PHE 223.A N THR 219.A O no hydrogen 3.357 N/A ILE 231.A N SER 227.A O no hydrogen 2.379 N/A PHE 232.A N GLU 228.A O no hydrogen 2.835 N/A LYS 233.A N GLN 229.A O no hydrogen 2.990 N/A LYS 233.A N ARG 230.A O no hydrogen 3.254 N/A TYR 235.A N ILE 231.A O no hydrogen 2.901 N/A LEU 236.A N PHE 232.A O no hydrogen 2.882 N/A SER 237.A N LYS 233.A O no hydrogen 2.880 N/A SER 237.A OG LYS 233.A O no hydrogen 2.855 N/A ILE 238.A N LEU 234.A O no hydrogen 2.829 N/A GLY 239.A N TYR 235.A O no hydrogen 2.947 N/A TRP 240.A N LEU 236.A O no hydrogen 2.943 N/A VAL 242.A N ILE 238.A O no hydrogen 2.952 N/A LEU 245.A N GLY 241.A O no hydrogen 2.941 N/A PHE 246.A N VAL 242.A O no hydrogen 2.806 N/A VAL 247.A N PRO 243.A O no hydrogen 2.798 N/A ILE 248.A N LEU 244.A O no hydrogen 2.884 N/A GLY 251.A N VAL 247.A O no hydrogen 2.624 N/A ILE 252.A N ILE 248.A O no hydrogen 2.898 N/A VAL 253.A N PRO 249.A O no hydrogen 2.906 N/A LYS 254.A N TRP 250.A O no hydrogen 2.857 N/A TYR 255.A N GLY 251.A O no hydrogen 2.905 N/A TYR 255.A OH SER 189.A OG no hydrogen 2.436 N/A TYR 255.A OH ASP 259.A OD2 no hydrogen 2.814 N/A LEU 256.A N ILE 252.A O no hydrogen 2.937 N/A TYR 257.A N VAL 253.A O no hydrogen 2.941 N/A GLU 258.A N LYS 254.A O no hydrogen 3.033 N/A GLY 261.A N ASP 259.A OD1 no hydrogen 3.015 N/A SER 267.A OG GLU 260.A OE1 no hydrogen 2.595 N/A SER 267.A OG GLU 260.A OE2 no hydrogen 2.733 N/A SER 267.A OG THR 264.A O no hydrogen 3.010 N/A ASN 268.A N ARG 265.A O no hydrogen 2.725 N/A ASN 268.A ND2 ARG 265.A O no hydrogen 3.260 N/A MET 269.A N ARG 265.A O no hydrogen 3.321 N/A ILE 275.A N TYR 271.A O no hydrogen 2.996 N/A ARG 276.A N TRP 272.A O no hydrogen 2.793 N/A LEU 277.A N LEU 273.A O no hydrogen 2.889 N/A ILE 279.A N ILE 275.A O no hydrogen 3.418 N/A LEU 280.A N ARG 276.A O no hydrogen 2.445 N/A PHE 281.A N LEU 277.A O no hydrogen 2.771 N/A ALA 282.A N PRO 278.A O no hydrogen 2.825 N/A ILE 283.A N ILE 279.A O no hydrogen 3.046 N/A GLY 284.A N LEU 280.A O no hydrogen 2.793 N/A VAL 285.A N PHE 281.A O no hydrogen 2.878 N/A ASN 286.A N ALA 282.A O no hydrogen 2.966 N/A PHE 287.A N ILE 283.A O no hydrogen 2.852 N/A LEU 288.A N GLY 284.A O no hydrogen 2.951 N/A ILE 289.A N VAL 285.A O no hydrogen 2.852 N/A PHE 290.A N ASN 286.A O no hydrogen 2.799 N/A ILE 291.A N PHE 287.A O no hydrogen 2.959 N/A ARG 292.A N LEU 288.A O no hydrogen 2.937 N/A VAL 293.A N ILE 289.A O no hydrogen 2.749 N/A ILE 294.A N PHE 290.A O no hydrogen 3.001 N/A CYS 295.A N ILE 291.A O no hydrogen 2.945 N/A CYS 295.A SG ILE 291.A O no hydrogen 2.873 N/A ILE 296.A N ARG 292.A O no hydrogen 2.891 N/A VAL 297.A N VAL 293.A O no hydrogen 2.844 N/A VAL 298.A N ILE 294.A O no hydrogen 2.856 N/A SER 299.A N CYS 295.A O no hydrogen 2.918 N/A SER 299.A OG CYS 295.A O no hydrogen 2.395 N/A LYS 300.A N ILE 296.A O no hydrogen 2.871 N/A LEU 301.A N VAL 297.A O no hydrogen 2.855 N/A LYS 302.A N VAL 298.A O no hydrogen 2.894 N/A ALA 303.A N SER 299.A O no hydrogen 3.431 N/A CYS 307.A SG ALA 303.A O no hydrogen 3.133 N/A CYS 307.A SG ASN 304.A OD1 no hydrogen 3.639 N/A LYS 308.A N LEU 305.A O no hydrogen 3.031 N/A THR 309.A N MET 306.A O no hydrogen 2.396 N/A ALA 316.A N LYS 312.A O no hydrogen 2.780 N/A LYS 317.A N CYS 313.A O no hydrogen 2.923 N/A SER 318.A N ARG 314.A O no hydrogen 2.970 N/A THR 319.A N LEU 315.A O no hydrogen 2.804 N/A THR 319.A OG1 LEU 315.A O no hydrogen 3.180 N/A LEU 320.A N ALA 316.A O no hydrogen 2.797 N/A THR 321.A N LYS 317.A O no hydrogen 3.063 N/A THR 321.A N SER 318.A O no hydrogen 3.091 N/A THR 321.A OG1 LYS 317.A O no hydrogen 3.564 N/A THR 321.A OG1 SER 318.A O no hydrogen 3.140 N/A LEU 322.A N THR 319.A O no hydrogen 2.889 N/A ILE 323.A N LEU 320.A O no hydrogen 2.780 N/A LEU 325.A N LEU 322.A O no hydrogen 2.947 N/A GLY 327.A N ILE 323.A O no hydrogen 2.861 N/A THR 328.A OG1 ASN 286.A O no hydrogen 3.099 N/A HIS 329.A N GLY 327.A O no hydrogen 2.598 N/A GLU 330.A N GLY 327.A O no hydrogen 3.408 N/A ILE 332.A N HIS 329.A O no hydrogen 3.292 N/A PHE 333.A N GLU 330.A O no hydrogen 2.333 N/A ALA 334.A N VAL 331.A O no hydrogen 2.647 N/A PHE 347.A N GLY 343.A O no hydrogen 2.531 N/A VAL 348.A N LEU 345.A O no hydrogen 3.173 N/A LEU 350.A N ARG 346.A O no hydrogen 2.481 N/A PHE 351.A N PHE 347.A O no hydrogen 2.942 N/A THR 352.A N VAL 348.A O no hydrogen 2.899 N/A THR 352.A OG1 VAL 348.A O no hydrogen 2.892 N/A GLU 353.A N LYS 349.A O no hydrogen 2.837 N/A LEU 354.A N LEU 350.A O no hydrogen 2.940 N/A SER 355.A N PHE 351.A O no hydrogen 2.961 N/A SER 355.A OG THR 352.A O no hydrogen 2.259 N/A PHE 356.A N THR 352.A O no hydrogen 2.951 N/A THR 357.A N GLU 353.A O no hydrogen 2.877 N/A THR 357.A OG1 GLU 330.A OE2 no hydrogen 2.541 N/A THR 357.A OG1 GLN 360.A OE1 no hydrogen 3.407 N/A SER 358.A N LEU 354.A O no hydrogen 2.965 N/A SER 358.A OG TYR 111.A OH no hydrogen 3.336 N/A SER 358.A OG LEU 354.A O no hydrogen 3.093 N/A PHE 359.A N SER 355.A O no hydrogen 2.959 N/A GLN 360.A N THR 357.A O no hydrogen 3.180 N/A GLN 360.A NE2 PRO 324.A O no hydrogen 2.581 N/A MET 363.A N PHE 359.A O no hydrogen 3.025 N/A VAL 364.A N GLN 360.A O no hydrogen 2.877 N/A ALA 365.A N GLY 361.A O no hydrogen 2.952 N/A ILE 366.A N LEU 362.A O no hydrogen 3.048 N/A LEU 367.A N MET 363.A O no hydrogen 2.803 N/A TYR 368.A N VAL 364.A O no hydrogen 3.044 N/A TYR 368.A OH HIS 146.A ND1 no hydrogen 2.692 N/A CYS 369.A N ALA 365.A O no hydrogen 3.097 N/A PHE 370.A N ALA 365.A O no hydrogen 2.718 N/A VAL 371.A N ILE 366.A O no hydrogen 3.204 N/A GLN 376.A N ASN 372.A O no hydrogen 2.557 N/A MET 377.A N ASN 373.A O no hydrogen 2.856 N/A GLU 378.A N GLU 374.A O no hydrogen 2.840 N/A PHE 379.A N VAL 375.A O no hydrogen 2.767 N/A ARG 380.A N GLN 376.A O no hydrogen 2.871 N/A LYS 381.A N MET 377.A O no hydrogen 2.897 N/A SER 382.A N GLU 378.A O no hydrogen 2.756 N/A TRP 383.A N PHE 379.A O no hydrogen 2.789 N/A GLU 384.A N ARG 380.A O no hydrogen 2.976 N/A ARG 385.A N LYS 381.A O no hydrogen 2.888 N/A TRP 386.A N SER 382.A O no hydrogen 2.832 N/A ARG 387.A N GLU 384.A O no hydrogen 2.872 N/A