Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3kv3_O.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 3.A N GLY 26.A O no hydrogen 2.777 N/A LYS 4.A N ASP 91.A OD2 no hydrogen 2.744 N/A VAL 5.A N GLU 28.A O no hydrogen 2.767 N/A ALA 6.A N VAL 92.A O no hydrogen 3.035 N/A ILE 7.A N ALA 31.A O no hydrogen 2.966 N/A ASN 8.A N LEU 94.A O no hydrogen 2.908 N/A ASN 8.A ND2 GLU 95.A OE1 no hydrogen 2.912 N/A GLY 9.A N ASN 33.A O no hydrogen 2.848 N/A PHE 10.A N ASP 34.A OD1 no hydrogen 2.712 N/A ARG 12.A NE GLU 317.A OE2 no hydrogen 2.620 N/A ARG 12.A NH1 ASP 48.A OD1 no hydrogen 2.681 N/A ARG 12.A NH2 ASP 48.A OD1 no hydrogen 2.800 N/A ARG 12.A NH2 GLU 317.A OE1 no hydrogen 2.886 N/A ARG 12.A NH2 GLU 317.A OE2 no hydrogen 3.476 N/A ARG 15.A N GLY 11.A O no hydrogen 2.916 N/A ARG 15.A NE LEU 44.A O no hydrogen 3.057 N/A ARG 15.A NH1 PHE 10.A O no hydrogen 2.673 N/A LEU 16.A N ARG 12.A O no hydrogen 3.225 N/A ALA 17.A N ILE 13.A O no hydrogen 2.838 N/A PHE 18.A N GLY 14.A O no hydrogen 3.051 N/A ARG 19.A N ARG 15.A O no hydrogen 3.016 N/A ARG 19.A NH1 GLN 51.A O no hydrogen 3.552 N/A ARG 19.A NH1 GLY 52.A O no hydrogen 2.867 N/A ARG 19.A NH2 LEU 45.A O no hydrogen 2.919 N/A ARG 19.A NH2 GLY 52.A O no hydrogen 2.980 N/A ARG 20.A N LEU 16.A O no hydrogen 2.857 N/A ILE 21.A N ALA 17.A O no hydrogen 2.948 N/A GLN 22.A N PHE 18.A O no hydrogen 3.295 N/A GLN 22.A N ARG 19.A O no hydrogen 3.182 N/A GLU 23.A N ARG 20.A O no hydrogen 2.917 N/A VAL 24.A N ILE 21.A O no hydrogen 3.006 N/A LEU 27.A N VAL 24.A O no hydrogen 3.486 N/A GLU 28.A N VAL 3.A O no hydrogen 2.874 N/A VAL 30.A N VAL 5.A O no hydrogen 2.889 N/A VAL 32.A N LYS 73.A O no hydrogen 2.923 N/A ASN 33.A N ILE 7.A O no hydrogen 2.882 N/A ASN 33.A ND2 ASN 8.A OD1 no hydrogen 2.773 N/A ASN 33.A ND2 GLU 77.A O no hydrogen 2.838 N/A ASP 34.A N PHE 75.A O no hydrogen 3.047 N/A LEU 35.A N ASP 34.A OD2 no hydrogen 2.621 N/A MET 40.A N ASP 37.A OD1 no hydrogen 2.897 N/A LEU 41.A N ASP 37.A O no hydrogen 3.133 N/A ALA 42.A N ASP 38.A O no hydrogen 2.844 N/A HIS 43.A N ASP 39.A O no hydrogen 3.124 N/A LEU 44.A N MET 40.A O no hydrogen 2.857 N/A LEU 45.A N LEU 41.A O no hydrogen 2.994 N/A LYS 46.A N ALA 42.A O no hydrogen 2.857 N/A TYR 47.A N HIS 43.A O no hydrogen 3.067 N/A GLN 51.A N ASP 48.A OD2 no hydrogen 2.766 N/A GLN 51.A NE2 ASP 315.A OD2 no hydrogen 2.826 N/A GLN 51.A NE2 GLU 317.A OE1 no hydrogen 3.174 N/A GLY 52.A N ASP 48.A O no hydrogen 2.958 N/A PHE 54.A N LYS 46.A O no hydrogen 2.865 N/A GLU 59.A N ARG 66.A O no hydrogen 3.069 N/A VAL 61.A N GLY 64.A O no hydrogen 3.082 N/A PHE 65.A N VAL 72.A O no hydrogen 3.163 N/A ARG 66.A N GLU 59.A O no hydrogen 2.797 N/A ARG 66.A NE GLU 59.A OE2 no hydrogen 3.071 N/A VAL 67.A N LYS 70.A O no hydrogen 2.793 N/A ASN 68.A N GLU 57.A O no hydrogen 3.050 N/A LYS 70.A N VAL 67.A O no hydrogen 2.978 N/A VAL 72.A N PHE 65.A O no hydrogen 2.901 N/A LYS 73.A N VAL 30.A O no hydrogen 2.956 N/A SER 74.A N GLY 63.A O no hydrogen 3.037 N/A SER 74.A OG ASP 38.A OD1 no hydrogen 2.334 N/A PHE 75.A N VAL 32.A O no hydrogen 2.945 N/A SER 76.A OG THR 36.A O no hydrogen 3.298 N/A GLU 77.A N ASN 33.A OD1 no hydrogen 2.885 N/A ASP 79.A N GLU 77.A OE2 no hydrogen 2.991 N/A ALA 80.A N TYR 100.A OH no hydrogen 2.947 N/A SER 81.A N ASP 79.A OD1 no hydrogen 3.204 N/A SER 81.A OG ASP 79.A OD1 no hydrogen 2.441 N/A LYS 82.A N ASP 79.A O no hydrogen 2.803 N/A LEU 83.A N ALA 80.A O no hydrogen 3.067 N/A TRP 85.A NE1 HIS 109.A ND1 no hydrogen 2.993 N/A LYS 86.A N ALA 112.A O no hydrogen 2.940 N/A LEU 88.A N PRO 84.A O no hydrogen 3.037 N/A LEU 88.A N TRP 85.A O no hydrogen 3.181 N/A ASN 89.A N LYS 86.A O no hydrogen 3.301 N/A ILE 90.A N TRP 85.A O no hydrogen 3.282 N/A ASP 91.A N LYS 4.A O no hydrogen 2.852 N/A VAL 92.A N LYS 4.A O no hydrogen 3.227 N/A VAL 93.A N LYS 116.A O no hydrogen 2.909 N/A LEU 94.A N ALA 6.A O no hydrogen 2.827 N/A GLU 95.A N LEU 118.A O no hydrogen 2.676 N/A CYS 96.A N ASN 8.A O no hydrogen 2.674 N/A CYS 96.A SG LEU 94.A O no hydrogen 3.429 N/A THR 97.A N GLU 95.A OE2 no hydrogen 2.947 N/A THR 97.A OG1 GLU 95.A OE2 no hydrogen 2.569 N/A PHE 99.A N THR 97.A OG1 no hydrogen 2.919 N/A TYR 100.A OH PRO 78.A O no hydrogen 3.091 N/A LYS 103.A N THR 124.A O no hydrogen 2.909 N/A LYS 103.A NZ ASP 126.A O no hydrogen 3.476 N/A LYS 105.A N ASP 102.A OD2 no hydrogen 3.015 N/A ALA 106.A N ASP 102.A O no hydrogen 2.961 N/A GLN 107.A N ASP 104.A O no hydrogen 3.258 N/A ALA 108.A N LYS 105.A O no hydrogen 3.033 N/A HIS 109.A N ALA 106.A O no hydrogen 3.053 N/A HIS 109.A NE2 GLU 95.A OE1 no hydrogen 2.861 N/A ILE 110.A N GLN 107.A O no hydrogen 3.095 N/A GLU 111.A N GLN 107.A O no hydrogen 3.138 N/A ALA 112.A N ALA 108.A O no hydrogen 3.021 N/A GLY 113.A N ILE 110.A O no hydrogen 2.913 N/A ALA 114.A N HIS 109.A O no hydrogen 2.955 N/A LYS 115.A N ILE 90.A O no hydrogen 3.191 N/A LYS 115.A NZ ASP 91.A OD1 no hydrogen 3.330 N/A LYS 116.A NZ GLY 141.A O no hydrogen 3.109 N/A VAL 117.A N THR 144.A O no hydrogen 2.699 N/A LEU 118.A N VAL 93.A O no hydrogen 2.705 N/A ILE 119.A N VAL 146.A O no hydrogen 2.821 N/A SER 120.A N GLU 95.A O no hydrogen 2.854 N/A SER 120.A OG GLU 95.A O no hydrogen 3.200 N/A THR 124.A N THR 101.A O no hydrogen 3.266 N/A THR 124.A OG1 ASP 102.A OD1 no hydrogen 2.581 N/A LEU 127.A N GLY 125.A O no hydrogen 3.038 N/A LYS 128.A NZ GLU 138.A O no hydrogen 2.966 N/A LYS 128.A NZ GLU 143.A OE2 no hydrogen 2.843 N/A ILE 130.A N SER 147.A O no hydrogen 2.980 N/A VAL 131.A N ASN 135.A OD1 no hydrogen 2.858 N/A ASN 133.A ND2 GLU 269.A OE2 no hydrogen 3.124 N/A ASN 133.A ND2 SER 270.A OG no hydrogen 2.798 N/A THR 134.A N VAL 131.A O no hydrogen 2.927 N/A ASN 135.A N VAL 131.A O no hydrogen 2.990 N/A ASN 135.A ND2 THR 129.A O no hydrogen 2.966 N/A ASN 135.A ND2 GLU 138.A OE1 no hydrogen 3.188 N/A GLU 138.A N ASN 135.A O no hydrogen 3.091 N/A LEU 139.A N HIS 136.A O no hydrogen 2.989 N/A ASP 140.A N GLU 143.A OE2 no hydrogen 2.766 N/A GLY 141.A N GLU 143.A OE1 no hydrogen 2.987 N/A SER 142.A N ASP 140.A OD1 no hydrogen 2.912 N/A SER 142.A OG ASP 140.A OD1 no hydrogen 2.825 N/A VAL 146.A N VAL 117.A O no hydrogen 3.065 N/A SER 147.A N LYS 128.A O no hydrogen 3.040 N/A SER 147.A OG ALA 121.A O no hydrogen 2.607 N/A GLY 148.A N ILE 119.A O no hydrogen 2.775 N/A ALA 149.A N SER 147.A OG no hydrogen 2.857 N/A SER 150.A OG THR 153.A OG1 no hydrogen 3.048 N/A THR 152.A OG1 TYR 314.A OH no hydrogen 2.806 N/A THR 153.A N SER 150.A OG no hydrogen 3.223 N/A THR 153.A OG1 SER 150.A OG no hydrogen 3.048 N/A ASN 154.A N SER 150.A O no hydrogen 3.031 N/A ASN 154.A ND2 GLY 148.A O no hydrogen 3.341 N/A ASN 154.A ND2 SER 150.A O no hydrogen 2.793 N/A SER 155.A N SER 151.A O no hydrogen 2.992 N/A SER 155.A OG THR 152.A O no hydrogen 2.635 N/A SER 155.A OG THR 243.A OG1 no hydrogen 2.908 N/A LEU 156.A N THR 152.A O no hydrogen 2.994 N/A LEU 156.A N THR 153.A O no hydrogen 3.155 N/A ALA 157.A N THR 153.A O no hydrogen 2.834 N/A VAL 159.A N LEU 156.A O no hydrogen 2.998 N/A ALA 160.A N LEU 156.A O no hydrogen 2.910 N/A LYS 161.A N ALA 157.A O no hydrogen 2.921 N/A VAL 162.A N PRO 158.A O no hydrogen 3.408 N/A LEU 163.A N VAL 159.A O no hydrogen 3.011 N/A ASN 164.A N ALA 160.A O no hydrogen 2.854 N/A ASP 165.A N LYS 161.A O no hydrogen 2.723 N/A ASP 166.A N VAL 162.A O no hydrogen 2.855 N/A PHE 167.A N LEU 163.A O no hydrogen 3.067 N/A GLY 168.A N ASN 164.A O no hydrogen 2.939 N/A LEU 169.A N ASN 164.A OD1 no hydrogen 2.978 N/A VAL 170.A N VAL 248.A O no hydrogen 3.048 N/A GLY 172.A N LYS 227.A O no hydrogen 2.894 N/A LEU 173.A N THR 246.A O no hydrogen 2.735 N/A MET 174.A N ASP 229.A O no hydrogen 2.856 N/A THR 175.A N GLU 244.A O no hydrogen 2.827 N/A THR 175.A OG1 MET 174.A O no hydrogen 3.112 N/A THR 176.A N GLY 231.A O no hydrogen 3.066 N/A THR 176.A OG1 LEU 242.A O no hydrogen 3.243 N/A THR 176.A OG1 TYR 314.A OH no hydrogen 2.600 N/A ILE 177.A N LEU 242.A O no hydrogen 2.761 N/A HIS 178.A N GLN 233.A O no hydrogen 2.872 N/A HIS 178.A ND1 ALA 179.A O no hydrogen 2.533 N/A ALA 179.A N SER 241.A OG no hydrogen 3.026 N/A TYR 180.A N VAL 237.A O no hydrogen 3.131 N/A THR 181.A N GLN 184.A OE1 no hydrogen 3.065 N/A THR 181.A OG1 ASP 183.A OD2 no hydrogen 2.690 N/A GLN 184.A N THR 181.A O no hydrogen 3.079 N/A ASN 185.A N ARG 198.A O no hydrogen 3.446 N/A ASN 185.A ND2 PRO 190.A O no hydrogen 3.440 N/A ASN 185.A ND2 ALA 199.A O no hydrogen 3.051 N/A ALA 189.A N ALA 199.A O no hydrogen 2.889 N/A HIS 191.A NE2 ASP 183.A O no hydrogen 2.805 N/A LYS 193.A N HIS 191.A ND1 no hydrogen 3.161 N/A GLY 194.A N HIS 191.A O no hydrogen 2.812 N/A ARG 197.A N ASP 195.A OD1 no hydrogen 2.761 N/A ARG 198.A N ASP 195.A OD1 no hydrogen 2.932 N/A ARG 198.A NE ASP 195.A OD2 no hydrogen 3.105 N/A ARG 198.A NH1 ASP 183.A OD1 no hydrogen 2.750 N/A ARG 200.A N ARG 197.A O no hydrogen 2.978 N/A ARG 200.A NE ASP 188.A OD1 no hydrogen 3.144 N/A ARG 200.A NE ASP 188.A OD2 no hydrogen 3.295 N/A ALA 201.A N ASP 188.A OD1 no hydrogen 2.831 N/A ALA 202.A N ASN 185.A O no hydrogen 2.935 N/A GLU 204.A N ALA 201.A O no hydrogen 3.464 N/A ILE 207.A N ARG 234.A O no hydrogen 2.899 N/A ASN 209.A N ALA 232.A O no hydrogen 2.796 N/A ALA 216.A N GLY 212.A O no hydrogen 2.538 N/A VAL 220.A N ILE 217.A O no hydrogen 2.939 N/A ILE 221.A N ILE 217.A O no hydrogen 2.756 N/A GLU 223.A N GLU 223.A OE1 no hydrogen 2.677 N/A ILE 224.A N ILE 221.A O no hydrogen 3.162 N/A ASP 225.A N PRO 222.A O no hydrogen 3.068 N/A LYS 227.A N ILE 224.A O no hydrogen 3.082 N/A LYS 227.A NZ LEU 169.A O no hydrogen 3.457 N/A ASP 229.A N GLY 172.A O no hydrogen 3.473 N/A GLY 230.A N ASP 229.A OD1 no hydrogen 2.759 N/A GLY 231.A N MET 174.A O no hydrogen 3.372 N/A ALA 232.A N ASN 209.A O no hydrogen 2.748 N/A GLN 233.A N THR 176.A O no hydrogen 2.920 N/A ARG 234.A N ILE 207.A O no hydrogen 2.802 N/A ARG 234.A NH1 THR 181.A OG1 no hydrogen 2.671 N/A ARG 234.A NH1 GLN 184.A OE1 no hydrogen 2.904 N/A VAL 235.A N HIS 178.A O no hydrogen 2.921 N/A VAL 237.A N VAL 235.A O no hydrogen 2.792 N/A THR 239.A OG1 ASP 315.A OD1 no hydrogen 2.677 N/A THR 239.A OG1 ASN 316.A OD1 no hydrogen 3.547 N/A SER 241.A N TYR 314.A O no hydrogen 2.857 N/A LEU 242.A N ILE 177.A O no hydrogen 2.892 N/A THR 243.A N ALA 312.A O no hydrogen 2.871 N/A THR 243.A OG1 SER 155.A OG no hydrogen 2.908 N/A GLU 244.A N THR 175.A O no hydrogen 2.725 N/A LEU 245.A N VAL 310.A O no hydrogen 2.969 N/A THR 246.A N LEU 173.A O no hydrogen 2.725 N/A VAL 247.A N VAL 308.A O no hydrogen 2.757 N/A VAL 248.A N GLU 171.A O no hydrogen 2.851 N/A GLU 250.A N GLY 168.A O no hydrogen 2.845 N/A LYS 251.A N PHE 167.A O no hydrogen 3.037 N/A GLN 252.A NE2 ASP 304.A O no hydrogen 2.661 N/A VAL 254.A N GLN 306.A OE1 no hydrogen 3.038 N/A THR 255.A N GLN 258.A OE1 no hydrogen 3.065 N/A THR 255.A OG1 GLU 257.A OE1 no hydrogen 3.554 N/A GLN 258.A N THR 255.A OG1 no hydrogen 3.107 N/A VAL 259.A N THR 255.A O no hydrogen 3.166 N/A ASN 260.A N VAL 256.A O no hydrogen 2.937 N/A ASN 260.A ND2 ALA 294.A O no hydrogen 3.443 N/A GLU 261.A N GLU 257.A O no hydrogen 2.991 N/A ALA 262.A N GLN 258.A O no hydrogen 3.084 N/A MET 263.A N VAL 259.A O no hydrogen 3.144 N/A LYS 264.A N ASN 260.A O no hydrogen 3.043 N/A ASN 265.A N GLU 261.A O no hydrogen 2.899 N/A ALA 266.A N MET 263.A O no hydrogen 2.996 N/A SER 267.A N LYS 264.A O no hydrogen 3.026 N/A SER 267.A OG LYS 264.A O no hydrogen 3.226 N/A ASN 268.A N PHE 271.A O no hydrogen 2.888 N/A SER 270.A N ASN 268.A OD1 no hydrogen 2.660 N/A SER 270.A OG PHE 132.A O no hydrogen 3.557 N/A SER 270.A OG GLN 323.A OE1 no hydrogen 2.793 N/A PHE 271.A N ASN 268.A OD1 no hydrogen 2.772 N/A GLY 272.A N SER 290.A O no hydrogen 2.783 N/A TYR 273.A OH GLU 275.A OE2 no hydrogen 2.661 N/A THR 274.A N PHE 292.A O no hydrogen 2.952 N/A ASP 276.A N THR 274.A OG1 no hydrogen 3.107 N/A VAL 279.A N ASP 282.A OD2 no hydrogen 2.835 N/A ASP 282.A N VAL 279.A O no hydrogen 2.905 N/A VAL 283.A N SER 280.A O no hydrogen 2.989 N/A VAL 284.A N SER 281.A O no hydrogen 3.396 N/A GLY 285.A N ASP 315.A OD2 no hydrogen 2.761 N/A MET 286.A N VAL 283.A O no hydrogen 2.946 N/A GLY 289.A N SER 270.A O no hydrogen 2.764 N/A SER 290.A OG SER 155.A O no hydrogen 2.665 N/A LEU 291.A N TRP 313.A O no hydrogen 2.827 N/A PHE 292.A N GLY 272.A O no hydrogen 2.869 N/A ASP 293.A N ALA 311.A O no hydrogen 3.004 N/A ALA 294.A N THR 274.A O no hydrogen 3.056 N/A THR 295.A OG1 ASP 293.A OD1 no hydrogen 2.527 N/A THR 295.A OG1 ASP 293.A OD2 no hydrogen 3.529 N/A GLN 296.A N ASP 293.A O no hydrogen 3.130 N/A THR 297.A N ALA 294.A O no hydrogen 3.228 N/A THR 297.A OG1 ASN 260.A OD1 no hydrogen 2.597 N/A THR 297.A OG1 ALA 294.A O no hydrogen 3.365 N/A ARG 298.A N LYS 309.A O no hydrogen 2.984 N/A MET 300.A N LEU 307.A O no hydrogen 2.927 N/A VAL 302.A N ARG 305.A O no hydrogen 2.897 N/A ARG 305.A N VAL 302.A O no hydrogen 3.114 N/A GLN 306.A NE2 VAL 254.A O no hydrogen 2.982 N/A GLN 306.A NE2 SER 301.A OG no hydrogen 3.049 N/A LEU 307.A N MET 300.A O no hydrogen 2.921 N/A VAL 308.A N VAL 247.A O no hydrogen 2.885 N/A LYS 309.A N ARG 298.A O no hydrogen 2.837 N/A VAL 310.A N LEU 245.A O no hydrogen 2.932 N/A ALA 312.A N THR 243.A O no hydrogen 2.958 N/A TRP 313.A N LEU 291.A O no hydrogen 2.762 N/A TRP 313.A NE1 ASP 293.A OD2 no hydrogen 2.786 N/A TYR 314.A N SER 241.A O no hydrogen 2.903 N/A TYR 314.A OH THR 152.A OG1 no hydrogen 2.806 N/A TYR 314.A OH THR 176.A OG1 no hydrogen 2.600 N/A ASP 315.A N SER 319.A OG no hydrogen 3.089 N/A GLU 317.A N ASP 315.A OD1 no hydrogen 2.941 N/A SER 319.A N ASP 315.A O no hydrogen 2.876 N/A SER 319.A OG TYR 288.A O no hydrogen 2.604 N/A TYR 320.A OH ALA 149.A O no hydrogen 2.622 N/A THR 321.A N GLU 317.A O no hydrogen 2.938 N/A THR 321.A OG1 GLU 317.A O no hydrogen 2.839 N/A ALA 322.A N MET 318.A O no hydrogen 2.771 N/A GLN 323.A N SER 319.A O no hydrogen 3.012 N/A GLN 323.A NE2 PHE 132.A O no hydrogen 2.940 N/A GLN 323.A NE2 ASN 154.A OD1 no hydrogen 3.063 N/A LEU 324.A N TYR 320.A O no hydrogen 2.672 N/A VAL 325.A N THR 321.A O no hydrogen 2.892 N/A ARG 326.A N ALA 322.A O no hydrogen 3.075 N/A ARG 326.A NH1 THR 287.A O no hydrogen 2.988 N/A ARG 326.A NH1 GLN 323.A OE1 no hydrogen 2.955 N/A ARG 326.A NH2 THR 287.A O no hydrogen 2.769 N/A THR 327.A N GLN 323.A O no hydrogen 2.979 N/A THR 327.A OG1 GLN 323.A O no hydrogen 3.423 N/A LEU 328.A N LEU 324.A O no hydrogen 2.795 N/A ALA 329.A N VAL 325.A O no hydrogen 2.968 N/A TYR 330.A N ARG 326.A O no hydrogen 3.028 N/A LEU 331.A N THR 327.A O no hydrogen 2.827 N/A ALA 332.A N LEU 328.A O no hydrogen 2.837 N/A GLU 333.A N ALA 329.A O no hydrogen 3.108 N/A GLU 333.A N TYR 330.A O no hydrogen 3.178 N/A LEU 334.A N LEU 331.A O no hydrogen 3.436 N/A