Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1ve5_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 2.A N ASP 5.A OD2 no hydrogen 2.606 N/A LEU 6.A N SER 2.A O no hydrogen 3.001 N/A TYR 7.A N LEU 3.A O no hydrogen 3.017 N/A ALA 8.A N GLN 4.A O no hydrogen 2.852 N/A ALA 9.A N ASP 5.A O no hydrogen 2.758 N/A PHE 10.A N LEU 6.A O no hydrogen 2.765 N/A ARG 11.A N TYR 7.A O no hydrogen 2.924 N/A ARG 12.A N ALA 8.A O no hydrogen 3.062 N/A ARG 12.A NE SER 56.A O no hydrogen 2.991 N/A ARG 12.A NH2 SER 56.A O no hydrogen 3.346 N/A ARG 12.A NH2 SER 56.A OG no hydrogen 3.023 N/A ILE 13.A N ALA 9.A O no hydrogen 2.993 N/A ALA 14.A N PHE 10.A O no hydrogen 2.784 N/A TYR 16.A N ILE 13.A O no hydrogen 2.877 N/A THR 17.A N ALA 14.A O no hydrogen 3.495 N/A THR 17.A OG1 ILE 13.A O no hydrogen 3.015 N/A HIS 18.A N GLN 44.A OE1 no hydrogen 2.825 N/A ARG 19.A NE GLU 155.A OE2 no hydrogen 2.651 N/A ARG 19.A NH1 ALA 14.A O no hydrogen 2.976 N/A ARG 19.A NH2 THR 17.A OG1 no hydrogen 2.723 N/A ARG 19.A NH2 GLU 155.A OE2 no hydrogen 3.053 N/A THR 20.A OG1 GLU 41.A OE2 no hydrogen 2.657 N/A LEU 23.A N LEU 38.A O no hydrogen 2.768 N/A LEU 28.A N SER 25.A OG no hydrogen 3.299 N/A ASP 29.A N SER 25.A O no hydrogen 3.031 N/A GLY 30.A N ARG 26.A O no hydrogen 2.821 N/A LEU 31.A N LEU 27.A O no hydrogen 2.940 N/A LEU 32.A N LEU 28.A O no hydrogen 3.101 N/A LYS 34.A NZ GLY 288.A O no hydrogen 2.733 N/A LYS 34.A NZ LEU 291.A O no hydrogen 2.868 N/A LYS 34.A NZ PRO 292.A O no hydrogen 3.013 N/A ARG 35.A N GLN 293.A O no hydrogen 3.017 N/A LEU 36.A N ASP 29.A OD1 no hydrogen 2.980 N/A LEU 37.A N LEU 295.A O no hydrogen 2.920 N/A LEU 38.A N LEU 23.A O no hydrogen 2.766 N/A LYS 39.A N LEU 297.A O no hydrogen 2.875 N/A LYS 39.A NZ THR 20.A O no hydrogen 2.804 N/A LYS 39.A NZ THR 20.A OG1 no hydrogen 3.214 N/A LYS 39.A NZ GLU 155.A OE1 no hydrogen 2.767 N/A LYS 39.A NZ GLN 159.A OE1 no hydrogen 2.775 N/A ALA 40.A N PRO 21.A O no hydrogen 3.056 N/A GLU 41.A N LYS 39.A O no hydrogen 2.987 N/A LEU 43.A N ALA 40.A O no hydrogen 2.923 N/A GLN 44.A N GLU 41.A O no hydrogen 3.021 N/A GLN 44.A NE2 HIS 18.A O no hydrogen 3.014 N/A LYS 45.A N GLN 44.A OE1 no hydrogen 2.877 N/A LYS 45.A NZ HIS 18.A NE2 no hydrogen 2.981 N/A THR 46.A OG1 LYS 45.A O no hydrogen 2.531 N/A GLY 47.A N GLN 44.A O no hydrogen 2.899 N/A PHE 49.A N SER 300.A O no hydrogen 3.204 N/A LYS 50.A N SER 48.A OG no hydrogen 3.246 N/A ARG 52.A N PHE 49.A O no hydrogen 2.834 N/A ARG 52.A NE GLU 41.A OE1 no hydrogen 2.766 N/A ARG 52.A NH1 THR 151.A OG1 no hydrogen 3.056 N/A ARG 52.A NH1 GLU 155.A OE2 no hydrogen 2.870 N/A ARG 52.A NH2 GLU 41.A OE1 no hydrogen 3.513 N/A ARG 52.A NH2 GLU 41.A OE2 no hydrogen 2.760 N/A ARG 52.A NH2 GLU 155.A OE1 no hydrogen 2.829 N/A ARG 52.A NH2 GLU 155.A OE2 no hydrogen 3.178 N/A ALA 54.A N LYS 50.A O no hydrogen 3.110 N/A LEU 55.A N ALA 51.A O no hydrogen 3.047 N/A SER 56.A N ARG 52.A O no hydrogen 2.931 N/A SER 56.A OG LEU 144.A O no hydrogen 2.532 N/A LYS 57.A N GLY 53.A O no hydrogen 3.179 N/A LYS 57.A NZ ASP 142.A OD2 no hydrogen 2.701 N/A ALA 58.A N ALA 54.A O no hydrogen 2.963 N/A LEU 59.A N LEU 55.A O no hydrogen 2.852 N/A ALA 60.A N LYS 57.A O no hydrogen 3.126 N/A LEU 61.A N ALA 58.A O no hydrogen 3.357 N/A LEU 67.A N LYS 89.A O no hydrogen 2.807 N/A LEU 68.A N ALA 135.A O no hydrogen 2.714 N/A ALA 69.A N LEU 91.A O no hydrogen 2.970 N/A GLY 73.A N SER 71.A OG no hydrogen 3.065 N/A HIS 75.A NE2 ILE 137.A O no hydrogen 2.837 N/A ALA 76.A N GLY 73.A O no hydrogen 3.206 N/A GLN 77.A NE2 ASN 303.A OD1 no hydrogen 3.473 N/A GLY 78.A N ASN 74.A O no hydrogen 3.118 N/A VAL 79.A N HIS 75.A O no hydrogen 2.926 N/A ALA 80.A N ALA 76.A O no hydrogen 3.013 N/A TYR 81.A N GLN 77.A O no hydrogen 2.865 N/A TYR 81.A OH TYR 16.A O no hydrogen 2.802 N/A ALA 82.A N GLY 78.A O no hydrogen 2.792 N/A ALA 83.A N VAL 79.A O no hydrogen 2.813 N/A GLN 84.A N ALA 80.A O no hydrogen 3.134 N/A GLN 84.A N TYR 81.A O no hydrogen 2.895 N/A VAL 85.A N TYR 81.A O no hydrogen 3.124 N/A LEU 86.A N ALA 82.A O no hydrogen 3.060 N/A GLY 87.A N ALA 83.A O no hydrogen 2.936 N/A VAL 88.A N ALA 83.A O no hydrogen 3.002 N/A LEU 91.A N LEU 67.A O no hydrogen 2.842 N/A VAL 92.A N GLU 110.A O no hydrogen 2.780 N/A VAL 93.A N ALA 69.A O no hydrogen 2.881 N/A MET 94.A N VAL 112.A O no hydrogen 3.310 N/A GLU 96.A N VAL 116.A O no hydrogen 3.009 N/A LYS 101.A NZ ASP 113.A OD2 no hydrogen 3.012 N/A ALA 102.A N TYR 99.A O no hydrogen 2.595 N/A ARG 105.A N LYS 101.A O no hydrogen 3.087 N/A ALA 106.A N ALA 102.A O no hydrogen 2.801 N/A TYR 107.A N CYS 103.A O no hydrogen 3.094 N/A GLY 108.A N ARG 105.A O no hydrogen 2.951 N/A ALA 109.A N ALA 104.A O no hydrogen 3.187 N/A GLU 110.A N ALA 90.A O no hydrogen 3.063 N/A VAL 112.A N VAL 92.A O no hydrogen 2.721 N/A VAL 116.A N ASP 113.A O no hydrogen 2.871 N/A THR 117.A N ASN 120.A OD1 no hydrogen 2.956 N/A THR 117.A OG1 ALA 118.A O no hydrogen 3.147 N/A ASN 120.A ND2 GLY 115.A O no hydrogen 3.340 N/A VAL 124.A N ASN 120.A O no hydrogen 3.136 N/A ALA 125.A N ARG 121.A O no hydrogen 2.937 N/A ARG 126.A N GLU 122.A O no hydrogen 2.929 N/A ALA 127.A N GLU 123.A O no hydrogen 3.059 N/A LEU 128.A N VAL 124.A O no hydrogen 2.944 N/A GLN 129.A N ALA 125.A O no hydrogen 2.761 N/A GLN 129.A NE2 TYR 134.A O no hydrogen 2.735 N/A GLU 130.A N ARG 126.A O no hydrogen 2.961 N/A GLU 131.A N ALA 127.A O no hydrogen 2.996 N/A THR 132.A N LEU 128.A O no hydrogen 2.819 N/A THR 132.A OG1 LEU 128.A O no hydrogen 2.795 N/A GLY 133.A N GLN 129.A O no hydrogen 2.658 N/A TYR 134.A N THR 132.A OG1 no hydrogen 3.218 N/A ALA 135.A N GLY 66.A O no hydrogen 3.027 N/A ILE 137.A N LEU 68.A O no hydrogen 2.920 N/A LEU 144.A N ASP 142.A OD1 no hydrogen 2.796 N/A VAL 145.A N ASP 142.A O no hydrogen 2.885 N/A ILE 146.A N ASP 142.A O no hydrogen 2.909 N/A ALA 147.A N PRO 143.A O no hydrogen 2.964 N/A GLY 148.A N LEU 144.A O no hydrogen 3.073 N/A GLN 149.A N VAL 145.A O no hydrogen 2.939 N/A GLN 149.A NE2 PHE 49.A O no hydrogen 3.428 N/A GLY 150.A N ILE 146.A O no hydrogen 2.969 N/A THR 151.A N GLY 148.A O no hydrogen 3.100 N/A THR 151.A OG1 GLY 148.A O no hydrogen 2.501 N/A ALA 152.A N GLN 149.A O no hydrogen 3.166 N/A GLY 153.A N GLY 150.A O no hydrogen 2.906 N/A LEU 154.A N GLY 150.A O no hydrogen 3.394 N/A GLU 155.A N THR 151.A O no hydrogen 3.035 N/A LEU 156.A N ALA 152.A O no hydrogen 2.950 N/A LEU 157.A N GLY 153.A O no hydrogen 3.210 N/A ALA 158.A N LEU 154.A O no hydrogen 3.176 N/A GLN 159.A N GLU 155.A O no hydrogen 2.809 N/A GLN 159.A NE2 THR 20.A O no hydrogen 2.861 N/A ALA 160.A N LEU 156.A O no hydrogen 2.900 N/A GLY 161.A N LEU 157.A O no hydrogen 2.832 N/A ARG 162.A N ALA 158.A O no hydrogen 2.893 N/A MET 163.A N GLN 159.A O no hydrogen 3.200 N/A MET 163.A N ALA 160.A O no hydrogen 3.213 N/A GLY 164.A N GLY 161.A O no hydrogen 3.020 N/A VAL 165.A N ALA 160.A O no hydrogen 3.062 N/A GLY 168.A N THR 294.A O no hydrogen 2.740 N/A VAL 170.A N LEU 195.A O no hydrogen 2.804 N/A LEU 171.A N ALA 296.A O no hydrogen 2.828 N/A ALA 172.A N LEU 197.A O no hydrogen 3.128 N/A VAL 174.A N VAL 199.A O no hydrogen 3.063 N/A ALA 181.A N GLY 177.A O no hydrogen 2.926 N/A GLY 182.A N GLY 178.A O no hydrogen 3.061 N/A LEU 183.A N LEU 179.A O no hydrogen 2.892 N/A ALA 184.A N LEU 180.A O no hydrogen 2.813 N/A THR 185.A N ALA 181.A O no hydrogen 3.085 N/A THR 185.A OG1 ALA 181.A O no hydrogen 2.706 N/A ALA 186.A N GLY 182.A O no hydrogen 3.214 N/A VAL 187.A N LEU 183.A O no hydrogen 3.010 N/A LYS 188.A N ALA 184.A O no hydrogen 2.902 N/A LYS 188.A NZ PRO 192.A O no hydrogen 3.353 N/A LYS 188.A NZ THR 194.A O no hydrogen 2.765 N/A LYS 188.A NZ ASP 248.A OD1 no hydrogen 3.276 N/A LYS 188.A NZ ASP 248.A OD2 no hydrogen 2.615 N/A ALA 189.A N THR 185.A O no hydrogen 3.124 N/A LEU 190.A N VAL 187.A O no hydrogen 3.194 N/A SER 191.A N VAL 187.A O no hydrogen 2.822 N/A SER 191.A OG THR 194.A OG1 no hydrogen 2.915 N/A THR 194.A N SER 191.A O no hydrogen 3.181 N/A THR 194.A OG1 SER 191.A OG no hydrogen 2.915 N/A LEU 195.A N GLY 168.A O no hydrogen 3.205 N/A VAL 196.A N ASP 248.A OD2 no hydrogen 2.667 N/A LEU 197.A N VAL 170.A O no hydrogen 2.889 N/A GLY 198.A N GLY 249.A O no hydrogen 2.979 N/A GLU 200.A N LEU 251.A O no hydrogen 2.867 N/A GLU 202.A N VAL 253.A O no hydrogen 3.223 N/A ALA 204.A N PRO 201.A O no hydrogen 2.924 N/A ALA 207.A N GLU 200.A OE1 no hydrogen 3.254 N/A LYS 208.A N GLU 200.A OE2 no hydrogen 2.649 N/A LYS 208.A NZ ILE 250.A O no hydrogen 3.096 N/A ARG 209.A N ASP 205.A O no hydrogen 2.979 N/A ARG 209.A NH1 ASP 205.A OD1 no hydrogen 3.428 N/A SER 210.A N ASP 206.A O no hydrogen 2.788 N/A SER 210.A OG ASP 206.A O no hydrogen 2.829 N/A SER 210.A OG ARG 215.A O no hydrogen 3.521 N/A LEU 211.A N ALA 207.A O no hydrogen 3.076 N/A GLU 212.A N LYS 208.A O no hydrogen 3.337 N/A ALA 213.A N ARG 209.A O no hydrogen 2.866 N/A GLY 214.A N SER 210.A O no hydrogen 2.854 N/A LEU 217.A N SER 210.A OG no hydrogen 2.850 N/A LEU 219.A N LEU 233.A O no hydrogen 2.824 N/A THR 225.A OG1 GLU 255.A OE1 no hydrogen 3.199 N/A THR 225.A OG1 GLU 255.A OE2 no hydrogen 2.874 N/A ARG 226.A N GLU 255.A OE1 no hydrogen 2.916 N/A ARG 226.A NE GLU 262.A OE2 no hydrogen 2.967 N/A ARG 226.A NH2 GLU 262.A OE1 no hydrogen 2.868 N/A ARG 226.A NH2 GLU 262.A OE2 no hydrogen 3.352 N/A ALA 227.A N THR 225.A OG1 no hydrogen 3.127 N/A ASP 228.A N ARG 226.A O no hydrogen 2.777 N/A VAL 230.A N ALA 227.A O no hydrogen 3.200 N/A ARG 231.A NH2 THR 225.A O no hydrogen 3.094 N/A SER 234.A OG LEU 235.A O no hydrogen 3.513 N/A GLY 236.A N GLY 176.A O no hydrogen 3.091 N/A GLY 236.A N THR 239.A OG1 no hydrogen 3.102 N/A GLU 237.A N ASP 141.A OD2 no hydrogen 2.736 N/A ARG 238.A N ASP 141.A OD1 no hydrogen 2.698 N/A ARG 238.A NH1 ASP 141.A O no hydrogen 3.297 N/A THR 239.A OG1 GLY 176.A O no hydrogen 2.865 N/A THR 239.A OG1 GLY 236.A O no hydrogen 3.231 N/A PHE 240.A N GLY 236.A O no hydrogen 3.093 N/A LEU 243.A N THR 239.A O no hydrogen 2.962 N/A ARG 244.A N PHE 240.A O no hydrogen 2.874 N/A GLU 245.A N ILE 242.A O no hydrogen 3.243 N/A ARG 246.A N ILE 242.A O no hydrogen 2.722 N/A ARG 246.A NH1 PRO 1.A O no hydrogen 3.174 N/A VAL 247.A N LEU 243.A O no hydrogen 2.884 N/A ASP 248.A N VAL 196.A O no hydrogen 2.947 N/A LEU 251.A N GLY 198.A O no hydrogen 2.861 N/A VAL 253.A N GLU 200.A O no hydrogen 3.231 N/A SER 254.A N GLU 286.A OE1 no hydrogen 2.840 N/A SER 254.A OG GLU 286.A OE1 no hydrogen 3.234 N/A SER 254.A OG GLU 286.A OE2 no hydrogen 2.781 N/A ALA 257.A N SER 254.A OG no hydrogen 3.143 N/A LEU 258.A N SER 254.A O no hydrogen 3.042 N/A LEU 259.A N GLU 255.A O no hydrogen 3.113 N/A GLU 260.A N GLU 256.A O no hydrogen 3.138 N/A ALA 261.A N ALA 257.A O no hydrogen 2.851 N/A GLU 262.A N LEU 258.A O no hydrogen 2.975 N/A ARG 263.A N LEU 259.A O no hydrogen 2.986 N/A LEU 264.A N GLU 260.A O no hydrogen 2.897 N/A LEU 265.A N ALA 261.A O no hydrogen 3.145 N/A PHE 266.A N GLU 262.A O no hydrogen 2.967 N/A THR 267.A N ARG 263.A O no hydrogen 2.803 N/A THR 267.A OG1 ARG 263.A O no hydrogen 2.718 N/A ARG 268.A N LEU 264.A O no hydrogen 2.806 N/A ARG 268.A NH1 THR 267.A OG1 no hydrogen 2.974 N/A THR 269.A N LEU 265.A O no hydrogen 3.134 N/A THR 269.A OG1 LEU 265.A O no hydrogen 2.484 N/A LYS 270.A NZ THR 267.A O no hydrogen 2.929 N/A GLN 271.A N LEU 265.A O no hydrogen 3.461 N/A GLN 271.A NE2 THR 269.A O no hydrogen 2.992 N/A GLU 274.A N GLY 301.A O no hydrogen 2.965 N/A ALA 278.A N PRO 275.A O no hydrogen 3.076 N/A LEU 279.A N THR 276.A O no hydrogen 3.199 N/A ALA 282.A N ALA 278.A O no hydrogen 3.162 N/A ALA 283.A N LEU 279.A O no hydrogen 3.009 N/A VAL 284.A N LEU 281.A O no hydrogen 3.108 N/A LEU 285.A N LEU 281.A O no hydrogen 3.147 N/A GLU 286.A N ALA 282.A O no hydrogen 3.057 N/A HIS 287.A N ALA 283.A O no hydrogen 2.729 N/A HIS 287.A ND1 ALA 283.A O no hydrogen 3.168 N/A GLY 288.A N VAL 284.A O no hydrogen 2.655 N/A ARG 290.A N HIS 287.A O no hydrogen 2.752 N/A LEU 291.A N GLY 288.A O no hydrogen 3.054 N/A LEU 295.A N ARG 35.A O no hydrogen 3.036 N/A ALA 296.A N ALA 169.A O no hydrogen 2.887 N/A LEU 297.A N LEU 37.A O no hydrogen 2.724 N/A LEU 298.A N LEU 171.A O no hydrogen 2.877 N/A LEU 299.A N LYS 39.A O no hydrogen 3.034 N/A GLY 302.A N GLY 47.A O no hydrogen 2.854 N/A ASN 303.A N GLU 274.A OE1 no hydrogen 2.990 N/A ASN 303.A ND2 THR 46.A O no hydrogen 3.545 N/A ARG 304.A NE ASP 305.A O no hydrogen 3.027 N/A ARG 304.A NH2 ASP 305.A O no hydrogen 3.009 N/A PHE 306.A N ASP 305.A OD1 no hydrogen 2.636 N/A