Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2vm3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 4.A N ALA 1.A O no hydrogen 3.255 N/A HIS 6.A ND1 GLU 32.A OE1 no hydrogen 2.618 N/A THR 7.A N VAL 30.A O no hydrogen 2.815 N/A VAL 9.A N GLU 32.A O no hydrogen 3.006 N/A GLN 16.A N ALA 13.A O no hydrogen 3.255 N/A HIS 20.A ND1 HIS 18.A O no hydrogen 2.826 N/A HIS 20.A NE2 TYR 164.A OH no hydrogen 2.636 N/A GLN 22.A NE2 TYR 164.A O no hydrogen 2.880 N/A THR 24.A N ARG 151.A O no hydrogen 2.947 N/A THR 24.A OG1 GLU 21.A OE2 no hydrogen 2.818 N/A THR 24.A OG1 SER 26.A OG.B no hydrogen 2.630 N/A SER 26.A N THR 24.A OG1 no hydrogen 2.963 N/A SER 26.A OG.A GLY 27.A O no hydrogen 2.963 N/A SER 26.A OG.B THR 24.A OG1 no hydrogen 2.630 N/A LYS 29.A N ASP 71.A OD1 no hydrogen 2.940 N/A VAL 30.A N PRO 5.A O no hydrogen 3.010 N/A VAL 31.A N TYR 72.A O no hydrogen 2.795 N/A GLU 32.A N THR 7.A O no hydrogen 2.764 N/A PHE 33.A N GLN 74.A O no hydrogen 2.912 N/A MET 35.A N THR 76.A O no hydrogen 2.985 N/A THR 36.A N ASN 57.A OD1 no hydrogen 2.825 N/A ILE 37.A N VAL 78.A O no hydrogen 2.876 N/A GLU 38.A N THR 55.A O no hydrogen 2.967 N/A GLU 39.A N ASN 83.A OD1 no hydrogen 3.012 N/A LYS 40.A N ALA 53.A O no hydrogen 2.920 N/A LYS 40.A NZ GLU 38.A OE1 no hydrogen 3.327 N/A LYS 40.A NZ GLY 58.A O no hydrogen 2.752 N/A LYS 41.A NZ ASP 187.A OD1 no hydrogen 2.498 N/A LYS 41.A NZ TYR 188.A O no hydrogen 2.827 N/A MET 42.A N LEU 51.A O no hydrogen 2.824 N/A ILE 44.A N THR 49.A O no hydrogen 2.922 N/A LYS 47.A NZ ASP 45.A OD2 no hydrogen 2.894 N/A GLY 48.A N ASP 45.A O no hydrogen 3.402 N/A THR 49.A N ASP 45.A OD1 no hydrogen 2.786 N/A THR 49.A OG1 ASP 45.A OD1 no hydrogen 3.187 N/A THR 49.A OG1 ASP 45.A OD2 no hydrogen 2.650 N/A LEU 51.A N MET 42.A O no hydrogen 2.794 N/A GLN 52.A NE2 TYR 188.A O no hydrogen 2.853 N/A ALA 53.A N LYS 40.A O no hydrogen 2.891 N/A MET 54.A N SER 140.A O no hydrogen 3.059 N/A THR 55.A N GLU 38.A O no hydrogen 3.009 N/A THR 55.A OG1 GLU 38.A O no hydrogen 2.820 N/A ASN 57.A N THR 36.A O no hydrogen 2.823 N/A SER 59.A N PHE 56.A O no hydrogen 3.414 N/A SER 59.A OG PRO 61.A O no hydrogen 2.699 N/A GLY 62.A N SER 143.A O no hydrogen 2.782 N/A THR 64.A OG1 THR 169.A OG1 no hydrogen 2.861 N/A LEU 65.A N THR 145.A O no hydrogen 3.022 N/A VAL 67.A N MET 147.A O no hydrogen 2.928 N/A HIS 68.A N ASP 71.A OD2 no hydrogen 2.785 N/A HIS 68.A NE2 GLN 22.A O no hydrogen 2.663 N/A GLU 69.A N LEU 149.A O no hydrogen 2.843 N/A GLY 70.A N ALA 118.A O no hydrogen 2.957 N/A ASP 71.A N HIS 68.A O no hydrogen 2.877 N/A TYR 72.A N LYS 29.A O no hydrogen 2.900 N/A VAL 73.A N PHE 116.A O no hydrogen 2.780 N/A GLN 74.A N VAL 31.A O no hydrogen 2.843 N/A LEU 75.A N LEU 114.A O no hydrogen 2.734 N/A THR 76.A N PHE 33.A O no hydrogen 2.862 N/A THR 76.A OG1 THR 113.A OG1 no hydrogen 2.973 N/A LEU 77.A N ALA 112.A O no hydrogen 2.779 N/A VAL 78.A N MET 35.A O no hydrogen 2.840 N/A ASN 79.A N GLU 110.A O no hydrogen 2.923 N/A ASN 79.A ND2 MET 85.A O no hydrogen 3.067 N/A ASN 79.A ND2 VAL 106.A O no hydrogen 2.711 N/A ASN 83.A N PRO 80.A O no hydrogen 3.054 N/A ASN 83.A ND2 ILE 37.A O no hydrogen 2.922 N/A ASN 83.A ND2 ASN 79.A OD1 no hydrogen 2.769 N/A ALA 84.A N GLU 39.A OE1 no hydrogen 2.751 N/A ALA 84.A N GLU 39.A OE2 no hydrogen 3.286 N/A MET 85.A N GLU 39.A OE2 no hydrogen 2.880 N/A HIS 87.A N VAL 106.A O no hydrogen 3.031 N/A HIS 87.A NE2 GLU 39.A OE2 no hydrogen 2.837 N/A ASN 88.A ND2 ALA 101.A O no hydrogen 3.372 N/A ASN 88.A ND2 ASN 105.A OD1 no hydrogen 2.962 N/A ASN 88.A ND2 ALA 129.A O no hydrogen 3.056 N/A VAL 89.A N THR 104.A OG1 no hydrogen 3.028 N/A ASP 90.A N HIS 127.A O no hydrogen 2.793 N/A PHE 91.A N GLY 99.A O no hydrogen 2.831 N/A HIS 92.A N VAL 125.A O no hydrogen 2.943 N/A ALA 94.A N PHE 91.A O no hydrogen 3.118 N/A GLY 100.A N ALA 97.A O no hydrogen 2.899 N/A ALA 101.A N LEU 98.A O no hydrogen 3.345 N/A LYS 102.A N ALA 97.A O no hydrogen 3.363 N/A LEU 103.A N GLY 100.A O no hydrogen 3.120 N/A THR 104.A N ALA 101.A O no hydrogen 3.344 N/A THR 104.A OG1 VAL 89.A O no hydrogen 3.379 N/A THR 104.A OG1 GLY 100.A O no hydrogen 2.704 N/A ASN 105.A ND2 LYS 102.A O no hydrogen 3.683 N/A VAL 106.A N HIS 87.A O no hydrogen 2.782 N/A ASN 107.A N GLU 110.A OE1 no hydrogen 2.932 N/A GLY 109.A N ASN 79.A O no hydrogen 2.599 N/A GLU 110.A N ASN 107.A O no hydrogen 2.846 N/A ALA 112.A N LEU 77.A O no hydrogen 3.074 N/A THR 113.A OG1 THR 76.A OG1 no hydrogen 2.973 N/A LEU 114.A N LEU 75.A O no hydrogen 2.802 N/A ARG 115.A NH1 ASP 2.A OD1 no hydrogen 3.196 N/A PHE 116.A N VAL 73.A O no hydrogen 2.930 N/A LYS 117.A NZ TYR 72.A OH no hydrogen 3.506 N/A ALA 118.A N ASP 71.A O no hydrogen 2.872 N/A GLY 122.A N VAL 148.A O no hydrogen 2.807 N/A THR 123.A N GLY 260.A O no hydrogen 2.766 N/A THR 123.A OG1 GLY 260.A O no hydrogen 3.453 N/A THR 123.A OG1 ALA 280.A O no hydrogen 3.015 N/A PHE 124.A N LEU 146.A O no hydrogen 2.771 N/A TYR 126.A N GLY 144.A O no hydrogen 2.804 N/A TYR 126.A OH PRO 63.A O no hydrogen 2.647 N/A HIS 127.A N ASP 90.A O no hydrogen 2.924 N/A HIS 127.A ND1 CYS 128.A O no hydrogen 2.859 N/A CYS 128.A N MET 142.A O no hydrogen 3.017 N/A CYS 128.A SG HIS 87.A ND1 no hydrogen 3.823 N/A CYS 128.A SG ASN 88.A O no hydrogen 3.551 N/A CYS 128.A SG ASN 88.A OD1 no hydrogen 3.873 N/A CYS 128.A SG HIS 137.A ND1 no hydrogen 3.657 N/A ALA 129.A N ASN 88.A OD1 no hydrogen 2.775 N/A MET 133.A N PRO 130.A O no hydrogen 2.992 N/A HIS 137.A N MET 133.A O no hydrogen 3.197 N/A VAL 138.A N VAL 134.A O no hydrogen 3.117 N/A VAL 139.A N PRO 135.A O no hydrogen 2.827 N/A SER 140.A N TRP 136.A O no hydrogen 3.012 N/A SER 140.A OG TRP 136.A O no hydrogen 2.705 N/A GLY 141.A N VAL 138.A O no hydrogen 3.053 N/A MET 142.A N HIS 137.A O no hydrogen 3.202 N/A SER 143.A N GLY 141.A O no hydrogen 2.986 N/A GLY 144.A N TYR 126.A O no hydrogen 2.923 N/A LEU 146.A N PHE 124.A O no hydrogen 2.804 N/A MET 147.A N LEU 65.A O no hydrogen 2.736 N/A VAL 148.A N GLY 122.A O no hydrogen 2.737 N/A LEU 149.A N VAL 67.A O no hydrogen 2.897 N/A ARG 151.A NE GLU 69.A O no hydrogen 3.171 N/A ARG 151.A NH1 SER 26.A O no hydrogen 2.819 N/A ARG 151.A NH2 GLU 69.A O no hydrogen 2.898 N/A ARG 151.A NH2 ASP 71.A OD1 no hydrogen 2.806 N/A GLY 153.A N PRO 150.A O no hydrogen 2.824 N/A LYS 155.A NZ.A ASP 152.A OD2 no hydrogen 3.117 N/A LYS 155.A NZ.B ASP 152.A O no hydrogen 3.391 N/A LYS 155.A NZ.B ASP 152.A OD2 no hydrogen 2.983 N/A ASP 156.A N LYS 160.A O no hydrogen 2.767 N/A GLN 158.A N ASP 156.A OD1 no hydrogen 2.827 N/A GLY 159.A N ASP 156.A O no hydrogen 2.826 N/A LYS 160.A N ASP 156.A OD1 no hydrogen 2.890 N/A LEU 162.A N LEU 154.A O no hydrogen 2.967 N/A TYR 164.A N GLN 22.A OE1 no hydrogen 3.171 N/A TYR 164.A OH HIS 20.A NE2 no hydrogen 2.636 N/A ASP 165.A N THR 232.A O no hydrogen 2.709 N/A ARG 166.A N THR 232.A O no hydrogen 3.284 N/A ARG 166.A NH1.A THR 226.A O no hydrogen 3.007 N/A TYR 168.A N LEU 234.A O no hydrogen 2.756 N/A TYR 168.A OH THR 226.A O no hydrogen 2.643 N/A THR 169.A N PRO 15.A O no hydrogen 2.823 N/A THR 169.A OG1 THR 64.A OG1 no hydrogen 2.861 N/A ILE 170.A N ILE 236.A O no hydrogen 2.763 N/A GLY 171.A N ASN 213.A OD1 no hydrogen 2.905 N/A GLU 172.A N SER 238.A O no hydrogen 2.955 N/A PHE 173.A N VAL 211.A O no hydrogen 2.804 N/A LEU 175.A N HIS 209.A O no hydrogen 2.816 N/A TYR 176.A OH ASP 174.A OD2 no hydrogen 2.614 N/A ILE 177.A N SER 208.A OG no hydrogen 3.022 N/A GLY 180.A N LYS 184.A O no hydrogen 2.866 N/A GLY 183.A N GLY 180.A O no hydrogen 2.796 N/A LYS 184.A N ASP 182.A OD1 no hydrogen 2.939 N/A LYS 186.A N PRO 178.A O no hydrogen 2.915 N/A LYS 186.A NZ ASP 197.A OD2 no hydrogen 3.134 N/A TYR 188.A OH ASP 197.A OD2 no hydrogen 2.572 N/A THR 190.A OG1 GLU 193.A OE2 no hydrogen 2.757 N/A GLU 193.A N THR 190.A OG1 no hydrogen 3.357 N/A SER 194.A N LEU 191.A O no hydrogen 3.054 N/A SER 194.A OG LEU 191.A O no hydrogen 2.634 N/A TYR 195.A N ALA 192.A O no hydrogen 3.248 N/A THR 198.A N SER 194.A O no hydrogen 3.095 N/A THR 198.A OG1 SER 194.A O no hydrogen 2.656 N/A VAL 199.A N TYR 195.A O no hydrogen 3.032 N/A GLN 200.A N GLY 196.A O no hydrogen 3.321 N/A VAL 201.A N ASP 197.A O no hydrogen 3.249 N/A MET 202.A N THR 198.A O no hydrogen 2.750 N/A ARG 203.A N VAL 199.A O no hydrogen 2.904 N/A THR 204.A N VAL 201.A O no hydrogen 2.992 N/A THR 204.A OG1 VAL 201.A O no hydrogen 2.621 N/A LEU 205.A N MET 202.A O no hydrogen 2.873 N/A THR 206.A N THR 204.A OG1 no hydrogen 3.234 N/A THR 206.A OG1 THR 204.A O no hydrogen 3.464 N/A SER 208.A N LEU 175.A O no hydrogen 2.805 N/A SER 208.A OG LEU 175.A O no hydrogen 3.223 N/A ILE 210.A N LEU 306.A O no hydrogen 2.857 N/A VAL 211.A N PHE 173.A O no hydrogen 2.974 N/A ASN 213.A N GLY 171.A O no hydrogen 2.775 N/A ASN 213.A ND2 THR 169.A O no hydrogen 3.449 N/A LYS 215.A N PHE 212.A O no hydrogen 3.513 N/A VAL 216.A N ILE 44.A O no hydrogen 2.898 N/A ALA 218.A N LYS 215.A O no hydrogen 3.017 N/A THR 220.A N GLY 217.A O no hydrogen 3.060 N/A THR 220.A OG1 GLY 217.A O no hydrogen 2.626 N/A ASN 223.A N THR 220.A O no hydrogen 2.904 N/A ALA 224.A N GLY 221.A O no hydrogen 3.090 N/A LEU 225.A N HIS 311.A O no hydrogen 2.949 N/A THR 226.A N TYR 168.A OH no hydrogen 3.083 N/A THR 226.A OG1 TYR 168.A OH no hydrogen 3.297 N/A ALA 227.A N LYS 313.A O no hydrogen 3.133 N/A LYS 228.A N GLU 231.A OE1 no hydrogen 2.978 N/A VAL 229.A N GLU 315.A O no hydrogen 2.770 N/A GLY 230.A N PHE 287.A O no hydrogen 2.802 N/A GLU 231.A N LYS 228.A O no hydrogen 3.013 N/A THR 232.A N ASP 165.A OD2 no hydrogen 2.904 N/A THR 232.A OG1 THR 286.A OG1 no hydrogen 2.619 N/A VAL 233.A N TYR 285.A O no hydrogen 2.846 N/A LEU 234.A N ARG 166.A O no hydrogen 2.812 N/A LEU 235.A N ALA 283.A O no hydrogen 2.884 N/A ILE 236.A N TYR 168.A O no hydrogen 2.943 N/A HIS 237.A N GLY 281.A O no hydrogen 2.978 N/A HIS 237.A ND1 TYR 295.A OH no hydrogen 2.669 N/A HIS 237.A NE2 GLU 172.A OE1 no hydrogen 2.806 N/A SER 238.A N ILE 170.A O no hydrogen 2.846 N/A SER 238.A OG ILE 170.A O no hydrogen 3.542 N/A GLN 239.A N SER 279.A O no hydrogen 3.032 N/A GLN 239.A NE2 ASP 174.A OD1 no hydrogen 3.022 N/A ASN 241.A N GLN 239.A OE1 no hydrogen 2.901 N/A ASN 241.A ND2 ASP 174.A OD2 no hydrogen 2.873 N/A ARG 242.A N GLN 239.A OE1 no hydrogen 3.014 N/A ARG 242.A NH1.A GLU 302.A OE1 no hydrogen 3.040 N/A ARG 242.A NH1.B LEU 205.A O no hydrogen 3.057 N/A ARG 242.A NH2.A GLU 302.A OE2 no hydrogen 2.249 N/A ARG 242.A NH2.B GLU 302.A OE2 no hydrogen 3.100 N/A THR 244.A N ILE 275.A O no hydrogen 2.993 N/A THR 244.A OG1 GLU 172.A OE1 no hydrogen 2.669 N/A THR 244.A OG1 GLU 172.A OE2 no hydrogen 3.073 N/A ARG 245.A NH1 ASN 297.A OD1 no hydrogen 2.985 N/A ARG 245.A NH1 GLU 302.A OE1 no hydrogen 3.199 N/A HIS 247.A N LEU 296.A O no hydrogen 2.896 N/A HIS 247.A ND1 GLU 271.A O no hydrogen 2.699 N/A ILE 249.A N ALA 294.A O no hydrogen 2.788 N/A GLY 251.A N LEU 248.A O no hydrogen 2.970 N/A GLY 253.A N LEU 270.A O no hydrogen 2.833 N/A ASP 254.A N LEU 284.A O no hydrogen 2.804 N/A TRP 255.A N LEU 284.A O no hydrogen 3.313 N/A VAL 256.A N GLN 267.A O no hydrogen 2.796 N/A TRP 257.A N ALA 282.A O no hydrogen 2.933 N/A TRP 257.A NE1 ASN 264.A O no hydrogen 2.892 N/A LYS 261.A NZ THR 123.A O no hydrogen 2.763 N/A LYS 261.A NZ THR 259.A O no hydrogen 2.712 N/A ASN 264.A N LYS 261.A O no hydrogen 3.079 N/A ASN 264.A ND2 LYS 261.A O no hydrogen 3.138 N/A GLN 267.A N VAL 256.A O no hydrogen 2.898 N/A ARG 268.A NE ASP 269.A OD2 no hydrogen 2.787 N/A ARG 268.A NH2 ASP 269.A OD1 no hydrogen 3.196 N/A ARG 268.A NH2 ASP 269.A OD2 no hydrogen 3.365 N/A ASP 269.A N ASP 254.A O no hydrogen 3.400 N/A LEU 270.A N GLY 253.A O no hydrogen 2.993 N/A THR 272.A OG1 HIS 247.A ND1 no hydrogen 3.266 N/A TRP 273.A N PRO 246.A O no hydrogen 3.018 N/A PHE 274.A N GLU 258.A OE1 no hydrogen 2.938 N/A ILE 275.A N THR 244.A O no hydrogen 2.880 N/A ARG 276.A NH1 GLU 258.A OE2 no hydrogen 3.223 N/A ARG 276.A NH2 GLU 258.A OE2 no hydrogen 2.840 N/A GLY 277.A N ASP 243.A OD1 no hydrogen 2.915 N/A GLY 278.A N GLN 239.A O no hydrogen 2.722 N/A SER 279.A N GLN 239.A O no hydrogen 3.200 N/A SER 279.A OG ARG 276.A O no hydrogen 2.653 N/A GLY 281.A N HIS 237.A O no hydrogen 2.982 N/A ALA 282.A N TRP 257.A O no hydrogen 3.183 N/A ALA 283.A N LEU 235.A O no hydrogen 3.016 N/A LEU 284.A N TRP 255.A O no hydrogen 2.771 N/A TYR 285.A N VAL 233.A O no hydrogen 3.060 N/A THR 286.A N ASP 254.A OD2 no hydrogen 2.914 N/A THR 286.A OG1 THR 232.A OG1 no hydrogen 2.619 N/A PHE 287.A N GLU 231.A O no hydrogen 3.104 N/A GLN 289.A NE2 ASN 319.A O no hydrogen 3.026 N/A GLY 291.A N VAL 314.A O no hydrogen 2.819 N/A TYR 293.A N ILE 312.A O no hydrogen 2.798 N/A TYR 293.A OH GLN 289.A O no hydrogen 2.616 N/A TYR 295.A N GLY 310.A O no hydrogen 2.824 N/A TYR 295.A OH HIS 237.A ND1 no hydrogen 2.669 N/A LEU 296.A N HIS 247.A O no hydrogen 2.979 N/A ASN 297.A N ALA 308.A O no hydrogen 3.009 N/A ASN 297.A ND2 GLU 172.A OE2 no hydrogen 2.824 N/A ASN 297.A ND2 GLU 302.A OE1 no hydrogen 2.901 N/A HIS 298.A N ARG 245.A O no hydrogen 2.833 N/A HIS 298.A ND1 HIS 298.A O no hydrogen 2.609 N/A ASN 299.A N ASN 297.A OD1 no hydrogen 2.851 N/A ILE 301.A N ASN 299.A OD1 no hydrogen 3.062 N/A GLU 302.A N ASN 299.A OD1 no hydrogen 3.177 N/A ALA 303.A N ASN 299.A O no hydrogen 2.882 N/A PHE 304.A N LEU 300.A O no hydrogen 2.866 N/A GLU 305.A N ILE 301.A O no hydrogen 2.905 N/A LEU 306.A N ILE 301.A O no hydrogen 3.053 N/A GLY 307.A N ALA 303.A O no hydrogen 3.218 N/A ALA 308.A N GLU 302.A O no hydrogen 3.059 N/A ALA 309.A N GLY 307.A O no hydrogen 2.965 N/A GLY 310.A N TYR 295.A O no hydrogen 2.758 N/A HIS 311.A N LEU 219.A O no hydrogen 2.835 N/A ILE 312.A N TYR 293.A O no hydrogen 2.862 N/A LYS 313.A N LEU 225.A O no hydrogen 2.774 N/A VAL 314.A N GLY 291.A O no hydrogen 2.786 N/A GLU 315.A N ALA 227.A O no hydrogen 2.875 N/A TRP 318.A NE1 MET 323.A O no hydrogen 2.971 N/A ASN 319.A N GLN 289.A OE1 no hydrogen 2.771 N/A ASP 321.A N ASN 319.A OD1 no hydrogen 2.897 N/A LEU 322.A N ASN 319.A OD1 no hydrogen 3.125 N/A MET 323.A N ASN 319.A O no hydrogen 3.179 N/A