Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2pvy_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 8.A N ASP 5.A O no hydrogen 2.849 N/A GLU 9.A N ASP 5.A O no hydrogen 3.160 N/A PHE 10.A N ALA 81.A O no hydrogen 2.772 N/A ARG 12.A NE GLN 84.A O no hydrogen 2.935 N/A ARG 12.A NH1 PRO 87.A O no hydrogen 2.918 N/A ARG 12.A NH2 GLN 84.A O no hydrogen 3.032 N/A ARG 12.A NH2 PRO 87.A O no hydrogen 2.716 N/A LYS 14.A N PRO 11.A O no hydrogen 2.972 N/A LEU 15.A N ARG 12.A O no hydrogen 2.947 N/A THR 16.A N GLU 27.A O no hydrogen 2.925 N/A GLY 18.A N MET 25.A O no hydrogen 2.582 N/A LEU 21.A N VAL 23.A O no hydrogen 2.786 N/A VAL 24.A N VAL 44.A O no hydrogen 2.849 N/A MET 25.A N LYS 19.A O no hydrogen 2.920 N/A ALA 26.A N VAL 42.A O no hydrogen 2.877 N/A GLU 27.A N THR 16.A O no hydrogen 2.870 N/A ALA 28.A N VAL 40.A O no hydrogen 2.986 N/A VAL 29.A N LYS 14.A O no hydrogen 2.879 N/A GLY 30.A N GLU 38.A O no hydrogen 2.711 N/A ASP 34.A N ASP 32.A OD1 no hydrogen 3.009 N/A LYS 35.A N ASP 32.A O no hydrogen 2.798 N/A GLU 38.A N LYS 35.A O no hydrogen 2.782 N/A VAL 40.A N ALA 28.A O no hydrogen 3.074 N/A VAL 42.A N ALA 26.A O no hydrogen 2.834 N/A ALA 43.A N VAL 92.A O no hydrogen 2.912 N/A VAL 44.A N VAL 24.A O no hydrogen 2.823 N/A LYS 45.A N VAL 90.A O no hydrogen 2.775 N/A LYS 45.A NZ GLU 62.A OE1 no hydrogen 2.852 N/A LYS 45.A NZ GLU 62.A OE2 no hydrogen 3.116 N/A MET 46.A N GLN 22.A O no hydrogen 2.918 N/A ALA 51.A N LYS 48.A O no hydrogen 3.105 N/A THR 52.A N ASP 55.A OD2 no hydrogen 2.649 N/A ASP 55.A N THR 52.A O no hydrogen 3.236 N/A ASP 55.A N THR 52.A OG1 no hydrogen 3.114 N/A LEU 56.A N THR 52.A O no hydrogen 3.369 N/A SER 57.A N GLU 53.A O no hydrogen 3.098 N/A SER 57.A OG LYS 54.A O no hydrogen 3.376 N/A ASP 58.A N LYS 54.A O no hydrogen 2.844 N/A LEU 59.A N ASP 55.A O no hydrogen 2.982 N/A VAL 60.A N LEU 56.A O no hydrogen 3.013 N/A SER 61.A N SER 57.A O no hydrogen 3.007 N/A GLU 62.A N ASP 58.A O no hydrogen 2.926 N/A MET 63.A N LEU 59.A O no hydrogen 3.001 N/A GLU 64.A N VAL 60.A O no hydrogen 2.868 N/A MET 65.A N SER 61.A O no hydrogen 2.932 N/A MET 66.A N GLU 62.A O no hydrogen 3.299 N/A LYS 67.A N MET 63.A O no hydrogen 3.271 N/A LYS 67.A NZ ASP 5.A OD1 no hydrogen 2.797 N/A LYS 67.A NZ GLU 64.A OE1 no hydrogen 2.784 N/A MET 68.A N GLU 64.A O no hydrogen 3.176 N/A ILE 69.A N MET 65.A O no hydrogen 2.885 N/A ASN 74.A N HIS 72.A ND1 no hydrogen 2.911 N/A ASN 74.A ND2 MET 164.A O no hydrogen 3.024 N/A ILE 75.A N HIS 72.A O no hydrogen 3.181 N/A ILE 76.A N ILE 166.A O no hydrogen 2.863 N/A LEU 79.A N ILE 91.A O no hydrogen 2.760 N/A GLY 80.A N ILE 91.A O no hydrogen 3.249 N/A ALA 81.A N TRP 8.A O no hydrogen 3.106 N/A CYS 82.A N TYR 89.A O no hydrogen 3.030 N/A CYS 82.A SG PHE 10.A O no hydrogen 3.268 N/A THR 83.A N GLU 9.A OE1 no hydrogen 3.041 N/A THR 83.A OG1 GLU 9.A OE2 no hydrogen 2.830 N/A GLN 84.A N GLU 9.A OE1 no hydrogen 3.320 N/A GLN 84.A NE2 LEU 2.A O no hydrogen 2.792 N/A GLN 84.A NE2 THR 83.A OG1 no hydrogen 3.166 N/A TYR 89.A N CYS 82.A O no hydrogen 3.063 N/A VAL 90.A N LYS 45.A O no hydrogen 2.805 N/A ILE 91.A N GLY 80.A O no hydrogen 2.865 N/A VAL 92.A N ALA 43.A O no hydrogen 2.846 N/A GLU 93.A N ASN 77.A O no hydrogen 2.964 N/A SER 96.A OG GLU 160.A OE1 no hydrogen 2.386 N/A LYS 97.A N VAL 158.A O no hydrogen 3.054 N/A LYS 97.A NZ GLU 120.A OE1 no hydrogen 3.117 N/A LYS 97.A NZ GLU 120.A OE2 no hydrogen 3.423 N/A LYS 97.A NZ ASN 162.A OD1 no hydrogen 3.257 N/A GLY 98.A N ALA 95.A O no hydrogen 3.270 N/A LEU 100.A N VAL 156.A O no hydrogen 2.767 N/A GLU 102.A N ASN 99.A OD1 no hydrogen 2.871 N/A TYR 103.A N ASN 99.A O no hydrogen 2.928 N/A LEU 104.A N LEU 100.A O no hydrogen 2.922 N/A ARG 105.A N ARG 101.A O no hydrogen 3.087 N/A ARG 105.A NH1 GLY 224.A O no hydrogen 3.409 N/A ALA 106.A N GLU 102.A O no hydrogen 2.911 N/A ARG 107.A N TYR 103.A O no hydrogen 3.359 N/A ARG 107.A N LEU 104.A O no hydrogen 3.064 N/A ARG 107.A NE GLU 120.A OE1 no hydrogen 3.091 N/A ARG 107.A NH1 TYR 103.A O no hydrogen 2.934 N/A ARG 107.A NH2 GLU 120.A OE1 no hydrogen 2.506 N/A ARG 108.A NE LEU 223.A O no hydrogen 2.771 N/A ARG 108.A NH2 LEU 223.A O no hydrogen 3.001 N/A ARG 116.A NH2 ARG 108.A O no hydrogen 2.843 N/A VAL 117.A N ALA 106.A O no hydrogen 3.060 N/A GLU 119.A N GLU 119.A OE1 no hydrogen 2.389 N/A GLU 120.A N VAL 117.A O no hydrogen 2.785 N/A GLN 121.A N PRO 118.A O no hydrogen 3.044 N/A MET 122.A N ARG 107.A O no hydrogen 3.109 N/A THR 123.A N ASP 126.A OD2 no hydrogen 2.563 N/A ASP 126.A N THR 123.A OG1 no hydrogen 2.939 N/A LEU 127.A N THR 123.A O no hydrogen 3.230 N/A VAL 128.A N PHE 124.A O no hydrogen 3.070 N/A SER 129.A N LYS 125.A O no hydrogen 2.864 N/A CYS 130.A N ASP 126.A O no hydrogen 2.874 N/A THR 131.A N LEU 127.A O no hydrogen 3.007 N/A THR 131.A OG1 LEU 127.A O no hydrogen 3.035 N/A TYR 132.A N VAL 128.A O no hydrogen 2.890 N/A GLN 133.A N SER 129.A O no hydrogen 2.919 N/A GLN 133.A NE2 SER 129.A O no hydrogen 3.199 N/A GLN 133.A NE2 SER 129.A OG no hydrogen 3.115 N/A GLN 133.A NE2 ASN 162.A O no hydrogen 3.496 N/A LEU 134.A N CYS 130.A O no hydrogen 3.058 N/A ALA 135.A N THR 131.A O no hydrogen 2.942 N/A ARG 136.A N TYR 132.A O no hydrogen 3.000 N/A GLY 137.A N GLN 133.A O no hydrogen 2.988 N/A MET 138.A N LEU 134.A O no hydrogen 3.003 N/A GLU 139.A N ALA 135.A O no hydrogen 2.863 N/A TYR 140.A N ARG 136.A O no hydrogen 3.109 N/A TYR 140.A OH ILE 69.A O no hydrogen 3.002 N/A LEU 141.A N GLY 137.A O no hydrogen 2.993 N/A ALA 142.A N MET 138.A O no hydrogen 2.747 N/A SER 143.A N GLU 139.A O no hydrogen 3.035 N/A SER 143.A OG TYR 140.A O no hydrogen 2.705 N/A GLN 144.A N TYR 140.A O no hydrogen 3.088 N/A GLN 144.A N LEU 141.A O no hydrogen 2.862 N/A GLN 144.A NE2 ILE 69.A O no hydrogen 3.585 N/A LYS 145.A N ALA 142.A O no hydrogen 2.714 N/A CYS 146.A N LEU 141.A O no hydrogen 3.278 N/A CYS 146.A SG GLN 144.A O no hydrogen 3.249 N/A ILE 147.A N ARG 173.A O no hydrogen 2.809 N/A HIS 148.A N ASP 209.A OD1 no hydrogen 2.718 N/A HIS 148.A NE2 ALA 167.A O no hydrogen 2.946 N/A ARG 149.A N ASP 209.A OD2 no hydrogen 3.059 N/A ARG 149.A NH1 LEU 171.A O no hydrogen 2.760 N/A ARG 149.A NH2 ASN 183.A OD1 no hydrogen 3.257 N/A ASP 150.A N HIS 148.A ND1 no hydrogen 2.984 N/A ALA 153.A N GLU 219.A OE2 no hydrogen 2.876 N/A ARG 154.A NH2 ASP 150.A OD2 no hydrogen 3.496 N/A ASN 155.A N ALA 152.A O no hydrogen 2.805 N/A VAL 156.A N ALA 153.A O no hydrogen 3.163 N/A LEU 157.A N LYS 165.A O no hydrogen 2.831 N/A VAL 158.A N GLY 98.A O no hydrogen 2.897 N/A THR 159.A N VAL 163.A O no hydrogen 3.104 N/A VAL 163.A N THR 159.A O no hydrogen 3.204 N/A MET 164.A N GLN 133.A OE1 no hydrogen 2.968 N/A LYS 165.A N LEU 157.A O no hydrogen 2.801 N/A LYS 165.A NZ LYS 73.A O no hydrogen 2.554 N/A ILE 166.A N ASN 74.A O no hydrogen 2.836 N/A ALA 167.A N ASN 155.A O no hydrogen 2.966 N/A ALA 172.A N PHE 169.A O no hydrogen 3.358 N/A ARG 173.A N ILE 147.A O no hydrogen 2.863 N/A ARG 173.A NE TYR 181.A OH no hydrogen 3.120 N/A ARG 173.A NH1 ALA 172.A O no hydrogen 2.826 N/A ILE 175.A N LYS 145.A O no hydrogen 2.869 N/A ASN 176.A N ASP 174.A OD1 no hydrogen 2.899 N/A ILE 178.A N ILE 175.A O no hydrogen 3.305 N/A TYR 181.A N TYR 204.A O no hydrogen 2.852 N/A ASN 183.A N ARG 202.A O no hydrogen 2.795 N/A ARG 188.A NH1 ASP 58.A OD1 no hydrogen 3.568 N/A ARG 188.A NH1 ASP 58.A OD2 no hydrogen 2.634 N/A ARG 188.A NH2 ASP 58.A OD1 no hydrogen 3.272 N/A LYS 192.A NZ PRO 227.A O no hydrogen 3.028 N/A LYS 192.A NZ TYR 228.A O no hydrogen 3.050 N/A LYS 192.A NZ ILE 231.A O no hydrogen 2.832 N/A TRP 193.A N PRO 190.A O no hydrogen 3.232 N/A TRP 193.A NE1 GLU 219.A OE2 no hydrogen 2.935 N/A MET 194.A N VAL 191.A O no hydrogen 2.995 N/A LEU 199.A N ALA 195.A O no hydrogen 3.060 N/A PHE 200.A N PRO 196.A O no hydrogen 2.818 N/A ASP 201.A N GLU 197.A O no hydrogen 2.790 N/A ARG 202.A N ALA 198.A O no hydrogen 3.104 N/A ARG 202.A NH1 ASN 183.A O no hydrogen 2.998 N/A VAL 203.A N GLU 197.A O no hydrogen 3.135 N/A TYR 204.A N TYR 181.A O no hydrogen 2.826 N/A TYR 204.A OH ASP 209.A OD2 no hydrogen 2.649 N/A THR 205.A N SER 208.A OG no hydrogen 2.930 N/A GLN 207.A N THR 205.A OG1 no hydrogen 3.172 N/A SER 208.A N THR 205.A O no hydrogen 2.725 N/A SER 208.A OG GLU 197.A OE1 no hydrogen 3.083 N/A ASP 209.A N THR 205.A O no hydrogen 3.334 N/A VAL 210.A N HIS 206.A O no hydrogen 2.960 N/A TRP 211.A N GLN 207.A O no hydrogen 3.198 N/A SER 212.A N SER 208.A O no hydrogen 3.215 N/A SER 212.A OG TRP 193.A O no hydrogen 2.866 N/A SER 212.A OG SER 208.A O no hydrogen 3.419 N/A PHE 213.A N ASP 209.A O no hydrogen 2.797 N/A GLY 214.A N VAL 210.A O no hydrogen 3.100 N/A VAL 215.A N TRP 211.A O no hydrogen 3.282 N/A LEU 216.A N SER 212.A O no hydrogen 2.896 N/A MET 217.A N PHE 213.A O no hydrogen 2.888 N/A TRP 218.A N GLY 214.A O no hydrogen 3.152 N/A TRP 218.A NE1 ASP 247.A O no hydrogen 3.148 N/A GLU 219.A N VAL 215.A O no hydrogen 2.996 N/A ILE 220.A N LEU 216.A O no hydrogen 2.880 N/A PHE 221.A N MET 217.A O no hydrogen 2.987 N/A THR 222.A N GLU 219.A O no hydrogen 3.331 N/A THR 222.A OG1 TRP 218.A O no hydrogen 2.715 N/A THR 222.A OG1 GLU 219.A O no hydrogen 2.892 N/A LEU 223.A N ILE 220.A O no hydrogen 2.931 N/A GLY 224.A N GLU 219.A O no hydrogen 2.686 N/A GLY 225.A N THR 222.A OG1 no hydrogen 2.876 N/A ILE 231.A N TYR 228.A O no hydrogen 3.086 N/A GLU 234.A N GLU 234.A OE1 no hydrogen 2.680 N/A GLU 235.A N PRO 232.A O no hydrogen 2.803 N/A LEU 236.A N PRO 232.A O no hydrogen 3.153 N/A LEU 236.A N VAL 233.A O no hydrogen 3.028 N/A LEU 239.A N GLU 235.A O no hydrogen 3.505 N/A LEU 240.A N LEU 236.A O no hydrogen 2.863 N/A LYS 241.A N PHE 237.A O no hydrogen 3.138 N/A GLU 242.A N LYS 238.A O no hydrogen 3.007 N/A GLU 242.A N LEU 239.A O no hydrogen 3.092 N/A GLY 243.A N LEU 240.A O no hydrogen 2.972 N/A HIS 244.A N LEU 239.A O no hydrogen 2.789 N/A ARG 245.A NE TRP 264.A O no hydrogen 2.809 N/A ARG 245.A NH1 HIS 244.A O no hydrogen 2.876 N/A ARG 245.A NH2 TRP 264.A O no hydrogen 2.841 N/A CYS 252.A SG THR 253.A O no hydrogen 3.574 N/A LEU 256.A N THR 253.A OG1 no hydrogen 3.157 N/A TYR 257.A N THR 253.A O no hydrogen 3.074 N/A TYR 257.A OH MET 246.A O no hydrogen 2.744 N/A MET 258.A N ASN 254.A O no hydrogen 2.847 N/A MET 259.A N GLU 255.A O no hydrogen 3.130 N/A MET 260.A N LEU 256.A O no hydrogen 3.099 N/A ARG 261.A N TYR 257.A O no hydrogen 2.932 N/A ARG 261.A NH1 TYR 257.A OH no hydrogen 3.147 N/A ASP 262.A N MET 258.A O no hydrogen 2.908 N/A CYS 263.A N MET 259.A O no hydrogen 3.080 N/A CYS 263.A SG VAL 210.A O no hydrogen 3.622 N/A CYS 263.A SG MET 259.A O no hydrogen 3.586 N/A TRP 264.A N MET 260.A O no hydrogen 2.999 N/A TRP 264.A N ARG 261.A O no hydrogen 2.991 N/A HIS 265.A N ASP 262.A O no hydrogen 3.209 N/A VAL 267.A N HIS 265.A ND1 no hydrogen 2.903 N/A GLN 270.A N VAL 267.A O no hydrogen 2.872 N/A ARG 271.A N PRO 268.A O no hydrogen 2.966 N/A ARG 271.A NE HIS 265.A O no hydrogen 2.685 N/A ARG 271.A NH1 GLU 197.A OE1 no hydrogen 3.010 N/A ARG 271.A NH1 GLU 197.A OE2 no hydrogen 3.496 N/A ARG 271.A NH1 GLN 207.A O no hydrogen 2.852 N/A ARG 271.A NH2 GLU 197.A OE2 no hydrogen 2.593 N/A ARG 271.A NH2 HIS 265.A O no hydrogen 3.077 N/A THR 273.A N GLN 276.A OE1 no hydrogen 2.986 N/A LYS 275.A NZ GLU 279.A OE1 no hydrogen 2.630 N/A GLN 276.A N THR 273.A OG1 no hydrogen 3.240 N/A LEU 277.A N THR 273.A O no hydrogen 2.993 N/A VAL 278.A N PHE 274.A O no hydrogen 2.988 N/A GLU 279.A N LYS 275.A O no hydrogen 3.210 N/A ASP 280.A N GLN 276.A O no hydrogen 2.894 N/A LEU 281.A N LEU 277.A O no hydrogen 2.842 N/A ASP 282.A N VAL 278.A O no hydrogen 2.844 N/A ARG 283.A N GLU 279.A O no hydrogen 3.326 N/A ARG 283.A NH1 ASP 280.A OD1 no hydrogen 2.630 N/A ILE 284.A N ASP 280.A O no hydrogen 2.921 N/A LEU 285.A N LEU 281.A O no hydrogen 2.761 N/A THR 286.A N ASP 282.A O no hydrogen 2.820 N/A THR 286.A OG1 ASP 282.A O no hydrogen 2.903 N/A THR 286.A OG1 ASP 282.A OD1 no hydrogen 3.536 N/A LEU 287.A N ARG 283.A O no hydrogen 2.912 N/A THR 288.A OG1 ILE 284.A O no hydrogen 2.983 N/A