Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6vly_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 6.A NH1 ASP 237.A OD1 no hydrogen 3.089 N/A ARG 6.A NH2 ASP 237.A OD1 no hydrogen 2.933 N/A ARG 6.A NH2 ASP 240.A OD2 no hydrogen 2.822 N/A TYR 12.A N GLU 42.A OE1 no hydrogen 3.011 N/A TYR 12.A N GLU 42.A OE2 no hydrogen 3.513 N/A LEU 14.A N GLU 42.A OE1 no hydrogen 3.092 N/A LEU 15.A N GLU 42.A O no hydrogen 2.918 N/A LYS 16.A N ASN 13.A O no hydrogen 3.280 N/A LYS 18.A N LEU 15.A O no hydrogen 2.878 N/A LYS 18.A NZ ASP 248.A OD1 no hydrogen 2.797 N/A LYS 19.A N ASP 98.A OD2 no hydrogen 2.874 N/A LYS 19.A NZ PHE 93.A O no hydrogen 2.882 N/A GLY 20.A N GLU 45.A O no hydrogen 2.902 N/A LEU 21.A N PHE 99.A O no hydrogen 2.916 N/A ILE 22.A N VAL 47.A O no hydrogen 3.037 N/A PHE 23.A N LEU 101.A O no hydrogen 2.987 N/A LEU 26.A N SER 30.A OG no hydrogen 2.969 N/A ASN 27.A N SER 30.A OG no hydrogen 3.183 N/A ASN 27.A ND2 THR 209.A OG1 no hydrogen 2.872 N/A GLN 29.A N ASN 27.A OD1 no hydrogen 2.994 N/A SER 30.A N ASN 27.A O no hydrogen 2.918 N/A SER 30.A OG ASN 27.A O no hydrogen 3.200 N/A LYS 34.A N SER 30.A O no hydrogen 3.234 N/A LYS 34.A NZ GLU 28.A O no hydrogen 3.519 N/A VAL 35.A N ILE 31.A O no hydrogen 2.942 N/A ALA 36.A N ALA 32.A O no hydrogen 2.879 N/A GLU 37.A N TRP 33.A O no hydrogen 3.012 N/A ARG 38.A N LYS 34.A O no hydrogen 2.953 N/A ARG 38.A NE ASP 240.A OD1 no hydrogen 2.881 N/A ARG 38.A NH1 GLU 41.A OE1 no hydrogen 2.950 N/A ARG 38.A NH1 GLU 42.A OE2 no hydrogen 3.460 N/A ARG 38.A NH2 GLU 42.A OE2 no hydrogen 3.462 N/A ARG 38.A NH2 ASP 240.A OD1 no hydrogen 3.091 N/A ALA 39.A N VAL 35.A O no hydrogen 2.786 N/A VAL 40.A N ALA 36.A O no hydrogen 3.135 N/A GLU 41.A N GLU 37.A O no hydrogen 2.980 N/A GLU 42.A N ARG 38.A O no hydrogen 2.970 N/A GLY 43.A N VAL 40.A O no hydrogen 3.017 N/A ALA 44.A N ALA 39.A O no hydrogen 2.923 N/A GLU 45.A N LYS 18.A O no hydrogen 2.952 N/A VAL 47.A N GLY 20.A O no hydrogen 2.863 N/A LEU 48.A N ILE 70.A O no hydrogen 3.164 N/A THR 49.A N ILE 22.A O no hydrogen 3.228 N/A THR 49.A OG1 VAL 72.A O no hydrogen 2.652 N/A ASN 50.A ND2 ALA 25.A O no hydrogen 2.904 N/A THR 51.A N ASN 50.A OD1 no hydrogen 2.917 N/A SER 54.A N THR 51.A OG1 no hydrogen 3.120 N/A SER 54.A OG THR 51.A OG1 no hydrogen 3.150 N/A ILE 55.A N THR 51.A O no hydrogen 2.886 N/A ARG 56.A N ALA 52.A O no hydrogen 3.082 N/A ARG 56.A N VAL 53.A O no hydrogen 3.273 N/A MET 57.A N VAL 53.A O no hydrogen 2.880 N/A GLY 58.A N SER 54.A O no hydrogen 2.857 N/A THR 59.A N LEU 26.A O no hydrogen 3.109 N/A THR 59.A OG1 GLU 28.A OE1 no hydrogen 3.479 N/A THR 59.A OG1 GLU 28.A OE2 no hydrogen 2.657 N/A ARG 62.A N THR 59.A O no hydrogen 2.811 N/A ALA 64.A N ILE 60.A O no hydrogen 2.780 N/A GLU 65.A N GLY 61.A O no hydrogen 3.124 N/A LYS 66.A N ARG 62.A O no hydrogen 2.972 N/A LYS 66.A NZ GLU 37.A OE2 no hydrogen 2.860 N/A CYS 67.A N LEU 63.A O no hydrogen 2.859 N/A CYS 67.A SG LEU 63.A O no hydrogen 3.469 N/A ASN 68.A N GLU 65.A O no hydrogen 3.136 N/A THR 69.A N ALA 64.A O no hydrogen 2.950 N/A THR 69.A OG1 ILE 46.A O no hydrogen 2.594 N/A ILE 70.A N THR 69.A OG1 no hydrogen 2.697 N/A VAL 72.A N LEU 48.A O no hydrogen 2.895 N/A ALA 74.A N ASN 50.A O no hydrogen 2.925 N/A ASP 75.A N ASP 81.A OD2 no hydrogen 2.960 N/A THR 77.A N ASP 75.A OD1 no hydrogen 2.885 N/A THR 77.A OG1 ASP 75.A OD1 no hydrogen 2.626 N/A SER 78.A N ASP 75.A O no hydrogen 2.889 N/A ASP 81.A N SER 78.A OG no hydrogen 3.113 N/A LEU 82.A N SER 78.A O no hydrogen 2.978 N/A GLU 83.A N VAL 79.A O no hydrogen 2.829 N/A ASN 84.A N GLU 80.A O no hydrogen 3.023 N/A LEU 85.A N ASP 81.A O no hydrogen 2.749 N/A ILE 86.A N LEU 82.A O no hydrogen 2.866 N/A ASP 87.A N GLU 83.A O no hydrogen 3.114 N/A LYS 88.A N ASN 84.A O no hydrogen 2.846 N/A LYS 88.A NZ ASN 84.A OD1 no hydrogen 3.129 N/A THR 89.A N LEU 85.A O no hydrogen 2.836 N/A THR 89.A OG1 LEU 85.A O no hydrogen 2.670 N/A MET 90.A N ILE 86.A O no hydrogen 2.901 N/A GLU 91.A N ASP 87.A O no hydrogen 2.890 N/A HIS 92.A N LYS 88.A O no hydrogen 3.064 N/A PHE 93.A N THR 89.A O no hydrogen 2.977 N/A GLY 94.A N GLU 91.A O no hydrogen 3.166 N/A GLY 95.A N MET 90.A O no hydrogen 2.682 N/A LYS 96.A NZ ASP 146.A OD1 no hydrogen 3.392 N/A LYS 96.A NZ ASP 146.A OD2 no hydrogen 3.031 N/A PHE 97.A N ALA 147.A O no hydrogen 2.902 N/A ASP 98.A N LYS 19.A O no hydrogen 2.683 N/A PHE 99.A N LYS 19.A O no hydrogen 3.135 N/A MET 100.A N SER 153.A O no hydrogen 3.073 N/A LEU 101.A N LEU 21.A O no hydrogen 2.888 N/A HIS 102.A N VAL 155.A O no hydrogen 2.757 N/A HIS 102.A NE2 SER 134.A OG no hydrogen 2.813 N/A MET 106.A N SER 131.A OG no hydrogen 2.995 N/A SER 107.A OG THR 127.A OG1 no hydrogen 3.225 N/A SER 107.A OG ASP 171.A OD1 no hydrogen 2.598 N/A SER 107.A OG ASP 171.A OD2 no hydrogen 3.334 N/A ASN 109.A ND2 ASP 120.A O no hydrogen 3.135 N/A ASN 109.A ND2 ASP 171.A OD2 no hydrogen 2.941 N/A VAL 110.A N SER 107.A OG no hydrogen 2.893 N/A ARG 111.A N SER 107.A O no hydrogen 2.910 N/A LYS 112.A N PRO 108.A O no hydrogen 2.914 N/A GLY 113.A N VAL 110.A O no hydrogen 3.054 N/A ARG 114.A N ASN 109.A O no hydrogen 2.733 N/A ARG 114.A NE ASP 118.A O no hydrogen 3.056 N/A ARG 114.A NH2 ASP 118.A O no hydrogen 3.030 N/A THR 115.A OG1 ASP 117.A OD1 no hydrogen 2.682 N/A TYR 116.A OH ASP 174.A OD2 no hydrogen 2.464 N/A ASP 118.A N THR 115.A O no hydrogen 2.917 N/A ASP 120.A N ASN 109.A OD1 no hydrogen 3.085 N/A TYR 123.A N ASP 120.A OD1 no hydrogen 2.958 N/A LEU 124.A N ASP 120.A O no hydrogen 2.902 N/A SER 125.A N TYR 121.A O no hydrogen 2.999 N/A LYS 126.A N ASP 122.A O no hydrogen 3.205 N/A THR 127.A N TYR 123.A O no hydrogen 2.735 N/A THR 127.A OG1 SER 107.A OG no hydrogen 3.225 N/A THR 127.A OG1 TYR 123.A O no hydrogen 3.082 N/A THR 127.A OG1 ASP 171.A OD2 no hydrogen 2.818 N/A LEU 128.A N LEU 124.A O no hydrogen 2.854 N/A ASP 129.A N SER 125.A O no hydrogen 2.987 N/A ILE 130.A N LYS 126.A O no hydrogen 2.910 N/A SER 131.A N THR 127.A O no hydrogen 2.928 N/A SER 131.A OG MET 106.A O no hydrogen 3.041 N/A SER 131.A OG THR 127.A O no hydrogen 3.037 N/A ALA 132.A N LEU 128.A O no hydrogen 2.997 N/A ILE 133.A N LEU 128.A O no hydrogen 2.914 N/A SER 134.A N ASP 129.A O no hydrogen 2.843 N/A SER 134.A OG HIS 102.A NE2 no hydrogen 2.813 N/A SER 134.A OG ILE 130.A O no hydrogen 2.614 N/A PHE 135.A N ALA 132.A O no hydrogen 2.864 N/A LYS 137.A N ILE 133.A O no hydrogen 2.819 N/A LYS 137.A NZ THR 77.A O no hydrogen 2.736 N/A LYS 137.A NZ ASP 129.A OD1 no hydrogen 2.766 N/A LYS 137.A NZ ASP 129.A OD2 no hydrogen 3.399 N/A ALA 138.A N SER 134.A O no hydrogen 2.958 N/A ILE 139.A N PHE 135.A O no hydrogen 3.063 N/A GLN 140.A N HIS 136.A O no hydrogen 2.828 N/A VAL 141.A N LYS 137.A O no hydrogen 2.967 N/A ALA 142.A N ALA 138.A O no hydrogen 2.976 N/A ARG 143.A N ILE 139.A O no hydrogen 2.852 N/A ARG 143.A NE GLU 193.A OE1 no hydrogen 2.810 N/A ARG 143.A NH2 GLU 193.A OE1 no hydrogen 3.299 N/A ARG 143.A NH2 GLU 193.A OE2 no hydrogen 2.597 N/A LYS 144.A N GLN 140.A O no hydrogen 2.997 N/A LYS 145.A N VAL 141.A O no hydrogen 3.131 N/A LYS 145.A N ALA 142.A O no hydrogen 3.235 N/A LYS 145.A NZ ASP 87.A OD1 no hydrogen 2.902 N/A LYS 145.A NZ ASP 87.A OD2 no hydrogen 3.343 N/A ASP 146.A N ARG 143.A O no hydrogen 2.983 N/A ALA 147.A N ALA 142.A O no hydrogen 2.940 N/A ASN 149.A N PHE 97.A O no hydrogen 2.908 N/A ASN 149.A ND2 ASP 98.A OD1 no hydrogen 2.755 N/A TRP 151.A N LYS 194.A O no hydrogen 3.018 N/A GLY 152.A N ASN 149.A O no hydrogen 3.075 N/A SER 153.A N ASP 98.A O no hydrogen 2.820 N/A SER 153.A OG LEU 245.A O no hydrogen 2.662 N/A ILE 154.A N ARG 197.A O no hydrogen 2.885 N/A VAL 155.A N MET 100.A O no hydrogen 2.912 N/A ALA 156.A N ASN 199.A O no hydrogen 3.152 N/A LEU 157.A N HIS 102.A O no hydrogen 3.189 N/A SER 158.A N VAL 201.A O no hydrogen 2.783 N/A SER 158.A OG GLU 180.A OE2 no hydrogen 2.459 N/A TYR 159.A N SER 158.A OG no hydrogen 2.788 N/A ALA 162.A N TYR 159.A O no hydrogen 3.012 N/A GLN 163.A N ILE 160.A O no hydrogen 2.791 N/A GLN 163.A NE2 GLU 180.A OE1 no hydrogen 2.569 N/A ARG 164.A N ILE 160.A O no hydrogen 2.937 N/A ARG 164.A NH1 ALA 265.A O no hydrogen 2.846 N/A ARG 164.A NH2 PHE 264.A O no hydrogen 3.473 N/A ARG 164.A NH2 ALA 265.A O no hydrogen 3.523 N/A TYR 169.A N LEU 166.A O no hydrogen 3.042 N/A ASN 170.A ND2 ARG 114.A O no hydrogen 2.885 N/A ALA 173.A N ASN 170.A O no hydrogen 3.171 N/A ALA 175.A N ASP 171.A O no hydrogen 3.059 N/A LYS 176.A N MET 172.A O no hydrogen 2.927 N/A LYS 176.A NZ LEU 157.A O no hydrogen 2.979 N/A ALA 177.A N ALA 173.A O no hydrogen 3.134 N/A LEU 178.A N ASP 174.A O no hydrogen 3.067 N/A LEU 179.A N ALA 175.A O no hydrogen 2.868 N/A GLU 180.A N LYS 176.A O no hydrogen 2.998 N/A SER 181.A N ALA 177.A O no hydrogen 3.270 N/A ILE 182.A N LEU 178.A O no hydrogen 3.113 N/A ALA 183.A N LEU 179.A O no hydrogen 3.229 N/A ARG 184.A N GLU 180.A O no hydrogen 3.458 N/A SER 185.A N SER 181.A O no hydrogen 2.857 N/A SER 185.A OG SER 181.A O no hydrogen 3.216 N/A PHE 186.A N ILE 182.A O no hydrogen 2.887 N/A GLY 187.A N ALA 183.A O no hydrogen 2.858 N/A TYR 188.A N ARG 184.A O no hydrogen 3.112 N/A TYR 190.A N PHE 186.A O no hydrogen 2.940 N/A GLY 191.A N GLY 187.A O no hydrogen 2.926 N/A ARG 192.A N TYR 188.A O no hydrogen 3.128 N/A GLU 193.A N ILE 189.A O no hydrogen 3.303 N/A LYS 194.A N TYR 190.A O no hydrogen 3.052 N/A LYS 194.A NZ ASP 146.A OD1 no hydrogen 2.914 N/A HIS 195.A N GLY 191.A O no hydrogen 2.810 N/A VAL 196.A N TYR 190.A O no hydrogen 3.367 N/A ARG 197.A N GLY 152.A O no hydrogen 2.958 N/A ARG 197.A NE LEU 245.A O no hydrogen 3.106 N/A ARG 197.A NE THR 250.A OG1 no hydrogen 3.327 N/A ARG 197.A NH1 TRP 151.A O no hydrogen 2.878 N/A ARG 197.A NH2 LEU 245.A O no hydrogen 3.097 N/A ILE 198.A N THR 254.A OG1 no hydrogen 2.967 N/A ASN 199.A N ILE 154.A O no hydrogen 3.045 N/A ASN 199.A ND2 VAL 253.A O no hydrogen 3.036 N/A THR 200.A N GLN 256.A O no hydrogen 2.919 N/A THR 200.A OG1 GLN 256.A O no hydrogen 3.497 N/A THR 200.A OG1 ASN 257.A OD1 no hydrogen 2.634 N/A VAL 201.A N ALA 156.A O no hydrogen 2.963 N/A SER 202.A N LEU 258.A O no hydrogen 2.787 N/A GLN 203.A N SER 158.A O no hydrogen 3.138 N/A GLN 203.A NE2 THR 206.A OG1 no hydrogen 2.931 N/A GLN 203.A NE2 ALA 233.A O no hydrogen 3.002 N/A GLN 203.A NE2 SER 234.A O no hydrogen 3.362 N/A SER 204.A N HIS 260.A O no hydrogen 3.186 N/A THR 206.A OG1 SER 204.A O no hydrogen 2.798 N/A GLY 211.A N THR 208.A OG1 no hydrogen 2.953 N/A SER 212.A N THR 208.A O no hydrogen 2.866 N/A SER 212.A OG THR 208.A O no hydrogen 3.523 N/A SER 212.A OG THR 209.A O no hydrogen 2.775 N/A GLY 213.A N ALA 210.A O no hydrogen 3.125 N/A VAL 214.A N GLY 211.A O no hydrogen 2.941 N/A LEU 220.A N GLY 216.A O no hydrogen 3.058 N/A MET 221.A N MET 217.A O no hydrogen 2.786 N/A ASN 222.A N GLY 218.A O no hydrogen 3.096 N/A PHE 223.A N ASP 219.A O no hydrogen 2.981 N/A ALA 224.A N LEU 220.A O no hydrogen 2.959 N/A GLU 225.A N MET 221.A O no hydrogen 2.862 N/A ASN 226.A N ASN 222.A O no hydrogen 3.077 N/A MET 227.A N PHE 223.A O no hydrogen 2.999 N/A SER 228.A N GLU 225.A O no hydrogen 3.280 N/A SER 228.A OG ALA 224.A O no hydrogen 2.700 N/A SER 228.A OG ASP 261.A O no hydrogen 3.066 N/A LEU 230.A N GLY 262.A O no hydrogen 3.012 N/A GLY 231.A N SER 228.A O no hydrogen 2.849 N/A ASN 232.A N GLU 225.A OE1 no hydrogen 2.832 N/A ASN 232.A ND2 MET 221.A O no hydrogen 2.786 N/A ALA 233.A N SER 204.A OG no hydrogen 2.850 N/A SER 234.A N ASP 237.A OD2 no hydrogen 2.987 N/A ASP 237.A N SER 234.A OG no hydrogen 2.991 N/A CYS 238.A N SER 234.A O no hydrogen 2.962 N/A ALA 239.A N ALA 235.A O no hydrogen 2.897 N/A ASP 240.A N ASN 236.A O no hydrogen 3.035 N/A TYR 241.A N ASP 237.A O no hydrogen 3.065 N/A VAL 242.A N CYS 238.A O no hydrogen 2.862 N/A LEU 243.A N ALA 239.A O no hydrogen 3.010 N/A THR 244.A N TYR 241.A O no hydrogen 3.009 N/A THR 244.A OG1 TYR 241.A O no hydrogen 2.722 N/A PHE 246.A N VAL 242.A O no hydrogen 3.036 N/A PHE 246.A N LEU 243.A O no hydrogen 3.177 N/A SER 247.A N LEU 243.A O no hydrogen 2.937 N/A SER 247.A N THR 244.A O no hydrogen 3.156 N/A SER 247.A OG THR 244.A O no hydrogen 2.730 N/A LEU 249.A N SER 247.A OG no hydrogen 3.109 N/A THR 250.A OG1 THR 244.A O no hydrogen 2.850 N/A THR 250.A OG1 LEU 245.A O no hydrogen 3.143 N/A THR 250.A OG1 SER 247.A O no hydrogen 3.273 N/A ARG 251.A N ASP 248.A O no hydrogen 3.369 N/A VAL 253.A N THR 250.A O no hydrogen 2.947 N/A THR 254.A OG1 ILE 198.A O no hydrogen 3.438 N/A MET 255.A N ILE 198.A O no hydrogen 2.777 N/A GLN 256.A N ASN 199.A OD1 no hydrogen 2.972 N/A GLN 256.A NE2 THR 254.A O no hydrogen 2.856 N/A LEU 258.A N THR 200.A O no hydrogen 2.740 N/A TYR 259.A OH GLN 163.A OE1 no hydrogen 2.591 N/A HIS 260.A N SER 202.A O no hydrogen 2.786 N/A HIS 260.A ND1 GLN 203.A OE1 no hydrogen 2.883 N/A GLY 263.A N ASP 261.A OD1 no hydrogen 2.906 N/A PHE 264.A N ASP 261.A O no hydrogen 3.195 N/A ALA 265.A N ASP 261.A OD2 no hydrogen 2.810 N/A SER 266.A N GLY 263.A O no hydrogen 2.983 N/A MET 267.A N PHE 264.A O no hydrogen 3.070 N/A SER 270.A OG ASN 226.A O no hydrogen 2.585 N/A ARG 271.A NH1 THR 276.A OG1 no hydrogen 3.092 N/A ARG 272.A NH2 SER 228.A O no hydrogen 2.846 N/A ALA 273.A N SER 270.A O no hydrogen 3.310 N/A ALA 273.A N SER 270.A OG no hydrogen 3.092 N/A MET 274.A N ARG 271.A O no hydrogen 3.075 N/A TYR 277.A N MET 274.A O no hydrogen 3.034 N/A MET 281.A N GLU 278.A O no hydrogen 3.049 N/A PHE 283.A N GLN 290.A O no hydrogen 2.778 N/A GLN 290.A NE2 PHE 283.A O no hydrogen 3.235 N/A GLN 290.A NE2 VAL 286.A O no hydrogen 3.101 N/A