Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6vpi_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 2.A OH GLU 59.A OE1 no hydrogen 2.796 N/A TYR 4.A N TYR 88.A OH no hydrogen 2.742 N/A ASP 5.A N GLU 72.A OE2 no hydrogen 2.972 N/A SER 8.A OG.B TYR 88.A O no hydrogen 2.330 N/A PHE 10.A N ARG 15.A O no hydrogen 2.818 N/A SER 14.A N ASN 12.A OD1 no hydrogen 3.154 N/A SER 14.A OG ASN 12.A OD1 no hydrogen 2.973 N/A ARG 15.A NH1 GLN 43.A OE1 no hydrogen 3.157 N/A TRP 17.A N SER 8.A O no hydrogen 2.958 N/A ALA 18.A N ASP 21.A OD2 no hydrogen 2.836 N/A ASP 21.A N ALA 18.A O no hydrogen 2.905 N/A PHE 22.A N LEU 19.A O no hydrogen 3.248 N/A GLU 23.A N ARG 40.A O no hydrogen 2.753 N/A GLY 25.A N LEU 38.A O no hydrogen 2.605 N/A LEU 28.A N VAL 36.A O no hydrogen 2.697 N/A GLY 29.A N VAL 36.A O no hydrogen 3.373 N/A GLY 31.A N GLY 34.A O no hydrogen 2.732 N/A ASN 35.A ND2 TYR 37.A OH no hydrogen 2.759 N/A VAL 36.A N GLY 29.A O no hydrogen 2.979 N/A TYR 37.A N LEU 50.A O no hydrogen 2.855 N/A LEU 38.A N ARG 26.A O no hydrogen 2.956 N/A ALA 39.A N LEU 48.A O no hydrogen 2.855 N/A ARG 40.A N GLU 23.A O no hydrogen 2.877 N/A ARG 40.A NH1 LYS 45.A O no hydrogen 3.486 N/A GLU 41.A N PHE 46.A O no hydrogen 2.974 N/A LYS 42.A N ASP 21.A O no hydrogen 2.803 N/A LYS 42.A NZ GLU 20.A O no hydrogen 2.671 N/A GLN 43.A N GLU 41.A OE2 no hydrogen 2.919 N/A SER 44.A N GLU 41.A OE1 no hydrogen 2.597 N/A SER 44.A OG GLU 41.A OE1 no hydrogen 2.542 N/A PHE 46.A N SER 44.A OG no hydrogen 3.311 N/A LEU 48.A N ALA 39.A O no hydrogen 2.769 N/A ALA 49.A N LEU 99.A O no hydrogen 2.952 N/A LEU 50.A N TYR 37.A O no hydrogen 2.754 N/A LYS 51.A N LEU 97.A O no hydrogen 2.894 N/A LYS 51.A NZ GLU 70.A OE2 no hydrogen 3.197 N/A VAL 52.A N ASN 35.A O no hydrogen 2.944 N/A LEU 53.A N VAL 95.A O no hydrogen 2.783 N/A PHE 54.A N PHE 33.A O no hydrogen 3.076 N/A LYS 55.A N THR 93.A O no hydrogen 2.852 N/A LYS 55.A NZ HIS 90.A ND1 no hydrogen 2.975 N/A LYS 55.A NZ ASP 91.A O no hydrogen 2.564 N/A GLN 57.A NE2 LYS 32.A O no hydrogen 3.479 N/A LEU 58.A N PHE 54.A O no hydrogen 2.938 N/A GLU 59.A N LYS 55.A O no hydrogen 3.012 N/A LYS 60.A N ALA 56.A O no hydrogen 3.085 N/A ALA 61.A N GLN 57.A O no hydrogen 3.209 N/A GLY 62.A N GLU 59.A O no hydrogen 2.889 N/A VAL 63.A N LEU 58.A O no hydrogen 3.031 N/A LEU 67.A N VAL 63.A O no hydrogen 3.166 N/A ARG 68.A N GLU 64.A O no hydrogen 3.412 N/A ARG 69.A N HIS 65.A O no hydrogen 3.257 N/A GLU 70.A N GLN 66.A O no hydrogen 2.959 N/A VAL 71.A N LEU 67.A O no hydrogen 2.916 N/A GLU 72.A N ARG 68.A O no hydrogen 2.865 N/A ILE 73.A N ARG 69.A O no hydrogen 2.892 N/A GLN 74.A N GLU 70.A O no hydrogen 3.084 N/A GLN 74.A NE2 LEU 83.A O no hydrogen 2.893 N/A SER 75.A N VAL 71.A O no hydrogen 3.096 N/A SER 75.A OG VAL 71.A O no hydrogen 2.856 N/A SER 75.A OG GLU 72.A O no hydrogen 3.283 N/A SER 75.A OG HIS 76.A ND1 no hydrogen 3.135 N/A HIS 76.A N ILE 73.A O no hydrogen 3.279 N/A HIS 76.A ND1 GLU 72.A O no hydrogen 2.572 N/A LEU 77.A N GLN 74.A O no hydrogen 3.197 N/A ARG 78.A N TYR 135.A OH no hydrogen 2.900 N/A ARG 78.A NH1 SER 75.A O no hydrogen 2.976 N/A ASN 81.A N HIS 79.A ND1 no hydrogen 2.964 N/A ASN 81.A ND2 LEU 159.A O no hydrogen 2.947 N/A ILE 82.A N HIS 79.A O no hydrogen 3.074 N/A LEU 83.A N ILE 161.A O no hydrogen 2.836 N/A ARG 84.A N GLU 100.A OE2 no hydrogen 2.933 N/A TYR 86.A N ILE 98.A O no hydrogen 2.848 N/A TYR 88.A N PRO 7.A O no hydrogen 3.015 N/A TYR 88.A OH TYR 2.A O no hydrogen 2.898 N/A PHE 89.A N TYR 96.A O no hydrogen 3.042 N/A ASP 91.A N ARG 94.A O no hydrogen 2.960 N/A THR 93.A N ASP 91.A OD1 no hydrogen 3.191 N/A ARG 94.A N ASP 91.A OD1 no hydrogen 2.729 N/A ARG 94.A NH2 ASP 91.A OD2 no hydrogen 3.105 N/A VAL 95.A N LEU 53.A O no hydrogen 2.686 N/A TYR 96.A N PHE 89.A O no hydrogen 2.722 N/A TYR 96.A OH ASP 91.A OD2 no hydrogen 2.823 N/A LEU 97.A N LYS 51.A O no hydrogen 2.847 N/A ILE 98.A N GLY 87.A O no hydrogen 2.872 N/A LEU 99.A N ALA 49.A O no hydrogen 2.756 N/A GLU 100.A N ARG 84.A O no hydrogen 2.875 N/A LEU 104.A N LEU 153.A O no hydrogen 3.133 N/A VAL 107.A N LEU 151.A O no hydrogen 2.801 N/A TYR 108.A N PRO 148.A O no hydrogen 3.127 N/A ARG 109.A N THR 106.A OG1 no hydrogen 2.898 N/A ARG 109.A NE GLN 112.A OE1 no hydrogen 3.125 N/A ARG 109.A NH2 GLN 112.A OE1 no hydrogen 2.926 N/A GLU 110.A N THR 106.A O no hydrogen 3.182 N/A LEU 111.A N VAL 107.A O no hydrogen 2.764 N/A GLN 112.A N TYR 108.A O no hydrogen 3.001 N/A LYS 113.A N ARG 109.A O no hydrogen 2.976 N/A LEU 114.A N GLU 110.A O no hydrogen 2.944 N/A LYS 116.A N LEU 114.A O no hydrogen 2.746 N/A LYS 116.A NZ.B VAL 213.A O no hydrogen 3.570 N/A PHE 117.A N PHE 211.A O no hydrogen 2.718 N/A GLN 120.A NE2 ASN 275.A OD1 no hydrogen 2.713 N/A ARG 121.A N ASP 118.A OD1 no hydrogen 2.689 N/A ARG 121.A NH1 TYR 125.A OH no hydrogen 3.208 N/A THR 122.A N ASP 118.A O no hydrogen 2.932 N/A THR 122.A OG1 ASP 118.A O no hydrogen 2.924 N/A ALA 123.A N GLU 119.A O no hydrogen 2.854 N/A THR 124.A N GLN 120.A O no hydrogen 3.024 N/A THR 124.A OG1 GLN 120.A O no hydrogen 2.852 N/A THR 124.A OG1 SER 277.A OG.A no hydrogen 3.182 N/A TYR 125.A N ARG 121.A O no hydrogen 3.128 N/A TYR 125.A OH GLU 110.A OE1 no hydrogen 2.590 N/A TYR 125.A OH GLU 110.A OE2 no hydrogen 2.953 N/A ILE 126.A N THR 122.A O no hydrogen 2.927 N/A THR 127.A N ALA 123.A O no hydrogen 2.948 N/A THR 127.A OG1 ALA 123.A O no hydrogen 3.101 N/A THR 127.A OG1 SER 276.A OG no hydrogen 2.971 N/A GLU 128.A N THR 124.A O no hydrogen 3.061 N/A LEU 129.A N TYR 125.A O no hydrogen 2.796 N/A ALA 130.A N ILE 126.A O no hydrogen 2.708 N/A ASN 131.A N THR 127.A O no hydrogen 2.917 N/A ALA 132.A N GLU 128.A O no hydrogen 3.052 N/A LEU 133.A N LEU 129.A O no hydrogen 2.851 N/A SER 134.A N ALA 130.A O no hydrogen 2.908 N/A SER 134.A OG.B ALA 130.A O no hydrogen 2.543 N/A TYR 135.A N ASN 131.A O no hydrogen 3.215 N/A VAL 136.A N ALA 132.A O no hydrogen 2.928 N/A HIS 137.A N LEU 133.A O no hydrogen 2.751 N/A HIS 137.A NE2 ASP 200.A OD2 no hydrogen 2.811 N/A SER 138.A N SER 134.A O no hydrogen 2.941 N/A SER 138.A OG TYR 135.A O no hydrogen 2.612 N/A LYS 139.A N VAL 136.A O no hydrogen 3.095 N/A ARG 140.A N HIS 137.A O no hydrogen 2.876 N/A VAL 141.A N VAL 136.A O no hydrogen 3.314 N/A ILE 142.A N VAL 168.A O no hydrogen 2.821 N/A HIS 143.A N ASP 200.A OD2 no hydrogen 2.973 N/A HIS 143.A NE2 ALA 162.A O no hydrogen 2.871 N/A ARG 144.A N ASP 200.A OD1 no hydrogen 2.996 N/A ARG 144.A NE TRP 166.A O no hydrogen 2.870 N/A ARG 144.A NH1 ARG 174.A O no hydrogen 2.789 N/A ARG 144.A NH1 HIS 195.A NE2 no hydrogen 3.022 N/A ARG 144.A NH2 TRP 166.A O no hydrogen 3.068 N/A ASN 145.A N HIS 143.A ND1 no hydrogen 3.021 N/A LYS 147.A NZ GLU 149.A OE1 no hydrogen 3.393 N/A ASN 150.A N LYS 147.A O no hydrogen 2.899 N/A ASN 150.A ND2 ASN 145.A O no hydrogen 2.908 N/A LEU 151.A N PRO 148.A O no hydrogen 3.367 N/A LEU 152.A N LYS 160.A O no hydrogen 2.877 N/A LEU 153.A N GLY 105.A O no hydrogen 2.846 N/A GLY 154.A N GLU 158.A O no hydrogen 2.830 N/A GLY 157.A N GLY 154.A O no hydrogen 2.955 N/A GLU 158.A N GLU 158.A OE1 no hydrogen 2.515 N/A LEU 159.A N GLU 128.A OE1 no hydrogen 2.725 N/A LYS 160.A N LEU 152.A O no hydrogen 2.703 N/A LYS 160.A NZ PRO 80.A O no hydrogen 3.075 N/A LYS 160.A NZ GLU 100.A OE1 no hydrogen 2.714 N/A ILE 161.A N ASN 81.A O no hydrogen 2.844 N/A ALA 162.A N ASN 150.A O no hydrogen 2.928 N/A GLY 165.A N ASP 163.A OD1 no hydrogen 3.338 N/A SER 167.A N PHE 164.A O no hydrogen 3.121 N/A SER 167.A OG PHE 164.A O no hydrogen 2.688 N/A VAL 168.A N ILE 142.A O no hydrogen 3.117 N/A ALA 170.A N ARG 140.A O no hydrogen 2.755 N/A SER 172.A N HIS 195.A O no hydrogen 2.958 N/A ARG 174.A N SER 172.A OG no hydrogen 3.033 N/A ARG 175.A NH1 ILE 190.A O no hydrogen 2.675 N/A ARG 175.A NH2 THR 177.A O no hydrogen 3.339 N/A LEU 185.A N LEU 182.A O no hydrogen 2.971 N/A GLU 188.A N GLU 188.A OE1 no hydrogen 2.804 N/A MET 189.A N PRO 186.A O no hydrogen 3.090 N/A ILE 190.A N PRO 187.A O no hydrogen 3.072 N/A GLU 191.A N PRO 187.A O no hydrogen 2.883 N/A HIS 195.A N SER 172.A O no hydrogen 2.829 N/A HIS 195.A ND1 ARG 193.A O no hydrogen 2.790 N/A GLU 197.A N GLU 197.A OE2 no hydrogen 2.641 N/A LYS 198.A N ASP 196.A OD1 no hydrogen 3.088 N/A LYS 198.A NZ ARG 260.A O no hydrogen 2.737 N/A LYS 198.A NZ PRO 261.A O no hydrogen 3.274 N/A VAL 199.A N ASP 196.A O no hydrogen 3.066 N/A ASP 200.A N GLU 197.A O no hydrogen 3.112 N/A LEU 201.A N LYS 198.A O no hydrogen 3.069 N/A TRP 202.A N LYS 198.A O no hydrogen 3.318 N/A SER 203.A N VAL 199.A O no hydrogen 3.265 N/A SER 203.A OG VAL 199.A O no hydrogen 3.505 N/A LEU 204.A N ASP 200.A O no hydrogen 2.958 N/A GLY 205.A N LEU 201.A O no hydrogen 3.146 N/A VAL 206.A N TRP 202.A O no hydrogen 3.009 N/A LEU 207.A N SER 203.A O no hydrogen 2.946 N/A VAL 208.A N LEU 204.A O no hydrogen 3.019 N/A TYR 209.A N GLY 205.A O no hydrogen 3.223 N/A TYR 209.A OH THR 236.A O no hydrogen 2.591 N/A GLU 210.A N VAL 206.A O no hydrogen 2.966 N/A PHE 211.A N LEU 207.A O no hydrogen 2.775 N/A LEU 212.A N VAL 208.A O no hydrogen 3.201 N/A VAL 213.A N TYR 209.A O no hydrogen 2.776 N/A GLY 214.A N GLU 210.A O no hydrogen 2.715 N/A LYS 215.A NZ.A GLU 219.A OE1 no hydrogen 3.216 N/A LYS 215.A NZ.A GLU 219.A OE2 no hydrogen 3.110 N/A GLN 224.A N GLN 224.A OE1.A no hydrogen 2.519 N/A GLU 225.A N THR 222.A OG1 no hydrogen 3.026 N/A THR 226.A N THR 222.A O no hydrogen 3.190 N/A THR 226.A OG1 PHE 218.A O no hydrogen 3.438 N/A THR 226.A OG1 THR 222.A O no hydrogen 3.157 N/A TYR 227.A N TYR 223.A O no hydrogen 2.741 N/A LYS 228.A N GLN 224.A O no hydrogen 2.954 N/A ARG 229.A N GLU 225.A O no hydrogen 2.891 N/A ARG 229.A NH2 GLU 225.A OE1 no hydrogen 3.530 N/A ILE 230.A N THR 226.A O no hydrogen 3.018 N/A SER 231.A N TYR 227.A O no hydrogen 2.956 N/A SER 231.A OG.A TYR 227.A O no hydrogen 2.771 N/A SER 231.A OG.A LYS 228.A O no hydrogen 2.998 N/A ARG 232.A N LYS 228.A O no hydrogen 2.878 N/A ARG 232.A NE.B GLU 234.A OE1 no hydrogen 2.552 N/A ARG 232.A NH2.B GLU 234.A OE1 no hydrogen 2.749 N/A ARG 232.A NH2.B GLU 234.A OE2 no hydrogen 3.336 N/A VAL 233.A N ILE 230.A O no hydrogen 3.072 N/A GLU 234.A N ARG 229.A O no hydrogen 2.741 N/A VAL 241.A N PRO 238.A O no hydrogen 3.189 N/A THR 242.A OG1 GLU 119.A OE2 no hydrogen 2.470 N/A ARG 246.A N THR 242.A O no hydrogen 2.927 N/A ARG 246.A NE VAL 241.A O no hydrogen 2.814 N/A ARG 246.A NH2 VAL 241.A O no hydrogen 3.537 N/A ASP 247.A N GLU 243.A O no hydrogen 2.947 N/A LEU 248.A N GLY 244.A O no hydrogen 3.134 N/A ILE 249.A N ALA 245.A O no hydrogen 2.952 N/A SER 250.A N ARG 246.A O no hydrogen 2.941 N/A SER 250.A OG ARG 246.A O no hydrogen 2.870 N/A ARG 251.A N ASP 247.A O no hydrogen 2.979 N/A ARG 251.A NE ASP 247.A OD2 no hydrogen 2.836 N/A LEU 252.A N LEU 248.A O no hydrogen 3.122 N/A LEU 252.A N ILE 249.A O no hydrogen 3.122 N/A LEU 253.A N ILE 249.A O no hydrogen 2.912 N/A SER 258.A N ASN 256.A OD1 no hydrogen 3.115 N/A SER 258.A OG ASN 256.A OD1 no hydrogen 2.655 N/A GLN 259.A N ASN 256.A O no hydrogen 3.086 N/A ARG 260.A N PRO 257.A O no hydrogen 3.109 N/A ARG 260.A NE LYS 254.A O no hydrogen 2.818 N/A ARG 260.A NH1 LYS 198.A O no hydrogen 2.875 N/A ARG 260.A NH2 LYS 254.A O no hydrogen 2.969 N/A MET 262.A N GLU 265.A OE2 no hydrogen 3.035 N/A ARG 264.A NE GLU 268.A OE2 no hydrogen 2.880 N/A ARG 264.A NH2 GLU 268.A OE2 no hydrogen 3.325 N/A VAL 266.A N MET 262.A O no hydrogen 3.228 N/A LEU 267.A N LEU 263.A O no hydrogen 2.980 N/A GLU 268.A N ARG 264.A O no hydrogen 3.056 N/A HIS 269.A N VAL 266.A O no hydrogen 3.111 N/A HIS 269.A NE2 ASP 247.A OD2 no hydrogen 2.673 N/A TRP 271.A N HIS 269.A ND1 no hydrogen 2.968 N/A TRP 271.A NE1 GLU 119.A OE2 no hydrogen 2.866 N/A THR 273.A N HIS 269.A O no hydrogen 3.005 N/A THR 273.A OG1 HIS 269.A O no hydrogen 3.346 N/A THR 273.A OG1 PRO 270.A O no hydrogen 3.220 N/A ALA 274.A N PRO 270.A O no hydrogen 3.008 N/A ASN 275.A N ILE 272.A O no hydrogen 3.148 N/A ASN 275.A ND2 TRP 271.A O no hydrogen 2.757 N/A SER 276.A N ILE 272.A O no hydrogen 2.751 N/A SER 276.A OG THR 127.A OG1 no hydrogen 2.971 N/A SER 276.A OG LYS 278.A O no hydrogen 3.103 N/A SER 277.A N THR 124.A OG1 no hydrogen 3.152 N/A SER 277.A OG.A THR 124.A OG1 no hydrogen 3.182 N/A LYS 278.A N SER 276.A OG no hydrogen 3.050 N/A