Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1l1e_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 6.A N SER 4.A OG no hydrogen 3.263 N/A PHE 7.A N SER 4.A O no hydrogen 2.977 N/A ARG 9.A N ASP 5.A O no hydrogen 2.929 N/A LEU 10.A N PHE 7.A O no hydrogen 2.994 N/A PHE 11.A N PHE 8.A O no hydrogen 2.980 N/A LEU 12.A N PHE 8.A O no hydrogen 2.984 N/A THR 15.A N ASP 13.A OD2 no hydrogen 3.101 N/A THR 15.A OG1 ASP 13.A OD1 no hydrogen 3.289 N/A THR 15.A OG1 ASP 13.A OD2 no hydrogen 2.628 N/A THR 15.A OG1 THR 17.A OG1 no hydrogen 2.948 N/A GLN 16.A N ASP 13.A O no hydrogen 2.860 N/A GLN 16.A NE2 ASP 5.A OD2 no hydrogen 3.288 N/A THR 17.A N ASP 13.A OD1 no hydrogen 3.261 N/A THR 17.A OG1 THR 15.A OG1 no hydrogen 2.948 N/A CYS 20.A SG ALA 21.A O no hydrogen 3.286 N/A CYS 20.A SG LEU 213.A O no hydrogen 3.924 N/A ALA 21.A N THR 220.A OG1 no hydrogen 3.040 N/A TYR 22.A N ALA 33.A O no hydrogen 2.804 N/A PHE 23.A N HIS 216.A ND1 no hydrogen 3.072 N/A GLU 24.A N TYR 22.A O no hydrogen 3.032 N/A ARG 25.A NE ASP 27.A OD1 no hydrogen 2.746 N/A ARG 25.A NH2 ASP 27.A OD1 no hydrogen 2.540 N/A ARG 25.A NH2 GLU 32.A OE1 no hydrogen 2.902 N/A MET 28.A N ARG 25.A O no hydrogen 3.125 N/A THR 29.A N GLU 32.A OE1 no hydrogen 3.035 N/A GLU 32.A N THR 29.A OG1 no hydrogen 3.149 N/A ALA 33.A N THR 29.A O no hydrogen 2.908 N/A GLN 34.A N LEU 30.A O no hydrogen 2.926 N/A GLN 34.A NE2 SER 19.A O no hydrogen 3.064 N/A ILE 35.A N GLN 31.A O no hydrogen 3.073 N/A ALA 36.A N GLU 32.A O no hydrogen 2.889 N/A LYS 37.A N ALA 33.A O no hydrogen 3.076 N/A LYS 37.A NZ SER 19.A OG no hydrogen 2.839 N/A LYS 37.A NZ CYS 20.A O no hydrogen 2.878 N/A LYS 37.A NZ GLN 34.A OE1 no hydrogen 2.780 N/A ILE 38.A N GLN 34.A O no hydrogen 3.073 N/A ASP 39.A N ILE 35.A O no hydrogen 3.026 N/A LEU 40.A N ALA 36.A O no hydrogen 2.956 N/A ALA 41.A N LYS 37.A O no hydrogen 2.951 N/A LEU 42.A N ILE 38.A O no hydrogen 2.945 N/A GLY 43.A N ASP 39.A O no hydrogen 2.825 N/A LYS 44.A N ALA 41.A O no hydrogen 3.187 N/A LYS 44.A NZ GLN 211.A OE1 no hydrogen 3.076 N/A LYS 44.A NZ GLN 267.A OE1 no hydrogen 2.601 N/A LEU 45.A N LEU 42.A O no hydrogen 2.984 N/A ASN 46.A ND2 GLY 43.A O no hydrogen 3.177 N/A GLY 50.A N ASP 72.A O no hydrogen 3.232 N/A MET 51.A N GLU 48.A O no hydrogen 3.199 N/A THR 52.A N ASP 116.A OD2 no hydrogen 2.881 N/A LEU 53.A N ASN 74.A O no hydrogen 2.812 N/A LEU 54.A N ARG 117.A O no hydrogen 3.105 N/A ASP 55.A N VAL 76.A O no hydrogen 2.778 N/A ILE 56.A N VAL 119.A O no hydrogen 2.948 N/A GLY 57.A N LEU 78.A O no hydrogen 2.765 N/A CYS 58.A N LEU 78.A O no hydrogen 2.931 N/A CYS 58.A SG GLY 59.A O no hydrogen 3.888 N/A CYS 58.A SG LEU 78.A O no hydrogen 3.649 N/A TRP 60.A NE1 ASN 83.A OD1 no hydrogen 2.945 N/A GLY 61.A N CYS 58.A O no hydrogen 3.067 N/A ARG 65.A N GLY 61.A O no hydrogen 2.951 N/A ARG 66.A N ALA 62.A O no hydrogen 2.970 N/A ARG 66.A NE ASP 39.A OD1 no hydrogen 2.809 N/A ARG 66.A NH2 ASP 39.A OD1 no hydrogen 3.396 N/A ARG 66.A NH2 ASP 39.A OD2 no hydrogen 2.711 N/A ALA 67.A N THR 63.A O no hydrogen 2.865 N/A ILE 68.A N MET 64.A O no hydrogen 3.031 N/A GLU 69.A N ARG 65.A O no hydrogen 3.029 N/A LYS 70.A N ARG 66.A O no hydrogen 2.760 N/A LYS 70.A NZ ASP 39.A OD2 no hydrogen 3.314 N/A TYR 71.A N ALA 67.A O no hydrogen 3.109 N/A VAL 73.A N ALA 67.A O no hydrogen 3.392 N/A ASN 74.A N MET 51.A O no hydrogen 2.773 N/A ASN 74.A ND2 MET 51.A O no hydrogen 3.143 N/A VAL 75.A N SER 100.A O no hydrogen 3.023 N/A VAL 76.A N LEU 53.A O no hydrogen 2.927 N/A GLY 77.A N ARG 102.A O no hydrogen 2.798 N/A LEU 78.A N ASP 55.A O no hydrogen 2.956 N/A THR 79.A N LEU 104.A O no hydrogen 3.174 N/A SER 81.A N THR 79.A OG1 no hydrogen 2.855 N/A GLN 84.A N SER 81.A OG no hydrogen 3.195 N/A GLN 84.A NE2 THR 79.A OG1 no hydrogen 2.869 N/A ALA 85.A N SER 81.A O no hydrogen 2.967 N/A GLY 86.A N GLU 82.A O no hydrogen 3.182 N/A HIS 87.A N ASN 83.A O no hydrogen 3.006 N/A VAL 88.A N GLN 84.A O no hydrogen 2.696 N/A GLN 89.A N ALA 85.A O no hydrogen 2.968 N/A LYS 90.A N GLY 86.A O no hydrogen 2.998 N/A MET 91.A N HIS 87.A O no hydrogen 2.976 N/A PHE 92.A N VAL 88.A O no hydrogen 2.834 N/A ASP 93.A N GLN 89.A O no hydrogen 2.804 N/A GLN 94.A N LYS 90.A O no hydrogen 3.032 N/A GLN 94.A N MET 91.A O no hydrogen 3.065 N/A MET 95.A N MET 91.A O no hydrogen 3.302 N/A ARG 99.A N THR 97.A OG1 no hydrogen 3.092 N/A ARG 99.A NE ASP 72.A O no hydrogen 2.999 N/A SER 100.A N ASN 74.A OD1 no hydrogen 3.011 N/A ARG 101.A NE PHE 92.A O no hydrogen 2.712 N/A ARG 101.A NH1 ARG 99.A O no hydrogen 2.860 N/A ARG 101.A NH2 PHE 92.A O no hydrogen 3.340 N/A ARG 102.A N VAL 75.A O no hydrogen 3.130 N/A ARG 102.A NH1 GLU 113.A OE2 no hydrogen 3.430 N/A ARG 102.A NH2 GLU 113.A OE1 no hydrogen 2.527 N/A ARG 102.A NH2 GLU 113.A OE2 no hydrogen 3.203 N/A LEU 104.A N GLY 77.A O no hydrogen 2.774 N/A GLU 106.A N LEU 104.A O no hydrogen 3.030 N/A LYS 110.A N GLY 107.A O no hydrogen 3.111 N/A PHE 111.A N TRP 108.A O no hydrogen 3.329 N/A VAL 115.A N THR 142.A O no hydrogen 3.239 N/A ASP 116.A N THR 52.A O no hydrogen 3.123 N/A ARG 117.A N THR 52.A O no hydrogen 3.388 N/A ARG 117.A NE LEU 45.A O no hydrogen 2.955 N/A ARG 117.A NH1 ASP 116.A O no hydrogen 2.933 N/A ARG 117.A NH1 ASP 146.A OD1 no hydrogen 3.331 N/A ILE 118.A N LYS 148.A O no hydrogen 3.252 N/A VAL 119.A N LEU 54.A O no hydrogen 2.937 N/A SER 120.A N LEU 150.A O no hydrogen 2.949 N/A SER 120.A OG ILE 56.A O no hydrogen 3.090 N/A GLY 122.A N HIS 152.A O no hydrogen 3.006 N/A GLU 125.A N GLU 125.A OE1 no hydrogen 2.733 N/A HIS 126.A N ALA 123.A O no hydrogen 2.840 N/A PHE 127.A N PHE 124.A O no hydrogen 3.168 N/A GLN 130.A N GLN 130.A OE1 no hydrogen 2.534 N/A ARG 131.A N GLY 128.A O no hydrogen 3.079 N/A TYR 132.A N HIS 129.A O no hydrogen 3.072 N/A HIS 134.A ND1 GLU 137.A OE1 no hydrogen 3.275 N/A PHE 135.A N ARG 131.A O no hydrogen 3.031 N/A PHE 136.A N TYR 132.A O no hydrogen 3.091 N/A GLU 137.A N HIS 133.A O no hydrogen 2.943 N/A VAL 138.A N HIS 134.A O no hydrogen 2.857 N/A THR 139.A N PHE 135.A O no hydrogen 2.937 N/A THR 139.A OG1 PHE 135.A O no hydrogen 2.836 N/A THR 139.A OG1 PHE 136.A O no hydrogen 3.255 N/A HIS 140.A N PHE 136.A O no hydrogen 2.986 N/A ARG 141.A N GLU 137.A O no hydrogen 3.088 N/A THR 142.A OG1 VAL 138.A O no hydrogen 3.291 N/A THR 142.A OG1 THR 139.A O no hydrogen 2.968 N/A GLY 147.A N PRO 144.A O no hydrogen 2.816 N/A LYS 148.A NZ ASP 146.A O no hydrogen 3.331 N/A MET 149.A N LEU 270.A O no hydrogen 2.889 N/A LEU 150.A N ILE 118.A O no hydrogen 2.945 N/A LEU 151.A N PHE 268.A O no hydrogen 2.902 N/A HIS 152.A N SER 120.A O no hydrogen 2.854 N/A THR 153.A N ASP 266.A O no hydrogen 3.005 N/A ILE 154.A N GLU 125.A OE2 no hydrogen 3.007 N/A VAL 155.A N ASP 264.A O no hydrogen 2.722 N/A ARG 156.A N PRO 191.A O no hydrogen 2.900 N/A ARG 156.A NH1 LEU 190.A O no hydrogen 3.009 N/A LYS 165.A NZ GLY 166.A O no hydrogen 2.526 N/A HIS 175.A N HIS 171.A O no hydrogen 2.994 N/A THR 177.A N LEU 173.A O no hydrogen 2.676 N/A THR 177.A OG1 LEU 173.A O no hydrogen 2.651 N/A LYS 178.A N VAL 174.A O no hydrogen 3.042 N/A PHE 179.A N HIS 175.A O no hydrogen 3.047 N/A ILE 180.A N PHE 176.A O no hydrogen 2.782 N/A LEU 181.A N THR 177.A O no hydrogen 2.840 N/A ALA 182.A N LYS 178.A O no hydrogen 2.848 N/A GLU 183.A N PHE 179.A O no hydrogen 2.873 N/A ILE 184.A N ILE 180.A O no hydrogen 2.938 N/A PHE 185.A N ILE 180.A O no hydrogen 2.867 N/A GLY 188.A N PHE 185.A O no hydrogen 2.519 N/A TRP 189.A N GLU 125.A O no hydrogen 2.828 N/A SER 192.A OG THR 195.A OG1 no hydrogen 3.166 N/A THR 195.A N SER 192.A OG no hydrogen 3.164 N/A THR 195.A OG1 SER 192.A OG no hydrogen 3.166 N/A VAL 196.A N SER 192.A O no hydrogen 3.251 N/A HIS 197.A N ILE 193.A O no hydrogen 3.113 N/A HIS 197.A ND1 GLU 201.A OE2 no hydrogen 2.922 N/A GLU 198.A N PRO 194.A O no hydrogen 2.742 N/A TYR 199.A N THR 195.A O no hydrogen 3.011 N/A ALA 200.A N VAL 196.A O no hydrogen 2.988 N/A GLU 201.A N HIS 197.A O no hydrogen 3.069 N/A LYS 202.A N GLU 198.A O no hydrogen 3.226 N/A LYS 202.A NZ GLU 198.A OE1 no hydrogen 3.010 N/A VAL 203.A N ALA 200.A O no hydrogen 3.202 N/A GLY 204.A N GLU 201.A O no hydrogen 3.177 N/A PHE 205.A N ALA 200.A O no hydrogen 3.257 N/A ARG 206.A N GLU 271.A O no hydrogen 3.030 N/A ARG 206.A NH2 GLU 271.A OE1 no hydrogen 3.248 N/A ARG 206.A NH2 LYS 272.A O no hydrogen 3.372 N/A THR 208.A N THR 269.A O no hydrogen 3.007 N/A THR 208.A OG1 THR 269.A O no hydrogen 3.466 N/A THR 208.A OG1 GLU 271.A OE2 no hydrogen 3.335 N/A GLN 211.A N GLN 267.A O no hydrogen 3.074 N/A LEU 213.A N VAL 265.A O no hydrogen 2.746 N/A GLN 214.A NE2 THR 263.A O no hydrogen 3.019 N/A HIS 216.A N LEU 213.A O no hydrogen 2.896 N/A TYR 217.A N LEU 213.A O no hydrogen 3.197 N/A TYR 217.A N GLN 214.A O no hydrogen 3.215 N/A ALA 218.A N GLN 214.A O no hydrogen 3.471 N/A ARG 219.A N LEU 215.A O no hydrogen 3.401 N/A ARG 219.A NH1 ASP 26.A O no hydrogen 3.270 N/A ARG 219.A NH2 ASP 26.A O no hydrogen 2.491 N/A THR 220.A N HIS 216.A O no hydrogen 3.107 N/A THR 220.A OG1 HIS 216.A O no hydrogen 2.655 N/A LEU 221.A N TYR 217.A O no hydrogen 2.895 N/A ASP 222.A N ALA 218.A O no hydrogen 3.010 N/A MET 223.A N ARG 219.A O no hydrogen 3.003 N/A TRP 224.A N THR 220.A O no hydrogen 2.886 N/A ALA 225.A N LEU 221.A O no hydrogen 2.985 N/A THR 226.A N ASP 222.A O no hydrogen 2.920 N/A THR 226.A OG1 ASP 222.A O no hydrogen 3.138 N/A ALA 227.A N MET 223.A O no hydrogen 3.118 N/A LEU 228.A N TRP 224.A O no hydrogen 2.985 N/A GLU 229.A N ALA 225.A O no hydrogen 2.845 N/A ALA 230.A N THR 226.A O no hydrogen 3.098 N/A ASN 231.A N ALA 227.A O no hydrogen 3.127 N/A ASN 231.A N LEU 228.A O no hydrogen 2.954 N/A LYS 232.A N GLU 229.A O no hydrogen 3.029 N/A ALA 235.A N ASN 231.A O no hydrogen 2.973 N/A ILE 236.A N LYS 232.A O no hydrogen 2.892 N/A ALA 237.A N ASP 233.A O no hydrogen 2.967 N/A ILE 238.A N GLN 234.A O no hydrogen 3.095 N/A GLN 239.A N ALA 235.A O no hydrogen 3.047 N/A GLN 241.A NE2 ASP 245.A OD1 no hydrogen 2.637 N/A GLN 241.A NE2 ASP 245.A OD2 no hydrogen 2.880 N/A VAL 243.A N SER 240.A OG no hydrogen 3.213 N/A TYR 244.A N SER 240.A O no hydrogen 3.007 N/A ASP 245.A N GLN 241.A O no hydrogen 2.810 N/A ARG 246.A N THR 242.A O no hydrogen 2.948 N/A ARG 246.A NH2 GLU 183.A O no hydrogen 3.132 N/A TYR 247.A N VAL 243.A O no hydrogen 2.923 N/A MET 248.A N TYR 244.A O no hydrogen 2.856 N/A LYS 249.A N ASP 245.A O no hydrogen 2.933 N/A TYR 250.A N ARG 246.A O no hydrogen 3.162 N/A LEU 251.A N TYR 247.A O no hydrogen 2.794 N/A THR 252.A N MET 248.A O no hydrogen 2.916 N/A THR 252.A OG1 MET 248.A O no hydrogen 3.223 N/A GLY 253.A N LYS 249.A O no hydrogen 3.099 N/A CYS 254.A N TYR 250.A O no hydrogen 2.954 N/A CYS 254.A SG TYR 250.A O no hydrogen 3.455 N/A ALA 255.A N LEU 251.A O no hydrogen 3.065 N/A LYS 256.A N THR 252.A O no hydrogen 3.381 N/A LEU 257.A N GLY 253.A O no hydrogen 3.275 N/A PHE 258.A N CYS 254.A O no hydrogen 3.101 N/A ARG 259.A N ALA 255.A O no hydrogen 3.199 N/A ARG 259.A NH1 ASP 222.A OD2 no hydrogen 2.740 N/A ARG 259.A NH2 ASP 222.A OD2 no hydrogen 2.803 N/A GLN 260.A N LYS 256.A O no hydrogen 2.897 N/A GLN 260.A NE2 LYS 256.A O no hydrogen 2.944 N/A GLY 261.A N PHE 258.A O no hydrogen 3.251 N/A TYR 262.A N LEU 257.A O no hydrogen 2.777 N/A ASP 264.A N VAL 155.A O no hydrogen 2.816 N/A VAL 265.A N ASP 264.A OD1 no hydrogen 2.605 N/A ASP 266.A N THR 153.A O no hydrogen 2.982 N/A GLN 267.A N GLN 211.A O no hydrogen 2.874 N/A GLN 267.A NE2 HIS 152.A ND1 no hydrogen 3.202 N/A PHE 268.A N LEU 151.A O no hydrogen 2.680 N/A THR 269.A N ALA 209.A O no hydrogen 2.858 N/A LEU 270.A N MET 149.A O no hydrogen 2.963 N/A GLU 271.A N ARG 206.A O no hydrogen 2.909 N/A LYS 272.A N GLY 147.A O no hydrogen 2.992 N/A LYS 272.A NZ HIS 140.A O no hydrogen 2.609 N/A LYS 272.A NZ LEU 143.A O no hydrogen 2.568 N/A