Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1k54_C.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 2.A N CYS 30.A O no hydrogen 3.108 N/A ASN 4.A N THR 32.A O no hydrogen 2.693 N/A SER 6.A N ASN 4.A OD1 no hydrogen 3.128 N/A SER 6.A OG ASN 4.A OD1 no hydrogen 2.436 N/A TRP 7.A N ASN 4.A O no hydrogen 3.142 N/A ASN 8.A N THR 5.A O no hydrogen 3.032 N/A GLU 10.A N TRP 7.A O no hydrogen 3.114 N/A PHE 11.A N ASN 8.A O no hydrogen 2.864 N/A SER 12.A N ASN 8.A O no hydrogen 2.998 N/A GLU 14.A N PHE 11.A O no hydrogen 3.239 N/A ALA 15.A N SER 12.A O no hydrogen 2.912 N/A VAL 16.A N PHE 11.A O no hydrogen 3.081 N/A VAL 19.A N ASN 213.A O no hydrogen 2.790 N/A PHE 20.A N ASN 33.A OD1 no hydrogen 2.821 N/A VAL 21.A N ALA 211.A O no hydrogen 2.870 N/A LEU 22.A N ALA 31.A O no hydrogen 2.871 N/A CYS 23.A N PHE 209.A O no hydrogen 2.863 N/A LYS 24.A N SER 29.A O no hydrogen 3.175 N/A SER 25.A N VAL 207.A O no hydrogen 2.765 N/A SER 25.A OG GLU 206.A OE1 no hydrogen 2.661 N/A SER 26.A N LYS 24.A O no hydrogen 2.845 N/A SER 27.A N GLU 146.A OE2 no hydrogen 2.961 N/A SER 27.A OG GLU 146.A OE1 no hydrogen 2.600 N/A LYS 28.A N SER 26.A OG no hydrogen 3.048 N/A SER 29.A N SER 26.A O no hydrogen 3.248 N/A CYS 30.A SG SER 27.A O no hydrogen 3.558 N/A ALA 31.A N LEU 22.A O no hydrogen 2.835 N/A THR 32.A N THR 2.A O no hydrogen 3.035 N/A THR 32.A OG1 PHE 20.A O no hydrogen 2.833 N/A THR 32.A OG1 ASP 34.A O no hydrogen 3.558 N/A ASN 33.A ND2 ASN 8.A OD1 no hydrogen 2.977 N/A ASN 33.A ND2 GLY 18.A O no hydrogen 3.284 N/A ASP 34.A N THR 32.A OG1 no hydrogen 3.344 N/A LEU 35.A N GLU 3.A OE2 no hydrogen 2.807 N/A ARG 37.A N ASP 34.A OD2 no hydrogen 2.919 N/A ARG 37.A NE ASN 213.A OD1 no hydrogen 2.963 N/A ARG 37.A NH1 ASN 213.A OD1 no hydrogen 2.975 N/A ARG 37.A NH1 ASP 215.A OD1 no hydrogen 2.863 N/A ARG 37.A NH2 ASP 215.A OD1 no hydrogen 3.266 N/A ARG 37.A NH2 ASP 215.A OD2 no hydrogen 3.320 N/A ALA 38.A N ASP 34.A O no hydrogen 2.903 N/A SER 39.A N ALA 36.A O no hydrogen 3.256 N/A SER 39.A OG.B ALA 36.A O no hydrogen 3.284 N/A LYS 40.A N ARG 37.A O no hydrogen 3.049 N/A TYR 42.A N ILE 136.A O no hydrogen 2.917 N/A ALA 45.A N TRP 129.A O no hydrogen 2.951 N/A THR 47.A N PRO 44.A O no hydrogen 3.092 N/A THR 47.A OG1 PRO 44.A O no hydrogen 2.725 N/A THR 47.A OG1 GLN 141.A OE1 no hydrogen 3.015 N/A PHE 48.A N ALA 45.A O no hydrogen 2.977 N/A LYS 49.A N SER 46.A O no hydrogen 3.023 N/A LYS 49.A NZ ALA 86.A O no hydrogen 2.838 N/A LYS 49.A NZ ILE 87.A O no hydrogen 3.326 N/A ILE 50.A N THR 47.A O no hydrogen 3.230 N/A ASN 52.A N PHE 48.A O no hydrogen 2.955 N/A ALA 53.A N LYS 49.A O no hydrogen 2.878 N/A ILE 54.A N ILE 50.A O no hydrogen 3.182 N/A ILE 55.A N PRO 51.A O no hydrogen 2.885 N/A GLY 56.A N ASN 52.A O no hydrogen 2.828 N/A LEU 57.A N ALA 53.A O no hydrogen 3.022 N/A GLU 58.A N ILE 54.A O no hydrogen 2.890 N/A THR 59.A N ILE 55.A O no hydrogen 2.897 N/A THR 59.A OG1 ILE 55.A O no hydrogen 2.839 N/A THR 59.A OG1 GLY 56.A O no hydrogen 3.374 N/A GLY 60.A N LEU 57.A O no hydrogen 3.266 N/A ILE 62.A N GLY 56.A O no hydrogen 2.824 N/A LYS 63.A N GLN 67.A OE1 no hydrogen 2.583 N/A HIS 66.A N ASN 64.A OD1 no hydrogen 2.726 N/A GLN 67.A N ASN 64.A O no hydrogen 3.260 N/A PHE 69.A N LEU 81.A O no hydrogen 2.722 N/A TRP 71.A N ASP 80.A OD2 no hydrogen 3.010 N/A TRP 77.A N MET 74.A O no hydrogen 3.293 N/A TRP 77.A NE1 SER 90.A OG no hydrogen 2.653 N/A GLU 78.A N LYS 75.A O no hydrogen 2.914 N/A LEU 81.A N PHE 69.A O no hydrogen 2.967 N/A ARG 84.A NH1 VAL 168.A O no hydrogen 2.894 N/A ARG 84.A NH2 GLU 165.A O no hydrogen 2.974 N/A ARG 84.A NH2 VAL 168.A O no hydrogen 2.945 N/A GLY 85.A N THR 82.A OG1 no hydrogen 3.032 N/A ALA 86.A N THR 82.A O no hydrogen 2.865 N/A ILE 87.A N LEU 83.A O no hydrogen 3.078 N/A GLN 88.A N ARG 84.A O no hydrogen 2.951 N/A GLN 88.A NE2 ALA 166.A O no hydrogen 2.806 N/A GLN 88.A NE2 VAL 168.A O no hydrogen 3.034 N/A VAL 89.A N GLY 85.A O no hydrogen 2.900 N/A GLN 96.A N VAL 92.A O no hydrogen 2.990 N/A GLN 96.A NE2 ASP 126.A O no hydrogen 3.618 N/A GLN 97.A N PRO 93.A O no hydrogen 2.941 N/A GLN 97.A NE2 GLU 101.A OE2 no hydrogen 2.717 N/A ILE 98.A N VAL 94.A O no hydrogen 2.966 N/A ALA 99.A N PHE 95.A O no hydrogen 2.962 N/A ARG 100.A N GLN 96.A O no hydrogen 3.096 N/A ARG 100.A NE ASP 126.A OD2 no hydrogen 3.174 N/A ARG 100.A NH1 GLN 97.A OE1 no hydrogen 2.787 N/A ARG 100.A NH2 ASP 126.A OD2 no hydrogen 3.256 N/A GLU 101.A N GLN 97.A O no hydrogen 3.068 N/A VAL 102.A N ILE 98.A O no hydrogen 2.951 N/A GLY 103.A N ALA 99.A O no hydrogen 2.983 N/A ARG 106.A NE VAL 102.A O no hydrogen 2.913 N/A ARG 106.A NH2 GLU 101.A O no hydrogen 2.961 N/A ARG 106.A NH2 VAL 102.A O no hydrogen 3.388 N/A MET 107.A N GLY 103.A O no hydrogen 2.951 N/A GLN 108.A N GLU 104.A O no hydrogen 2.869 N/A GLN 108.A NE2 GLN 119.A O no hydrogen 2.684 N/A LYS 109.A N VAL 105.A O no hydrogen 3.035 N/A TYR 110.A N ARG 106.A O no hydrogen 3.039 N/A LEU 111.A N MET 107.A O no hydrogen 3.024 N/A LYS 112.A N GLN 108.A O no hydrogen 3.097 N/A LYS 113.A N LYS 109.A O no hydrogen 3.110 N/A PHE 114.A N TYR 110.A O no hydrogen 2.815 N/A SER 115.A N LYS 112.A O no hydrogen 3.110 N/A TYR 116.A N LEU 111.A O no hydrogen 3.039 N/A ASN 118.A N ARG 135.A O no hydrogen 2.859 N/A ASN 118.A ND2 GLN 133.A O no hydrogen 2.958 N/A GLN 119.A N TYR 116.A O no hydrogen 3.173 N/A ASN 120.A N ASN 118.A OD1 no hydrogen 3.086 N/A SER 122.A N ASN 120.A OD1 no hydrogen 3.259 N/A SER 122.A OG.A ASN 120.A OD1 no hydrogen 3.239 N/A SER 122.A OG.B ASN 120.A OD1 no hydrogen 2.460 N/A LYS 127.A N GLY 124.A O no hydrogen 3.112 N/A LEU 130.A N LYS 127.A O no hydrogen 3.006 N/A GLU 131.A N LYS 127.A O no hydrogen 2.805 N/A GLN 133.A N SER 122.A O no hydrogen 3.102 N/A ARG 135.A N ASN 118.A OD1 no hydrogen 3.028 N/A ARG 135.A NH2 GLY 132.A O no hydrogen 2.841 N/A ARG 135.A NH2 LEU 134.A O no hydrogen 2.909 N/A ILE 136.A N TYR 42.A O no hydrogen 2.883 N/A VAL 139.A N ALA 38.A O no hydrogen 3.196 N/A ASN 140.A N SER 137.A OG no hydrogen 2.972 N/A ASN 140.A ND2 SER 115.A O no hydrogen 3.409 N/A GLN 141.A N SER 137.A O no hydrogen 2.903 N/A VAL 142.A N ALA 138.A O no hydrogen 3.044 N/A GLU 143.A N VAL 139.A O no hydrogen 3.025 N/A PHE 144.A N ASN 140.A O no hydrogen 2.892 N/A LEU 145.A N GLN 141.A O no hydrogen 2.870 N/A GLU 146.A N VAL 142.A O no hydrogen 2.904 N/A SER 147.A N GLU 143.A O no hydrogen 3.074 N/A SER 147.A OG GLU 143.A O no hydrogen 3.183 N/A LEU 148.A N PHE 144.A O no hydrogen 3.066 N/A TYR 149.A N LEU 145.A O no hydrogen 2.859 N/A TYR 149.A OH GLU 202.A OE2 no hydrogen 3.098 N/A LEU 150.A N GLU 146.A O no hydrogen 2.998 N/A ASN 151.A N LEU 148.A O no hydrogen 3.015 N/A LYS 152.A N SER 147.A O no hydrogen 2.818 N/A LEU 153.A N GLN 160.A OE1 no hydrogen 3.151 N/A ALA 155.A N LEU 153.A O no hydrogen 2.770 N/A SER 156.A N GLU 58.A OE2 no hydrogen 2.829 N/A SER 156.A OG GLU 58.A OE2 no hydrogen 3.416 N/A ASN 159.A N SER 156.A OG no hydrogen 3.005 N/A ASN 159.A ND2 GLU 58.A OE2 no hydrogen 2.860 N/A GLN 160.A N SER 156.A O no hydrogen 3.160 N/A GLN 160.A NE2 ASN 151.A O no hydrogen 3.129 N/A GLN 160.A NE2 ALA 155.A O no hydrogen 3.002 N/A GLN 160.A NE2 SER 156.A O no hydrogen 3.508 N/A LEU 161.A N LYS 157.A O no hydrogen 2.892 N/A ILE 162.A N GLU 158.A O no hydrogen 2.935 N/A VAL 163.A N ASN 159.A O no hydrogen 3.092 N/A LYS 164.A N GLN 160.A O no hydrogen 2.904 N/A LYS 164.A NZ LEU 148.A O no hydrogen 2.960 N/A LYS 164.A NZ TYR 149.A O no hydrogen 2.979 N/A LYS 164.A NZ ASN 151.A OD1 no hydrogen 2.604 N/A GLU 165.A N LEU 161.A O no hydrogen 3.056 N/A ALA 166.A N ILE 162.A O no hydrogen 3.300 N/A LEU 167.A N LYS 164.A O no hydrogen 2.929 N/A VAL 168.A N GLU 165.A O no hydrogen 3.226 N/A THR 169.A N VAL 177.A O no hydrogen 2.867 N/A THR 169.A OG1 SER 179.A OG no hydrogen 2.799 N/A ALA 172.A N TYR 175.A O no hydrogen 2.780 N/A TYR 175.A N ALA 172.A O no hydrogen 3.273 N/A LEU 176.A N GLU 202.A O no hydrogen 2.880 N/A VAL 177.A N GLU 170.A O no hydrogen 2.967 N/A HIS 178.A N TRP 200.A O no hydrogen 2.997 N/A HIS 178.A ND1 LYS 164.A O no hydrogen 2.930 N/A SER 179.A N LEU 167.A O no hydrogen 2.921 N/A SER 179.A OG THR 169.A OG1 no hydrogen 2.799 N/A LYS 180.A N VAL 198.A O no hydrogen 2.819 N/A LYS 180.A NZ THR 181.A O no hydrogen 2.906 N/A GLY 182.A N TRP 196.A O no hydrogen 3.112 N/A SER 184.A N VAL 194.A O no hydrogen 2.895 N/A SER 184.A OG VAL 194.A O no hydrogen 3.515 N/A GLY 187.A N ILE 216.A O no hydrogen 3.170 N/A THR 188.A N ASN 191.A O no hydrogen 2.909 N/A SER 190.A OG ASN 191.A OD1 no hydrogen 3.130 N/A ASN 191.A N THR 188.A O no hydrogen 3.029 N/A GLY 193.A N ILE 216.A O no hydrogen 2.970 N/A VAL 194.A N SER 184.A OG no hydrogen 2.899 N/A ALA 195.A N MET 214.A O no hydrogen 2.988 N/A TRP 196.A N GLY 182.A O no hydrogen 2.782 N/A TRP 196.A NE1 LEU 43.A O no hydrogen 2.679 N/A TRP 197.A N PHE 212.A O no hydrogen 2.980 N/A VAL 198.A N LYS 180.A O no hydrogen 3.026 N/A GLY 199.A N PHE 210.A O no hydrogen 3.008 N/A TRP 200.A N HIS 178.A O no hydrogen 2.866 N/A VAL 201.A N TYR 208.A O no hydrogen 2.778 N/A GLU 202.A N LEU 176.A O no hydrogen 2.824 N/A LYS 203.A N GLU 206.A O no hydrogen 2.973 N/A LYS 203.A NZ GLY 237.A O no hydrogen 2.628 N/A LYS 203.A NZ ILE 238.A O no hydrogen 2.908 N/A LYS 203.A NZ GLY 240.A O no hydrogen 2.707 N/A GLU 204.A N GLU 174.A O no hydrogen 2.919 N/A GLU 206.A N LYS 203.A O no hydrogen 2.851 N/A VAL 207.A N GLU 206.A OE1 no hydrogen 3.001 N/A TYR 208.A N VAL 201.A O no hydrogen 2.812 N/A PHE 209.A N CYS 23.A O no hydrogen 2.839 N/A PHE 210.A N GLY 199.A O no hydrogen 2.913 N/A ALA 211.A N VAL 21.A O no hydrogen 2.986 N/A PHE 212.A N TRP 197.A O no hydrogen 2.763 N/A ASN 213.A N VAL 19.A O no hydrogen 2.957 N/A MET 214.A N ALA 195.A O no hydrogen 2.961 N/A ASP 215.A N ASN 17.A O no hydrogen 2.884 N/A ILE 216.A N GLY 193.A O no hydrogen 2.891 N/A LYS 221.A N ASN 218.A O no hydrogen 2.985 N/A LYS 221.A NZ GLU 14.A O no hydrogen 3.368 N/A LEU 222.A N GLU 219.A O no hydrogen 3.319 N/A LEU 224.A N LYS 221.A O no hydrogen 3.001 N/A ARG 225.A N LEU 222.A O no hydrogen 3.096 N/A ARG 225.A NH2 GLY 182.A O no hydrogen 3.092 N/A LYS 226.A N PRO 223.A O no hydrogen 3.066 N/A SER 227.A N PRO 223.A O no hydrogen 3.156 N/A ILE 228.A N LEU 224.A O no hydrogen 2.951 N/A THR 230.A N LYS 226.A O no hydrogen 3.071 N/A THR 230.A OG1 LYS 226.A O no hydrogen 2.629 N/A LYS 231.A N SER 227.A O no hydrogen 2.954 N/A ILE 232.A N ILE 228.A O no hydrogen 3.038 N/A MET 233.A N PRO 229.A O no hydrogen 2.818 N/A GLU 234.A N THR 230.A O no hydrogen 2.783 N/A SER 235.A N LYS 231.A O no hydrogen 3.029 N/A SER 235.A OG ILE 232.A O no hydrogen 2.568 N/A GLU 236.A N ILE 232.A O no hydrogen 3.096 N/A GLU 236.A N MET 233.A O no hydrogen 3.210 N/A GLY 237.A N GLU 234.A O no hydrogen 2.903 N/A ILE 238.A N MET 233.A O no hydrogen 3.046 N/A