Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3kmw_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 4.A N ALA 72.A O no hydrogen 2.812 N/A LYS 7.A N ASP 5.A OD1 no hydrogen 2.848 N/A GLN 8.A N ASP 5.A O no hydrogen 2.869 N/A GLN 8.A NE2 GLN 29.A OE1 no hydrogen 3.123 N/A LEU 9.A N PHE 6.A O no hydrogen 3.101 N/A ASN 10.A N ARG 27.A O no hydrogen 3.047 N/A LEU 12.A N LYS 25.A O no hydrogen 2.835 N/A THR 13.A N LYS 25.A O no hydrogen 3.128 N/A LYS 14.A NZ GLU 17.A OE1 no hydrogen 2.692 N/A LYS 14.A NZ GLU 22.A OE1 no hydrogen 2.870 N/A LEU 15.A N LEU 23.A O no hydrogen 2.685 N/A ASN 16.A N LEU 23.A O no hydrogen 3.163 N/A ASN 18.A N GLY 21.A O no hydrogen 2.944 N/A SER 20.A N ASN 18.A OD1 no hydrogen 2.951 N/A SER 20.A OG GLN 161.A OE1 no hydrogen 3.331 N/A GLY 21.A N ASN 18.A O no hydrogen 3.167 N/A GLY 21.A N ASN 18.A OD1 no hydrogen 3.337 N/A GLU 22.A N VAL 37.A O no hydrogen 2.889 N/A LEU 23.A N ASN 16.A O no hydrogen 2.922 N/A TRP 24.A N VAL 35.A O no hydrogen 2.932 N/A TRP 24.A NE1 GLU 22.A OE2 no hydrogen 2.652 N/A LYS 25.A N THR 13.A O no hydrogen 2.734 N/A GLY 26.A N ILE 33.A O no hydrogen 2.924 N/A ARG 27.A N ASN 10.A O no hydrogen 2.957 N/A ARG 27.A NE ASP 32.A OD1 no hydrogen 3.310 N/A TRP 28.A N ASN 31.A O no hydrogen 3.049 N/A ASN 31.A N TRP 28.A O no hydrogen 2.903 N/A ASN 31.A ND2 TRP 28.A O no hydrogen 3.100 N/A ILE 33.A N GLY 26.A O no hydrogen 2.890 N/A VAL 34.A N THR 85.A O no hydrogen 2.869 N/A VAL 35.A N TRP 24.A O no hydrogen 2.790 N/A LYS 36.A N LEU 83.A O no hydrogen 2.738 N/A VAL 37.A N GLU 22.A O no hydrogen 2.860 N/A LEU 38.A N PRO 81.A O no hydrogen 2.854 N/A LYS 39.A N SER 20.A O no hydrogen 2.978 N/A LYS 39.A NZ ASN 18.A O no hydrogen 3.118 N/A TRP 43.A NE1 SER 75.A O no hydrogen 2.999 N/A LYS 47.A N SER 44.A OG no hydrogen 3.123 N/A LYS 47.A NZ ARG 41.A O no hydrogen 3.226 N/A LYS 47.A NZ ASP 42.A O no hydrogen 3.073 N/A SER 48.A N SER 44.A O no hydrogen 2.955 N/A SER 48.A OG SER 75.A O no hydrogen 2.735 N/A ARG 49.A N THR 45.A O no hydrogen 2.802 N/A ARG 49.A NE ASP 50.A OD1 no hydrogen 2.895 N/A ARG 49.A NH2 ASP 50.A OD1 no hydrogen 2.972 N/A ASP 50.A N ARG 46.A O no hydrogen 2.973 N/A PHE 51.A N LYS 47.A O no hydrogen 2.793 N/A ASN 52.A N SER 48.A O no hydrogen 3.097 N/A GLU 53.A N ARG 49.A O no hydrogen 3.007 N/A GLU 54.A N ASP 50.A O no hydrogen 2.829 N/A CYS 55.A N PHE 51.A O no hydrogen 3.025 N/A CYS 55.A SG PHE 51.A O no hydrogen 3.382 N/A ARG 57.A NH1 PRO 129.A O no hydrogen 3.132 N/A ARG 57.A NH1 LEU 130.A O no hydrogen 3.292 N/A ARG 57.A NH2 PRO 129.A O no hydrogen 3.043 N/A LEU 58.A N CYS 55.A O no hydrogen 2.923 N/A ARG 59.A N PRO 56.A O no hydrogen 3.212 N/A ARG 59.A NE LEU 70.A O no hydrogen 3.019 N/A ASN 65.A ND2 ALA 149.A O no hydrogen 2.996 N/A VAL 66.A N HIS 63.A O no hydrogen 3.036 N/A LEU 67.A N ILE 151.A O no hydrogen 2.868 N/A VAL 69.A N LEU 58.A O no hydrogen 2.918 N/A LEU 70.A N ILE 84.A O no hydrogen 2.842 N/A CYS 73.A N THR 82.A O no hydrogen 2.708 N/A CYS 73.A SG ILE 4.A O no hydrogen 3.513 N/A SER 75.A OG ALA 78.A O no hydrogen 2.902 N/A ALA 78.A N GLN 74.A O no hydrogen 2.846 N/A THR 82.A N CYS 73.A O no hydrogen 3.404 N/A THR 82.A OG1 HIS 80.A O no hydrogen 2.842 N/A LEU 83.A N LYS 36.A O no hydrogen 2.885 N/A ILE 84.A N GLY 71.A O no hydrogen 2.996 N/A THR 85.A N VAL 34.A O no hydrogen 3.201 N/A THR 85.A OG1 PRO 68.A O no hydrogen 2.770 N/A HIS 86.A NE2 ASN 31.A OD1 no hydrogen 2.974 N/A TRP 87.A N ASP 32.A O no hydrogen 2.951 N/A GLY 91.A N MET 88.A O no hydrogen 3.040 N/A LEU 93.A N VAL 141.A O no hydrogen 2.969 N/A TYR 94.A N SER 138.A O no hydrogen 2.897 N/A ASN 95.A N SER 92.A OG no hydrogen 2.943 N/A VAL 96.A N SER 92.A O no hydrogen 2.984 N/A LEU 97.A N LEU 93.A O no hydrogen 2.904 N/A HIS 98.A N TYR 94.A O no hydrogen 2.929 N/A GLU 99.A N ASN 95.A O no hydrogen 2.725 N/A THR 101.A N GLU 99.A O no hydrogen 3.259 N/A GLN 107.A NE2 LEU 201.A O no hydrogen 3.033 N/A GLN 109.A N ASP 106.A OD1 no hydrogen 2.752 N/A ALA 110.A N ASP 106.A O no hydrogen 2.877 N/A VAL 111.A N GLN 107.A O no hydrogen 2.824 N/A LYS 112.A N SER 108.A O no hydrogen 3.008 N/A LYS 112.A NZ ASP 116.A OD1 no hydrogen 2.921 N/A PHE 113.A N GLN 109.A O no hydrogen 2.857 N/A ALA 114.A N ALA 110.A O no hydrogen 2.940 N/A LEU 115.A N VAL 111.A O no hydrogen 2.962 N/A ASP 116.A N LYS 112.A O no hydrogen 2.808 N/A MET 117.A N PHE 113.A O no hydrogen 2.953 N/A ALA 118.A N ALA 114.A O no hydrogen 2.867 N/A ARG 119.A N LEU 115.A O no hydrogen 2.899 N/A ARG 119.A NH2 GLU 263.A OE2 no hydrogen 3.002 N/A GLY 120.A N ASP 116.A O no hydrogen 2.959 N/A MET 121.A N MET 117.A O no hydrogen 2.905 N/A ALA 122.A N ALA 118.A O no hydrogen 2.897 N/A PHE 123.A N ARG 119.A O no hydrogen 3.134 N/A LEU 124.A N GLY 120.A O no hydrogen 3.012 N/A HIS 125.A N MET 121.A O no hydrogen 2.816 N/A HIS 125.A NE2 ASP 190.A OD2 no hydrogen 2.756 N/A THR 126.A N PHE 123.A O no hydrogen 2.901 N/A THR 126.A OG1 PHE 123.A O no hydrogen 2.506 N/A LEU 127.A N LEU 124.A O no hydrogen 3.063 N/A ARG 133.A NE LYS 157.A O no hydrogen 3.004 N/A ASN 137.A N SER 140.A OG no hydrogen 3.145 N/A SER 138.A OG GLU 200.A OE1 no hydrogen 3.363 N/A SER 138.A OG GLU 200.A OE2 no hydrogen 2.546 N/A SER 140.A N ASN 137.A O no hydrogen 3.027 N/A SER 140.A OG ALA 135.A O no hydrogen 2.819 N/A SER 140.A OG ASN 137.A O no hydrogen 3.263 N/A SER 140.A OG ASN 137.A OD1 no hydrogen 3.092 N/A MET 142.A N ARG 150.A O no hydrogen 2.791 N/A ILE 143.A N GLY 91.A O no hydrogen 2.818 N/A ASP 144.A N THR 148.A O no hydrogen 2.977 N/A GLU 145.A N ASP 144.A OD1 no hydrogen 2.823 N/A MET 147.A N ASP 144.A O no hydrogen 2.900 N/A THR 148.A N ASP 146.A OD1 no hydrogen 3.200 N/A THR 148.A OG1 ASP 146.A OD1 no hydrogen 2.550 N/A ALA 149.A N ASP 116.A OD2 no hydrogen 2.884 N/A ARG 150.A N MET 142.A O no hydrogen 2.811 N/A ARG 150.A NE PRO 64.A O no hydrogen 2.993 N/A ARG 150.A NH1 ASP 144.A OD2 no hydrogen 3.059 N/A ARG 150.A NH2 VAL 66.A O no hydrogen 2.951 N/A ILE 151.A N ASN 65.A O no hydrogen 2.873 N/A SER 152.A N SER 140.A O no hydrogen 2.902 N/A SER 152.A OG ASP 155.A OD2 no hydrogen 2.548 N/A MET 153.A N LEU 67.A O no hydrogen 3.257 N/A ASP 155.A N SER 152.A O no hydrogen 2.909 N/A VAL 156.A N MET 153.A O no hydrogen 3.228 N/A LYS 157.A N ARG 133.A O no hydrogen 3.384 N/A LYS 157.A NZ ASP 155.A O no hydrogen 3.086 N/A SER 159.A N GLU 54.A OE1 no hydrogen 2.912 N/A SER 159.A OG GLU 54.A OE1 no hydrogen 3.474 N/A SER 159.A OG GLU 54.A OE2 no hydrogen 2.526 N/A GLN 161.A N PHE 158.A O no hydrogen 2.886 N/A ARG 165.A N SER 162.A O no hydrogen 3.392 N/A ARG 165.A NH1 TYR 167.A OH no hydrogen 2.852 N/A TRP 171.A N ALA 168.A O no hydrogen 3.465 N/A TRP 171.A NE1 GLU 200.A OE1 no hydrogen 2.822 N/A VAL 172.A N PRO 169.A O no hydrogen 3.118 N/A GLU 175.A N GLU 175.A OE1 no hydrogen 2.842 N/A ALA 176.A N ALA 173.A O no hydrogen 2.907 N/A LEU 177.A N PRO 174.A O no hydrogen 3.171 N/A GLN 178.A N GLU 175.A O no hydrogen 3.228 N/A GLN 178.A NE2 PRO 174.A O no hydrogen 3.004 N/A LYS 179.A N GLU 175.A O no hydrogen 2.801 N/A LYS 179.A NZ ASP 183.A O no hydrogen 2.917 N/A GLU 182.A N GLU 182.A OE1 no hydrogen 2.484 N/A ASP 183.A N LYS 180.A O no hydrogen 2.845 N/A THR 184.A N PRO 181.A O no hydrogen 3.012 N/A THR 184.A OG1 LYS 180.A O no hydrogen 3.147 N/A ARG 187.A NE HIS 125.A O no hydrogen 2.994 N/A ARG 187.A NH2 HIS 125.A O no hydrogen 3.110 N/A SER 188.A N ASN 185.A OD1 no hydrogen 2.977 N/A SER 188.A OG PRO 249.A O no hydrogen 3.245 N/A ALA 189.A N ASN 185.A O no hydrogen 3.158 N/A ASP 190.A N ARG 186.A O no hydrogen 2.986 N/A MET 191.A N ARG 187.A O no hydrogen 3.219 N/A TRP 192.A N SER 188.A O no hydrogen 3.211 N/A SER 193.A N ALA 189.A O no hydrogen 3.309 N/A SER 193.A OG TRP 171.A O no hydrogen 2.649 N/A SER 193.A OG ALA 189.A O no hydrogen 3.430 N/A PHE 194.A N ASP 190.A O no hydrogen 3.020 N/A ALA 195.A N MET 191.A O no hydrogen 2.899 N/A VAL 196.A N TRP 192.A O no hydrogen 3.079 N/A LEU 197.A N SER 193.A O no hydrogen 2.992 N/A LEU 198.A N PHE 194.A O no hydrogen 2.856 N/A TRP 199.A N ALA 195.A O no hydrogen 3.091 N/A TRP 199.A NE1 THR 228.A O no hydrogen 2.814 N/A GLU 200.A N VAL 196.A O no hydrogen 2.855 N/A LEU 201.A N LEU 197.A O no hydrogen 2.887 N/A VAL 202.A N LEU 198.A O no hydrogen 2.858 N/A THR 203.A N TRP 199.A O no hydrogen 2.843 N/A THR 203.A OG1 TRP 199.A O no hydrogen 2.916 N/A ARG 204.A N GLU 200.A O no hydrogen 2.803 N/A ARG 204.A NE LEU 201.A O no hydrogen 2.890 N/A ARG 204.A NH1 VAL 105.A O no hydrogen 2.776 N/A ARG 204.A NH2 VAL 105.A O no hydrogen 2.902 N/A ARG 204.A NH2 GLN 107.A OE1 no hydrogen 2.834 N/A GLU 205.A N THR 203.A OG1 no hydrogen 3.187 N/A ALA 209.A N VAL 206.A O no hydrogen 3.210 N/A ASP 210.A N ASP 210.A OD1 no hydrogen 2.480 N/A LEU 211.A N PHE 208.A O no hydrogen 2.991 N/A SER 212.A N GLU 215.A OE2 no hydrogen 3.050 N/A SER 212.A OG GLU 215.A OE2 no hydrogen 2.812 N/A GLU 215.A N SER 212.A OG no hydrogen 3.195 N/A ILE 216.A N SER 212.A O no hydrogen 3.097 N/A GLY 217.A N ASN 213.A O no hydrogen 3.026 N/A MET 218.A N MET 214.A O no hydrogen 3.149 N/A LYS 219.A N GLU 215.A O no hydrogen 3.184 N/A VAL 220.A N ILE 216.A O no hydrogen 2.846 N/A ALA 221.A N GLY 217.A O no hydrogen 2.881 N/A LEU 222.A N MET 218.A O no hydrogen 2.732 N/A GLU 223.A N LYS 219.A O no hydrogen 2.852 N/A LEU 225.A N LYS 219.A O no hydrogen 2.964 N/A ARG 226.A NE GLU 247.A OE1 no hydrogen 3.364 N/A ARG 226.A NE GLU 247.A OE2 no hydrogen 2.561 N/A ARG 226.A NH1 VAL 220.A O no hydrogen 3.038 N/A ARG 226.A NH1 LEU 225.A O no hydrogen 2.717 N/A ARG 226.A NH2 GLU 247.A OE1 no hydrogen 2.870 N/A VAL 237.A N SER 234.A OG no hydrogen 3.034 N/A SER 238.A N SER 234.A O no hydrogen 2.838 N/A LYS 239.A N PRO 235.A O no hydrogen 2.775 N/A LEU 240.A N HIS 236.A O no hydrogen 3.119 N/A MET 241.A N VAL 237.A O no hydrogen 2.823 N/A LYS 242.A N SER 238.A O no hydrogen 2.971 N/A ILE 243.A N LYS 239.A O no hydrogen 2.926 N/A CYS 244.A N LEU 240.A O no hydrogen 3.059 N/A CYS 244.A SG LEU 240.A O no hydrogen 3.359 N/A MET 245.A N MET 241.A O no hydrogen 3.110 N/A ASN 246.A N ILE 243.A O no hydrogen 3.366 N/A ASP 248.A N ASN 246.A OD1 no hydrogen 3.077 N/A ALA 250.A N ASP 248.A OD1 no hydrogen 3.239 N/A LYS 251.A N ASP 248.A O no hydrogen 2.942 N/A ARG 252.A N PRO 249.A O no hydrogen 3.192 N/A ARG 252.A NE ASN 246.A O no hydrogen 2.820 N/A ARG 252.A NH1 GLU 175.A OE2 no hydrogen 2.787 N/A ARG 252.A NH1 SER 188.A O no hydrogen 3.001 N/A ARG 252.A NH2 GLU 175.A OE1 no hydrogen 3.074 N/A ARG 252.A NH2 ASN 246.A O no hydrogen 3.166 N/A MET 257.A N LYS 254.A O no hydrogen 3.090 N/A ILE 258.A N LYS 254.A O no hydrogen 3.309 N/A VAL 259.A N PHE 255.A O no hydrogen 3.049 N/A LEU 262.A N ILE 258.A O no hydrogen 2.914 N/A GLU 263.A N VAL 259.A O no hydrogen 2.828 N/A LYS 264.A N PRO 260.A O no hydrogen 3.179 N/A LYS 264.A NZ PRO 260.A O no hydrogen 3.537 N/A MET 265.A N ILE 261.A O no hydrogen 3.204 N/A MET 265.A N LEU 262.A O no hydrogen 2.974 N/A GLN 266.A N GLU 263.A O no hydrogen 3.093 N/A GLN 266.A NE2 VAL 111.A O no hydrogen 3.378 N/A GLN 266.A NE2 LEU 262.A O no hydrogen 2.875 N/A