Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5bsh_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 8.A N PRO 5.A O no hydrogen 3.318 N/A THR 10.A N ASN 71.A OD1 no hydrogen 2.668 N/A THR 10.A OG1 ASP 69.A O no hydrogen 2.771 N/A THR 10.A OG1 ASN 71.A OD1 no hydrogen 3.077 N/A LEU 11.A N ARG 37.A O no hydrogen 2.874 N/A GLY 12.A N VAL 72.A O no hydrogen 2.775 N/A PHE 13.A N LYS 39.A O no hydrogen 2.881 N/A ILE 14.A N VAL 74.A O no hydrogen 2.859 N/A GLU 21.A N GLY 17.A O no hydrogen 3.004 N/A SER 22.A N LYS 18.A O no hydrogen 2.821 N/A SER 22.A OG LYS 18.A O no hydrogen 3.155 N/A ILE 23.A N MET 19.A O no hydrogen 2.894 N/A ALA 24.A N ALA 20.A O no hydrogen 2.869 N/A LYS 25.A N GLU 21.A O no hydrogen 2.865 N/A GLY 26.A N SER 22.A O no hydrogen 2.906 N/A ALA 27.A N ILE 23.A O no hydrogen 2.857 N/A VAL 28.A N ALA 24.A O no hydrogen 3.031 N/A ARG 29.A N LYS 25.A O no hydrogen 2.820 N/A SER 30.A N GLY 26.A O no hydrogen 3.061 N/A SER 30.A OG GLY 26.A O no hydrogen 3.170 N/A SER 30.A OG ALA 27.A O no hydrogen 3.388 N/A GLY 31.A N VAL 28.A O no hydrogen 2.821 N/A LEU 33.A N ALA 27.A O no hydrogen 3.260 N/A SER 34.A OG SER 36.A OG no hydrogen 2.965 N/A SER 36.A OG SER 34.A OG no hydrogen 2.965 N/A ARG 37.A N SER 34.A O no hydrogen 2.800 N/A ARG 37.A NE TYR 9.A O no hydrogen 2.849 N/A ARG 37.A NH2 TYR 9.A O no hydrogen 2.933 N/A ILE 38.A N PRO 35.A O no hydrogen 3.121 N/A LYS 39.A N LEU 11.A O no hydrogen 2.997 N/A LYS 39.A NZ SER 36.A O no hydrogen 3.036 N/A LYS 39.A NZ ILE 38.A O no hydrogen 3.191 N/A THR 40.A N THR 58.A O no hydrogen 3.390 N/A THR 40.A OG1 PHE 13.A O no hydrogen 2.933 N/A ALA 47.A N ASN 45.A OD1 no hydrogen 2.734 N/A ARG 48.A NE ALA 16.A O no hydrogen 2.738 N/A ARG 48.A NH2 ALA 16.A O no hydrogen 3.530 N/A ARG 48.A NH2 GLU 21.A OE1 no hydrogen 2.654 N/A ARG 49.A N PRO 46.A O no hydrogen 3.318 N/A ARG 49.A NH1 GLU 53.A OE2 no hydrogen 3.081 N/A GLU 53.A N ARG 49.A O no hydrogen 2.926 N/A SER 54.A N THR 50.A O no hydrogen 2.751 N/A SER 54.A OG THR 50.A O no hydrogen 3.278 N/A SER 54.A OG ALA 51.A O no hydrogen 3.136 N/A ILE 55.A N PHE 52.A O no hydrogen 3.186 N/A GLY 56.A N GLU 53.A O no hydrogen 2.793 N/A ILE 57.A N PHE 52.A O no hydrogen 3.111 N/A LEU 60.A N THR 40.A O no hydrogen 2.821 N/A ASP 65.A N SER 62.A OG no hydrogen 3.259 N/A VAL 66.A N SER 62.A O no hydrogen 3.390 N/A VAL 67.A N ASN 63.A O no hydrogen 3.040 N/A ARG 68.A N ASP 64.A O no hydrogen 3.009 N/A ARG 68.A NE ASP 65.A OD1 no hydrogen 3.084 N/A ASP 69.A N ASP 65.A O no hydrogen 3.112 N/A SER 70.A N VAL 67.A O no hydrogen 2.980 N/A SER 70.A OG VAL 66.A O no hydrogen 2.627 N/A ASN 71.A N THR 10.A OG1 no hydrogen 3.119 N/A VAL 72.A N THR 10.A O no hydrogen 3.096 N/A VAL 73.A N LEU 98.A O no hydrogen 2.899 N/A VAL 74.A N GLY 12.A O no hydrogen 2.794 N/A PHE 75.A N VAL 100.A O no hydrogen 2.777 N/A SER 76.A N ILE 14.A O no hydrogen 2.840 N/A LEU 81.A N LYS 78.A O no hydrogen 2.938 N/A LEU 82.A N PRO 79.A O no hydrogen 3.101 N/A VAL 85.A N LEU 81.A O no hydrogen 3.127 N/A VAL 86.A N LEU 82.A O no hydrogen 2.838 N/A LEU 87.A N LYS 83.A O no hydrogen 2.950 N/A LYS 88.A N ASP 84.A O no hydrogen 2.997 N/A LEU 89.A N VAL 85.A O no hydrogen 3.194 N/A LYS 90.A N LEU 87.A O no hydrogen 3.241 N/A LEU 92.A N LEU 89.A O no hydrogen 2.986 N/A LEU 93.A N LYS 90.A O no hydrogen 2.986 N/A THR 94.A N LEU 92.A O no hydrogen 2.908 N/A THR 94.A OG1 ASP 96.A OD1 no hydrogen 2.443 N/A LYS 97.A N THR 94.A O no hydrogen 2.915 N/A LYS 97.A NZ VAL 67.A O no hydrogen 2.893 N/A LYS 97.A NZ ARG 68.A O no hydrogen 3.072 N/A LYS 97.A NZ SER 70.A O no hydrogen 2.866 N/A LEU 98.A N ASN 71.A O no hydrogen 3.004 N/A LEU 99.A N ARG 119.A O no hydrogen 3.110 N/A VAL 100.A N VAL 73.A O no hydrogen 2.806 N/A SER 101.A N ILE 121.A O no hydrogen 2.838 N/A VAL 102.A N PHE 75.A O no hydrogen 3.078 N/A ALA 103.A N SER 101.A OG no hydrogen 3.113 N/A MET 108.A N ASP 167.A OD2 no hydrogen 3.017 N/A LYS 109.A NZ GLU 113.A OE2 no hydrogen 3.028 N/A ASP 110.A N LYS 107.A O no hydrogen 3.183 N/A LEU 111.A N LYS 107.A O no hydrogen 3.112 N/A GLN 112.A N MET 108.A O no hydrogen 2.953 N/A GLU 113.A N LYS 109.A O no hydrogen 3.178 N/A TRP 114.A N ASP 110.A O no hydrogen 2.933 N/A ALA 115.A N LEU 111.A O no hydrogen 3.020 N/A GLY 116.A N GLN 112.A O no hydrogen 2.854 N/A ARG 119.A N HIS 117.A ND1 no hydrogen 3.150 N/A ARG 119.A NE ASP 148.A OD2 no hydrogen 2.875 N/A ARG 119.A NH1 ILE 2.A O no hydrogen 3.017 N/A ARG 119.A NH1 LYS 95.A O no hydrogen 3.127 N/A ARG 119.A NH2 ILE 2.A O no hydrogen 3.153 N/A ARG 119.A NH2 ASP 148.A OD1 no hydrogen 2.770 N/A ARG 119.A NH2 ASP 148.A OD2 no hydrogen 3.453 N/A ILE 121.A N LEU 99.A O no hydrogen 2.762 N/A ARG 122.A N SER 139.A O no hydrogen 2.921 N/A ARG 122.A NH1 ASP 167.A OD1 no hydrogen 3.052 N/A VAL 123.A N SER 101.A O no hydrogen 2.792 N/A MET 124.A N.A VAL 137.A O no hydrogen 2.846 N/A MET 124.A N.B VAL 137.A O no hydrogen 2.835 N/A ASN 126.A ND2 SER 177.A O no hydrogen 2.899 N/A ALA 128.A N ASN 126.A OD1 no hydrogen 3.316 N/A ALA 129.A N ASN 126.A O no hydrogen 3.214 N/A THR 130.A N THR 127.A O no hydrogen 3.374 N/A THR 130.A OG1 THR 127.A O no hydrogen 3.506 N/A VAL 131.A N ALA 128.A O no hydrogen 3.056 N/A GLY 132.A N ALA 129.A O no hydrogen 2.918 N/A GLU 133.A N ALA 128.A O no hydrogen 2.927 N/A ALA 134.A N ILE 159.A O no hydrogen 2.832 N/A ALA 135.A N ASN 126.A OD1 no hydrogen 3.138 N/A SER 136.A N LYS 161.A O no hydrogen 2.981 N/A VAL 137.A N MET 124.A O.A no hydrogen 3.098 N/A VAL 137.A N MET 124.A O.B no hydrogen 3.094 N/A MET 138.A N TRP 163.A O no hydrogen 2.790 N/A SER 139.A N ARG 122.A O no hydrogen 2.812 N/A SER 139.A OG ASP 167.A OD1 no hydrogen 2.861 N/A GLY 141.A N PHE 120.A O no hydrogen 2.705 N/A GLY 142.A N GLN 112.A OE1 no hydrogen 2.848 N/A ALA 143.A N GLU 118.A O no hydrogen 2.851 N/A ALA 144.A N GLY 141.A O no hydrogen 3.179 N/A THR 145.A N ASP 148.A OD2 no hydrogen 3.016 N/A ASP 148.A N THR 145.A OG1 no hydrogen 2.882 N/A ALA 149.A N THR 145.A O no hydrogen 2.942 N/A ASN 150.A N GLU 146.A O no hydrogen 2.835 N/A LEU 151.A N GLU 147.A O no hydrogen 2.987 N/A ILE 152.A N ASP 148.A O no hydrogen 3.005 N/A SER 153.A N ALA 149.A O no hydrogen 2.758 N/A SER 153.A OG ALA 149.A O no hydrogen 3.177 N/A GLN 154.A N ASN 150.A O no hydrogen 2.988 N/A LEU 155.A N LEU 151.A O no hydrogen 3.027 N/A PHE 156.A N ILE 152.A O no hydrogen 2.892 N/A GLY 157.A N SER 153.A O no hydrogen 2.689 N/A SER 158.A N LEU 155.A O no hydrogen 3.291 N/A SER 158.A OG LEU 155.A O no hydrogen 2.822 N/A ILE 159.A N PHE 156.A O no hydrogen 3.224 N/A LYS 161.A N ALA 134.A O no hydrogen 2.899 N/A TRP 163.A N SER 136.A O no hydrogen 2.955 N/A ALA 165.A N MET 138.A O no hydrogen 2.877 N/A TYR 169.A N ASP 166.A O no hydrogen 2.982 N/A PHE 170.A N ASP 167.A O no hydrogen 3.091 N/A ILE 173.A N TYR 169.A O no hydrogen 2.968 N/A THR 174.A N PHE 170.A O no hydrogen 2.925 N/A THR 174.A OG1 PHE 170.A O no hydrogen 2.749 N/A GLY 175.A N ASP 171.A O no hydrogen 3.250 N/A LEU 176.A N ALA 172.A O no hydrogen 3.200 N/A LEU 176.A N ILE 173.A O no hydrogen 3.026 N/A SER 177.A N ILE 173.A O no hydrogen 2.871 N/A SER 177.A OG ILE 173.A O no hydrogen 3.194 N/A GLY 178.A N ILE 173.A O no hydrogen 3.368 N/A SER 179.A N THR 174.A O no hydrogen 2.773 N/A SER 179.A OG THR 174.A O no hydrogen 2.977 N/A GLY 180.A N LEU 176.A O no hydrogen 2.770 N/A ALA 182.A N SER 179.A O no hydrogen 3.129 N/A TYR 183.A OH GLY 175.A O no hydrogen 3.038 N/A ILE 184.A N GLY 180.A O no hydrogen 3.175 N/A TYR 185.A N PRO 181.A O no hydrogen 2.896 N/A LEU 186.A N ALA 182.A O no hydrogen 3.067 N/A ALA 187.A N TYR 183.A O no hydrogen 3.015 N/A ILE 188.A N ILE 184.A O no hydrogen 2.865 N/A GLU 189.A N TYR 185.A O no hydrogen 3.084 N/A ALA 190.A N LEU 186.A O no hydrogen 2.890 N/A LEU 191.A N ALA 187.A O no hydrogen 2.827 N/A ALA 192.A N ILE 188.A O no hydrogen 3.016 N/A ASP 193.A N GLU 189.A O no hydrogen 2.838 N/A GLY 194.A N ALA 190.A O no hydrogen 2.800 N/A GLY 195.A N LEU 191.A O no hydrogen 2.856 N/A VAL 196.A N ALA 192.A O no hydrogen 2.975 N/A ALA 197.A N ASP 193.A O no hydrogen 2.809 N/A ALA 198.A N GLY 194.A O no hydrogen 2.948 N/A GLY 199.A N VAL 196.A O no hydrogen 2.896 N/A LEU 200.A N GLY 195.A O no hydrogen 2.998 N/A ARG 202.A NH1 ASP 193.A OD1 no hydrogen 2.830 N/A ARG 202.A NH2 ASP 193.A OD1 no hydrogen 2.976 N/A ALA 205.A N PRO 201.A O no hydrogen 2.852 N/A LEU 206.A N ARG 202.A O no hydrogen 2.888 N/A SER 207.A N ASP 203.A O no hydrogen 2.966 N/A SER 207.A OG ASP 203.A O no hydrogen 2.935 N/A LEU 208.A N LEU 204.A O no hydrogen 2.773 N/A ALA 209.A N ALA 205.A O no hydrogen 2.917 N/A SER 210.A N LEU 206.A O no hydrogen 2.957 N/A SER 210.A OG LEU 206.A O no hydrogen 3.395 N/A GLN 211.A N SER 207.A O no hydrogen 3.169 N/A THR 212.A N LEU 208.A O no hydrogen 2.773 N/A THR 212.A OG1 LEU 208.A O no hydrogen 2.575 N/A VAL 213.A N ALA 209.A O no hydrogen 3.005 N/A LEU 214.A N SER 210.A O no hydrogen 2.907 N/A GLY 215.A N GLN 211.A O no hydrogen 2.773 N/A ALA 216.A N THR 212.A O no hydrogen 2.949 N/A ALA 217.A N VAL 213.A O no hydrogen 3.090 N/A SER 218.A N LEU 214.A O no hydrogen 2.955 N/A SER 218.A OG LEU 214.A O no hydrogen 2.879 N/A MET 219.A N GLY 215.A O no hydrogen 2.950 N/A ALA 220.A N ALA 216.A O no hydrogen 2.959 N/A THR 221.A N ALA 217.A O no hydrogen 2.810 N/A THR 221.A OG1 ALA 217.A O no hydrogen 3.289 N/A THR 221.A OG1 SER 218.A O no hydrogen 3.143 N/A GLN 222.A N SER 218.A O no hydrogen 2.939 N/A SER 223.A N MET 219.A O no hydrogen 2.928 N/A SER 223.A OG MET 219.A O no hydrogen 2.774 N/A LYS 225.A N SER 223.A OG no hydrogen 3.031 N/A LYS 225.A NZ ASP 233.A OD2 no hydrogen 2.819 N/A GLY 228.A N HIS 226.A ND1 no hydrogen 3.050 N/A GLN 229.A N HIS 226.A O no hydrogen 2.891 N/A GLN 229.A NE2 GLN 229.A O no hydrogen 3.285 N/A GLN 229.A NE2 ASP 233.A OD1 no hydrogen 3.001 N/A LEU 230.A N HIS 226.A O no hydrogen 3.040 N/A LYS 231.A N PRO 227.A O no hydrogen 2.909 N/A ASP 232.A N GLY 228.A O no hydrogen 2.945 N/A ASP 233.A N GLN 229.A O no hydrogen 2.884 N/A VAL 234.A N LYS 231.A O no hydrogen 3.162 N/A THR 235.A N ASP 232.A O no hydrogen 3.434 N/A THR 235.A OG1 LYS 231.A O no hydrogen 2.797 N/A THR 235.A OG1 ASP 232.A O no hydrogen 3.368 N/A SER 236.A N VAL 234.A O no hydrogen 3.259 N/A GLY 239.A N SER 236.A O no hydrogen 2.997 N/A THR 241.A OG1 VAL 234.A O no hydrogen 3.522 N/A ALA 243.A N GLY 239.A O no hydrogen 3.243 N/A GLY 244.A N THR 240.A O no hydrogen 3.089 N/A VAL 245.A N THR 241.A O no hydrogen 2.778 N/A HIS 246.A N ILE 242.A O no hydrogen 2.814 N/A GLU 247.A N ALA 243.A O no hydrogen 3.312 N/A LEU 248.A N GLY 244.A O no hydrogen 3.126 N/A GLU 249.A N VAL 245.A O no hydrogen 2.900 N/A LYS 250.A N HIS 246.A O no hydrogen 2.794 N/A LYS 250.A NZ HIS 246.A NE2 no hydrogen 3.486 N/A ALA 251.A N GLU 247.A O no hydrogen 3.230 N/A ALA 251.A N LEU 248.A O no hydrogen 3.190 N/A GLY 252.A N GLU 249.A O no hydrogen 3.078 N/A PHE 253.A N LEU 248.A O no hydrogen 3.098 N/A ARG 254.A NE GLU 249.A OE2 no hydrogen 2.935 N/A ARG 254.A NH2 GLU 249.A OE2 no hydrogen 3.332 N/A ILE 256.A N GLY 252.A O no hydrogen 3.162 N/A ILE 256.A N PHE 253.A O no hydrogen 3.110 N/A LEU 257.A N PHE 253.A O no hydrogen 3.249 N/A MET 258.A N ARG 254.A O no hydrogen 3.039 N/A ASN 259.A N GLY 255.A O no hydrogen 2.847 N/A ALA 260.A N ILE 256.A O no hydrogen 3.041 N/A VAL 261.A N LEU 257.A O no hydrogen 3.109 N/A VAL 262.A N MET 258.A O no hydrogen 3.004 N/A ALA 263.A N ASN 259.A O no hydrogen 2.927 N/A ALA 264.A N ALA 260.A O no hydrogen 2.906 N/A ALA 265.A N VAL 261.A O no hydrogen 2.912 N/A LYS 266.A N VAL 262.A O no hydrogen 2.929 N/A ARG 267.A N.A ALA 263.A O no hydrogen 2.899 N/A ARG 267.A N.B ALA 263.A O no hydrogen 2.899 N/A ARG 267.A NH1.A GLU 270.A OE1 no hydrogen 3.267 N/A SER 268.A N ALA 264.A O no hydrogen 2.953 N/A SER 268.A OG ASP 171.A OD1 no hydrogen 2.827 N/A GLN 269.A N.A ALA 265.A O no hydrogen 3.038 N/A GLN 269.A N.B ALA 265.A O no hydrogen 3.042 N/A GLU 270.A N LYS 266.A O no hydrogen 2.981 N/A LEU 271.A N ARG 267.A O.A no hydrogen 2.918 N/A LEU 271.A N ARG 267.A O.B no hydrogen 2.917 N/A SER 272.A N GLN 269.A O.A no hydrogen 2.875 N/A SER 272.A N GLN 269.A O.B no hydrogen 2.875 N/A