Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5b58_T.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 1.A N ASP 62.A OD1 no hydrogen 3.295 N/A ARG 1.A NE LEU 59.A O no hydrogen 3.108 N/A ARG 1.A NE ARG 60.A O no hydrogen 2.862 N/A ARG 1.A NH2 LEU 59.A O no hydrogen 2.435 N/A VAL 2.A N ARG 25.A O no hydrogen 3.056 N/A ILE 3.A N LEU 63.A O no hydrogen 3.109 N/A VAL 4.A N GLY 28.A O no hydrogen 3.155 N/A ILE 5.A N LEU 65.A O no hydrogen 2.763 N/A GLY 6.A N ASP 30.A OD1 no hydrogen 2.601 N/A ALA 10.A N GLY 6.A O no hydrogen 3.044 N/A GLU 11.A N GLY 7.A O no hydrogen 2.947 N/A THR 12.A N ALA 8.A O no hydrogen 2.819 N/A THR 12.A OG1 ALA 8.A O no hydrogen 2.968 N/A ALA 13.A N LEU 9.A O no hydrogen 2.774 N/A PHE 14.A N ALA 10.A O no hydrogen 2.974 N/A ALA 15.A N GLU 11.A O no hydrogen 2.760 N/A LEU 16.A N THR 12.A O no hydrogen 2.993 N/A LEU 16.A N ALA 13.A O no hydrogen 3.272 N/A GLY 17.A N PHE 14.A O no hydrogen 3.135 N/A GLY 18.A N PHE 14.A O no hydrogen 2.847 N/A THR 21.A N TYR 24.A O no hydrogen 2.856 N/A ARG 23.A N THR 21.A OG1 no hydrogen 2.982 N/A TYR 24.A N THR 21.A OG1 no hydrogen 3.303 N/A LEU 26.A N ALA 19.A O no hydrogen 3.009 N/A VAL 27.A N VAL 2.A O no hydrogen 2.937 N/A ALA 29.A N PRO 43.A O no hydrogen 2.996 N/A THR 31.A N GLY 46.A O no hydrogen 3.344 N/A THR 32.A N ASP 30.A OD2 no hydrogen 3.044 N/A THR 32.A OG1 ASP 30.A OD2 no hydrogen 2.336 N/A CYS 33.A N ASP 30.A O no hydrogen 3.357 N/A CYS 33.A SG ASP 30.A O no hydrogen 3.725 N/A CYS 33.A SG ASP 30.A OD1 no hydrogen 3.292 N/A ALA 39.A N PRO 36.A O no hydrogen 3.192 N/A LYS 40.A N PRO 36.A O no hydrogen 3.341 N/A LYS 40.A NZ THR 34.A O no hydrogen 2.579 N/A ARG 41.A N ASP 37.A O no hydrogen 3.169 N/A LEU 42.A N ALA 39.A O no hydrogen 2.971 N/A LYS 44.A NZ ALA 39.A O no hydrogen 3.245 N/A LYS 44.A NZ LEU 42.A O no hydrogen 2.687 N/A VAL 45.A N ALA 29.A O no hydrogen 3.064 N/A ALA 50.A N TYR 47.A O no hydrogen 3.098 N/A SER 52.A OG GLU 54.A OE1 no hydrogen 3.104 N/A GLU 54.A N GLU 54.A OE1 no hydrogen 2.985 N/A LEU 56.A N SER 52.A O no hydrogen 2.821 N/A LEU 57.A N ALA 53.A O no hydrogen 2.531 N/A SER 58.A N GLU 54.A O no hydrogen 2.769 N/A SER 58.A OG GLY 55.A O no hydrogen 2.264 N/A LEU 59.A N LEU 56.A O no hydrogen 3.033 N/A ARG 60.A N LEU 57.A O no hydrogen 2.623 N/A ASP 62.A N ARG 1.A O no hydrogen 2.748 N/A VAL 64.A N THR 85.A O no hydrogen 2.741 N/A LEU 65.A N ILE 3.A O no hydrogen 2.876 N/A ALA 66.A N THR 87.A O no hydrogen 2.864 N/A SER 67.A N ILE 5.A O no hydrogen 3.061 N/A SER 67.A OG ILE 5.A O no hydrogen 3.324 N/A SER 67.A OG GLN 48.A OE1 no hydrogen 3.065 N/A SER 67.A OG GLU 69.A OE1 no hydrogen 2.985 N/A GLU 69.A N GLU 69.A OE1 no hydrogen 2.874 N/A ALA 70.A N SER 67.A O no hydrogen 3.265 N/A GLY 71.A N GLN 48.A O no hydrogen 3.250 N/A ILE 76.A N PRO 72.A O no hydrogen 3.008 N/A ALA 77.A N PRO 73.A O no hydrogen 2.880 N/A GLN 78.A N THR 74.A O no hydrogen 3.139 N/A VAL 79.A N ALA 75.A O no hydrogen 3.076 N/A LYS 80.A N ILE 76.A O no hydrogen 2.766 N/A GLY 81.A N ALA 77.A O no hydrogen 2.621 N/A ALA 82.A N VAL 79.A O no hydrogen 2.878 N/A GLY 83.A N LYS 80.A O no hydrogen 2.981 N/A THR 87.A N VAL 64.A O no hydrogen 2.906 N/A PHE 89.A N ALA 66.A O no hydrogen 2.944 N/A ARG 92.A N SER 97.A OG no hydrogen 2.706 N/A HIS 93.A N GLU 91.A OE2 no hydrogen 2.826 N/A SER 97.A N ASP 94.A OD1 no hydrogen 3.295 N/A SER 97.A OG ASP 90.A O no hydrogen 3.324 N/A SER 97.A OG GLU 91.A OE2 no hydrogen 3.124 N/A VAL 98.A N ASP 94.A O no hydrogen 3.173 N/A ARG 99.A N VAL 95.A O no hydrogen 2.831 N/A ALA 100.A N GLU 96.A O no hydrogen 3.226 N/A LYS 101.A NZ GLU 91.A OE1 no hydrogen 2.625 N/A LYS 101.A NZ PHE 245.A O no hydrogen 3.236 N/A ILE 102.A N VAL 98.A O no hydrogen 3.061 N/A THR 103.A N ARG 99.A O no hydrogen 2.923 N/A THR 103.A OG1 ARG 99.A O no hydrogen 2.862 N/A GLY 104.A N ALA 100.A O no hydrogen 2.711 N/A VAL 105.A N LYS 101.A O no hydrogen 2.893 N/A ALA 106.A N ILE 102.A O no hydrogen 3.145 N/A GLN 107.A N THR 103.A O no hydrogen 2.865 N/A ALA 108.A N GLY 104.A O no hydrogen 2.816 N/A LEU 109.A N VAL 105.A O no hydrogen 2.768 N/A ASP 110.A N GLN 107.A O no hydrogen 2.895 N/A VAL 111.A N ALA 106.A O no hydrogen 2.618 N/A GLY 115.A N VAL 111.A O no hydrogen 3.084 N/A ALA 116.A N ARG 112.A O no hydrogen 2.937 N/A ALA 117.A N ASP 113.A O no hydrogen 3.042 N/A LEU 118.A N ALA 114.A O no hydrogen 2.961 N/A LEU 119.A N GLY 115.A O no hydrogen 2.853 N/A GLN 120.A N ALA 116.A O no hydrogen 3.170 N/A ARG 121.A N ALA 117.A O no hydrogen 3.116 N/A PHE 122.A N LEU 118.A O no hydrogen 2.874 N/A ASP 123.A N LEU 119.A O no hydrogen 2.874 N/A ARG 124.A N GLN 120.A O no hydrogen 3.022 N/A ARG 124.A NH1 ARG 124.A O no hydrogen 2.317 N/A ASP 125.A N ARG 121.A O no hydrogen 2.961 N/A TRP 126.A N PHE 122.A O no hydrogen 2.655 N/A GLN 127.A N ASP 123.A O no hydrogen 2.774 N/A GLN 127.A NE2 GLN 127.A O no hydrogen 3.367 N/A GLN 127.A NE2 ASP 131.A OD1 no hydrogen 3.264 N/A ALA 128.A N ARG 124.A O no hydrogen 3.045 N/A ALA 129.A N ASP 125.A O no hydrogen 2.862 N/A ARG 130.A N TRP 126.A O no hydrogen 2.895 N/A ASP 131.A N GLN 127.A O no hydrogen 2.998 N/A ALA 132.A N ALA 128.A O no hydrogen 2.749 N/A VAL 133.A N ALA 129.A O no hydrogen 3.370 N/A ALA 134.A N ARG 130.A O no hydrogen 3.030 N/A ALA 135.A N ASP 131.A O no hydrogen 2.972 N/A ARG 136.A N VAL 133.A O no hydrogen 3.194 N/A GLY 140.A N VAL 137.A O no hydrogen 2.928 N/A ARG 145.A N ASP 199.A OD2 no hydrogen 2.947 N/A ARG 145.A NE ALA 196.A O no hydrogen 3.039 N/A ARG 145.A NH2 ALA 178.A O no hydrogen 3.464 N/A VAL 146.A N ARG 176.A O no hydrogen 2.863 N/A LEU 147.A N VAL 200.A O no hydrogen 3.179 N/A VAL 149.A N LEU 202.A O no hydrogen 2.856 N/A LEU 150.A N LEU 158.A O no hydrogen 2.957 N/A THR 153.A N GLN 156.A O no hydrogen 2.435 N/A GLN 156.A N THR 153.A O no hydrogen 2.877 N/A LEU 158.A N ASN 151.A O no hydrogen 2.718 N/A VAL 159.A N LYS 186.A O no hydrogen 3.002 N/A ALA 160.A N PHE 148.A O no hydrogen 3.272 N/A GLY 161.A N HIS 184.A O no hydrogen 3.003 N/A GLN 162.A N PHE 182.A O no hydrogen 2.794 N/A GLN 162.A NE2 ASP 167.A OD1 no hydrogen 2.971 N/A GLN 162.A NE2 MET 179.A O no hydrogen 2.790 N/A THR 164.A OG1 GLY 161.A O no hydrogen 2.574 N/A ASP 167.A N THR 164.A OG1 no hydrogen 2.945 N/A ALA 168.A N THR 164.A O no hydrogen 3.420 N/A MET 169.A N ALA 165.A O no hydrogen 2.942 N/A ILE 170.A N ALA 166.A O no hydrogen 2.784 N/A ARG 171.A N ASP 167.A O no hydrogen 3.135 N/A ARG 171.A NE ASP 167.A OD2 no hydrogen 2.998 N/A ARG 171.A NH2 ASP 167.A OD2 no hydrogen 3.513 N/A TYR 172.A N ALA 168.A O no hydrogen 2.943 N/A ALA 173.A N MET 169.A O no hydrogen 3.169 N/A GLY 174.A N ARG 171.A O no hydrogen 3.191 N/A ALA 175.A N ILE 170.A O no hydrogen 3.324 N/A ARG 176.A N PRO 144.A O no hydrogen 2.655 N/A ASN 177.A ND2 ALA 160.A O no hydrogen 3.583 N/A ASN 177.A ND2 GLY 161.A O no hydrogen 3.681 N/A ASN 177.A ND2 ASP 167.A OD1 no hydrogen 2.947 N/A ALA 178.A N VAL 146.A O no hydrogen 2.728 N/A MET 179.A N ASN 177.A OD1 no hydrogen 2.845 N/A GLN 180.A NE2 ASN 177.A O no hydrogen 2.915 N/A GLY 181.A N GLN 162.A OE1 no hydrogen 3.274 N/A HIS 184.A N GLN 162.A O no hydrogen 2.564 N/A LYS 186.A N VAL 159.A O no hydrogen 3.141 N/A LEU 188.A N ALA 157.A O no hydrogen 2.380 N/A THR 190.A OG1 GLU 191.A OE1 no hydrogen 2.965 N/A GLU 191.A N GLU 191.A OE1 no hydrogen 2.503 N/A ALA 192.A N THR 189.A OG1 no hydrogen 2.565 N/A LEU 193.A N THR 189.A O no hydrogen 2.721 N/A ALA 194.A N THR 190.A O no hydrogen 2.797 N/A ALA 195.A N GLU 191.A O no hydrogen 2.986 N/A ALA 196.A N ALA 192.A O no hydrogen 2.758 N/A ALA 197.A N LEU 193.A O no hydrogen 2.808 N/A ASP 199.A N ARG 145.A O no hydrogen 2.738 N/A VAL 200.A N ARG 145.A O no hydrogen 3.338 N/A VAL 201.A N ARG 233.A O no hydrogen 3.120 N/A LEU 202.A N LEU 147.A O no hydrogen 2.811 N/A ILE 203.A N VAL 235.A O no hydrogen 2.948 N/A ASP 205.A N LEU 237.A O no hydrogen 2.483 N/A GLU 206.A N GLU 206.A OE1 no hydrogen 2.461 N/A GLY 207.A N SER 204.A OG no hydrogen 2.827 N/A LEU 208.A N SER 204.A O no hydrogen 2.666 N/A ALA 209.A N ASP 205.A O no hydrogen 2.871 N/A ALA 210.A N GLU 206.A O no hydrogen 2.827 N/A VAL 211.A N GLY 207.A O no hydrogen 2.935 N/A GLY 212.A N LEU 208.A O no hydrogen 3.170 N/A GLY 212.A N ALA 209.A O no hydrogen 3.170 N/A GLY 213.A N LEU 208.A O no hydrogen 2.776 N/A LEU 217.A N GLY 213.A O no hydrogen 3.170 N/A LEU 218.A N HIS 214.A O no hydrogen 3.182 N/A ALA 219.A N ALA 215.A O no hydrogen 3.009 N/A THR 220.A N LEU 217.A O no hydrogen 3.291 N/A THR 220.A OG1 ALA 216.A O no hydrogen 3.186 N/A THR 220.A OG1 LEU 217.A O no hydrogen 2.883 N/A PHE 223.A N THR 220.A O no hydrogen 2.867 N/A THR 226.A OG1 PHE 223.A O no hydrogen 2.848 N/A ALA 228.A N PRO 198.A O no hydrogen 3.137 N/A GLY 229.A N THR 226.A OG1 no hydrogen 2.968 N/A ARG 230.A N THR 226.A O no hydrogen 2.551 N/A ALA 231.A N PRO 227.A O no hydrogen 3.023 N/A ARG 232.A N GLY 229.A O no hydrogen 3.090 N/A ARG 233.A N ALA 228.A O no hydrogen 2.790 N/A ARG 233.A NE ALA 263.A O no hydrogen 2.983 N/A ARG 233.A NH1 ASP 199.A O no hydrogen 2.902 N/A VAL 235.A N VAL 201.A O no hydrogen 2.959 N/A LEU 237.A N ILE 203.A O no hydrogen 3.108 N/A ALA 239.A N GLU 206.A OE1 no hydrogen 3.083 N/A PHE 241.A N ASP 238.A OD2 no hydrogen 2.562 N/A LEU 242.A N ASP 238.A O no hydrogen 2.816 N/A LEU 243.A N ALA 239.A O no hydrogen 2.920 N/A GLY 244.A N LEU 240.A O no hydrogen 3.212 N/A ARG 248.A NE GLU 11.A OE1 no hydrogen 2.669 N/A ARG 248.A NH2 GLU 11.A OE2 no hydrogen 2.673 N/A LEU 249.A N GLY 246.A O no hydrogen 2.908 N/A ALA 252.A N ARG 248.A O no hydrogen 2.690 N/A VAL 253.A N LEU 249.A O no hydrogen 2.892 N/A THR 254.A N PRO 250.A O no hydrogen 2.987 N/A THR 254.A OG1 PRO 250.A O no hydrogen 2.617 N/A THR 255.A N LEU 251.A O no hydrogen 2.873 N/A THR 255.A OG1 LEU 251.A O no hydrogen 2.675 N/A LEU 256.A N ALA 252.A O no hydrogen 2.927 N/A HIS 257.A N VAL 253.A O no hydrogen 2.870 N/A HIS 257.A NE2 ARG 136.A O no hydrogen 2.933 N/A ARG 258.A N THR 254.A O no hydrogen 2.998 N/A ARG 259.A N THR 255.A O no hydrogen 2.942 N/A LEU 260.A N LEU 256.A O no hydrogen 2.916 N/A SER 261.A N HIS 257.A O no hydrogen 2.969 N/A SER 261.A OG HIS 257.A O no hydrogen 2.682 N/A ASP 262.A N ARG 258.A O no hydrogen 2.791 N/A ALA 263.A N ARG 259.A O no hydrogen 3.046 N/A LEU 264.A N LEU 260.A O no hydrogen 3.100 N/A LEU 264.A N SER 261.A O no hydrogen 3.224 N/A ALA 265.A N ASP 262.A O no hydrogen 3.161 N/A