Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3t57_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 1.A N VAL 18.A O no hydrogen 3.035 N/A HIS 3.A N VAL 20.A O no hydrogen 2.841 N/A HIS 3.A ND1 SER 5.A OG no hydrogen 3.046 N/A SER 5.A N HIS 3.A ND1 no hydrogen 3.126 N/A SER 5.A OG HIS 3.A ND1 no hydrogen 3.046 N/A ALA 6.A N HIS 3.A O no hydrogen 3.093 N/A VAL 7.A N CYS 24.A O no hydrogen 2.891 N/A HIS 9.A N ILE 26.A O no hydrogen 3.000 N/A ASN 11.A N HIS 9.A ND1 no hydrogen 3.002 N/A ALA 12.A N HIS 9.A O no hydrogen 3.094 N/A VAL 13.A N VAL 30.A O no hydrogen 2.731 N/A GLY 15.A N LEU 32.A O no hydrogen 2.865 N/A LYS 16.A N ASN 34.A OD1 no hydrogen 2.808 N/A SER 19.A N CYS 36.A O no hydrogen 2.998 N/A VAL 20.A N LEU 1.A O no hydrogen 2.915 N/A GLY 21.A N LEU 38.A O no hydrogen 2.869 N/A TYR 23.A N SER 5.A OG no hydrogen 3.000 N/A CYS 24.A SG GLY 21.A O no hydrogen 3.305 N/A CYS 24.A SG TYR 39.A O no hydrogen 3.004 N/A CYS 24.A SG SER 42.A OG no hydrogen 3.454 N/A THR 25.A N SER 42.A O no hydrogen 3.210 N/A THR 25.A OG1 HIS 43.A ND1 no hydrogen 2.861 N/A ILE 26.A N VAL 7.A O no hydrogen 2.890 N/A GLY 27.A N VAL 44.A O no hydrogen 2.989 N/A SER 28.A OG SER 29.A OG no hydrogen 3.321 N/A SER 29.A OG SER 28.A OG no hydrogen 3.321 N/A LYS 31.A N THR 48.A O no hydrogen 2.872 N/A LEU 32.A N VAL 13.A O no hydrogen 2.765 N/A GLY 33.A N LEU 50.A O no hydrogen 2.979 N/A GLY 35.A N LYS 16.A O no hydrogen 2.926 N/A CYS 36.A N GLY 33.A O no hydrogen 3.379 N/A CYS 36.A SG GLY 33.A O no hydrogen 3.371 N/A CYS 36.A SG GLY 51.A O no hydrogen 3.111 N/A LYS 37.A N CYS 54.A O no hydrogen 2.902 N/A LEU 38.A N SER 19.A O no hydrogen 2.789 N/A TYR 39.A N LEU 56.A O no hydrogen 2.802 N/A SER 41.A N PRO 22.A O no hydrogen 2.917 N/A SER 42.A OG TYR 39.A O no hydrogen 2.746 N/A HIS 43.A N ALA 60.A O no hydrogen 2.858 N/A HIS 43.A ND1 THR 25.A OG1 no hydrogen 2.861 N/A VAL 44.A N THR 25.A O no hydrogen 2.997 N/A PHE 45.A N VAL 62.A O no hydrogen 2.830 N/A ASN 47.A ND2 GLY 68.A O no hydrogen 2.785 N/A THR 48.A N SER 29.A O no hydrogen 3.386 N/A THR 48.A OG1 PHE 45.A O no hydrogen 2.482 N/A GLU 49.A N THR 70.A O no hydrogen 3.006 N/A LEU 50.A N LYS 31.A O no hydrogen 2.947 N/A GLY 51.A N GLY 73.A O no hydrogen 2.946 N/A SER 53.A N ASN 34.A O no hydrogen 2.868 N/A CYS 54.A SG GLY 51.A O no hydrogen 3.557 N/A CYS 54.A SG GLY 73.A O no hydrogen 3.117 N/A VAL 55.A N ASN 76.A O no hydrogen 2.816 N/A LEU 56.A N LYS 37.A O no hydrogen 2.896 N/A MET 57.A N ILE 78.A O no hydrogen 2.925 N/A THR 58.A OG1 PRO 40.A O no hydrogen 2.958 N/A GLY 59.A N SER 41.A O no hydrogen 2.874 N/A ALA 60.A N MET 57.A O no hydrogen 3.064 N/A VAL 61.A N ALA 82.A O no hydrogen 2.844 N/A VAL 62.A N HIS 43.A O no hydrogen 2.920 N/A GLY 63.A N VAL 84.A O no hydrogen 2.792 N/A LEU 66.A N ASP 64.A OD1 no hydrogen 3.104 N/A TYR 69.A N CYS 99.A O no hydrogen 3.274 N/A THR 70.A N ASN 47.A O no hydrogen 3.087 N/A THR 70.A OG1 GLY 85.A O no hydrogen 3.544 N/A PHE 71.A N LEU 101.A O no hydrogen 2.882 N/A ILE 72.A N GLU 49.A O no hydrogen 2.800 N/A GLY 73.A N ILE 103.A O no hydrogen 2.840 N/A GLY 73.A N GLY 104.A O no hydrogen 3.172 N/A CYS 74.A N ASN 105.A OD1 no hydrogen 2.957 N/A CYS 74.A SG ASN 75.A OD1 no hydrogen 3.287 N/A ASN 75.A N GLU 52.A O no hydrogen 2.795 N/A ASN 76.A ND2 GLY 104.A O no hydrogen 2.838 N/A ILE 77.A N ASN 107.A O no hydrogen 3.062 N/A ILE 78.A N VAL 55.A O no hydrogen 2.761 N/A GLY 79.A N ILE 109.A O no hydrogen 2.636 N/A HIS 81.A N THR 58.A O no hydrogen 3.044 N/A ALA 82.A N GLY 79.A O no hydrogen 3.107 N/A VAL 83.A N CYS 113.A O no hydrogen 2.803 N/A VAL 84.A N VAL 61.A O no hydrogen 2.860 N/A GLY 85.A N ILE 115.A O no hydrogen 2.813 N/A LYS 87.A N ASP 64.A OD2 no hydrogen 3.115 N/A CYS 88.A SG SER 118.A O no hydrogen 4.029 N/A LYS 92.A N ASP 90.A OD1 no hydrogen 2.816 N/A TYR 93.A N ASP 90.A O no hydrogen 3.122 N/A TYR 93.A OH ASP 97.A O no hydrogen 2.687 N/A ASP 97.A N LYS 94.A O no hydrogen 3.004 N/A CYS 99.A N PRO 67.A O no hydrogen 2.990 N/A CYS 99.A SG PRO 67.A O no hydrogen 3.771 N/A PHE 100.A N SER 118.A OG no hydrogen 2.890 N/A LEU 101.A N TYR 69.A O no hydrogen 3.127 N/A CYS 102.A N THR 125.A O no hydrogen 2.805 N/A CYS 102.A SG.A TYR 69.A OH no hydrogen 3.504 N/A ILE 103.A N PHE 71.A O no hydrogen 2.819 N/A GLY 104.A N ILE 127.A O no hydrogen 2.877 N/A GLY 104.A N GLY 128.A O no hydrogen 3.126 N/A ASN 105.A N ASP 129.A OD1 no hydrogen 2.855 N/A ASN 106.A N CYS 74.A O no hydrogen 2.949 N/A ASN 107.A N ASN 76.A OD1 no hydrogen 2.870 N/A ASN 107.A ND2 ASN 76.A OD1 no hydrogen 3.005 N/A ASN 107.A ND2 GLY 128.A O no hydrogen 2.945 N/A GLU 108.A N ASN 131.A O no hydrogen 2.856 N/A ILE 109.A N ILE 77.A O no hydrogen 2.925 N/A ARG 110.A N ILE 133.A O no hydrogen 2.763 N/A ARG 110.A NE GLU 111.A OE1 no hydrogen 3.089 N/A ARG 110.A NH2 GLU 111.A OE1 no hydrogen 3.067 N/A GLU 111.A N GLU 111.A OE1 no hydrogen 2.763 N/A PHE 112.A N HIS 80.A O no hydrogen 3.111 N/A CYS 113.A N ARG 110.A O no hydrogen 3.433 N/A CYS 113.A SG ARG 110.A O no hydrogen 3.351 N/A CYS 113.A SG ILE 133.A O no hydrogen 3.935 N/A CYS 113.A SG MET 134.A O no hydrogen 3.031 N/A SER 114.A N CYS 137.A O no hydrogen 2.952 N/A ILE 115.A N VAL 83.A O no hydrogen 2.951 N/A HIS 116.A N ILE 139.A O no hydrogen 2.991 N/A HIS 116.A ND1 LYS 87.A O no hydrogen 2.931 N/A ARG 117.A N VAL 86.A O no hydrogen 2.880 N/A ARG 117.A NE CYS 99.A O no hydrogen 2.931 N/A ARG 117.A NH1 GLY 85.A O no hydrogen 2.965 N/A ARG 117.A NH2 LEU 66.A O no hydrogen 2.810 N/A ARG 117.A NH2 PRO 67.A O no hydrogen 2.942 N/A ARG 117.A NH2 CYS 99.A O no hydrogen 3.234 N/A SER 118.A N PHE 100.A O no hydrogen 3.026 N/A SER 118.A OG LYS 120.A O no hydrogen 3.002 N/A SER 118.A OG ASP 123.A O no hydrogen 3.209 N/A SER 119.A N ASP 142.A OD1 no hydrogen 3.034 N/A SER 119.A OG ASP 142.A OD2 no hydrogen 2.532 N/A LYS 120.A NZ SER 119.A OG no hydrogen 3.204 N/A ASP 123.A N LYS 120.A O no hydrogen 3.111 N/A LYS 124.A N ASP 123.A OD1 no hydrogen 2.693 N/A THR 125.A N PHE 100.A O no hydrogen 3.135 N/A THR 125.A OG1 HIS 116.A O no hydrogen 2.739 N/A VAL 126.A N CYS 143.A O no hydrogen 2.853 N/A ILE 127.A N CYS 102.A O no hydrogen 2.848 N/A ASP 129.A N ASP 147.A OD1 no hydrogen 2.871 N/A ASN 130.A N ASN 105.A O no hydrogen 2.837 N/A ASN 131.A N ASN 107.A OD1 no hydrogen 2.856 N/A ASN 131.A ND2 ASN 107.A OD1 no hydrogen 2.922 N/A ASN 131.A ND2 GLY 146.A O no hydrogen 2.968 N/A LEU 132.A N ASN 149.A O no hydrogen 2.869 N/A ILE 133.A N GLU 108.A O no hydrogen 2.763 N/A MET 134.A N PHE 151.A O no hydrogen 2.911 N/A SER 136.A N GLU 111.A O no hydrogen 2.891 N/A CYS 137.A SG MET 134.A O no hydrogen 3.315 N/A CYS 137.A SG PHE 151.A O no hydrogen 3.766 N/A CYS 137.A SG ALA 152.A O no hydrogen 3.215 N/A HIS 138.A N THR 155.A O no hydrogen 2.904 N/A ILE 139.A N SER 114.A O no hydrogen 2.845 N/A ALA 140.A N LEU 157.A O no hydrogen 2.942 N/A HIS 141.A ND1 ASP 142.A OD2 no hydrogen 2.697 N/A ASP 142.A N THR 125.A OG1 no hydrogen 2.918 N/A CYS 143.A N ALA 140.A O no hydrogen 3.429 N/A CYS 143.A SG ALA 140.A O no hydrogen 3.398 N/A CYS 143.A SG LEU 157.A O no hydrogen 3.853 N/A CYS 143.A SG ALA 158.A O no hydrogen 3.129 N/A LYS 144.A N VAL 161.A O no hydrogen 2.914 N/A LYS 144.A NZ ASP 123.A OD1 no hydrogen 2.820 N/A LYS 144.A NZ LYS 124.A O no hydrogen 3.164 N/A LYS 144.A NZ ASP 142.A O no hydrogen 2.863 N/A ILE 145.A N VAL 126.A O no hydrogen 2.731 N/A GLY 146.A N VAL 163.A O no hydrogen 2.904 N/A ASP 147.A N ASP 165.A OD1 no hydrogen 2.853 N/A ARG 148.A N ASP 129.A O no hydrogen 2.942 N/A ARG 148.A NE ASN 166.A OD1 no hydrogen 2.848 N/A ARG 148.A NH2 ASN 166.A OD1 no hydrogen 3.455 N/A ASN 149.A N ASN 131.A OD1 no hydrogen 2.933 N/A ASN 149.A ND2 ASN 131.A OD1 no hydrogen 3.038 N/A ASN 149.A ND2 GLU 164.A O no hydrogen 2.875 N/A ILE 150.A N THR 167.A O no hydrogen 2.846 N/A PHE 151.A N LEU 132.A O no hydrogen 2.892 N/A ALA 152.A N THR 169.A O no hydrogen 2.879 N/A ASN 154.A N GLY 135.A O no hydrogen 3.023 N/A THR 155.A N ALA 152.A O no hydrogen 3.279 N/A THR 155.A OG1 ALA 152.A O no hydrogen 2.756 N/A THR 155.A OG1 THR 169.A OG1 no hydrogen 2.808 N/A LEU 156.A N SER 173.A O no hydrogen 2.867 N/A LEU 157.A N HIS 138.A O no hydrogen 2.821 N/A ALA 158.A N VAL 175.A O no hydrogen 3.070 N/A HIS 160.A N HIS 141.A O no hydrogen 3.085 N/A VAL 161.A N ALA 158.A O no hydrogen 3.335 N/A VAL 162.A N CYS 179.A O no hydrogen 3.064 N/A VAL 163.A N LYS 144.A O no hydrogen 2.742 N/A GLU 164.A N ILE 181.A O no hydrogen 2.951 N/A ASP 165.A N SER 183.A OG no hydrogen 3.128 N/A ASN 166.A N ASP 147.A O no hydrogen 2.917 N/A THR 167.A N ASN 149.A OD1 no hydrogen 2.800 N/A THR 167.A OG1 ASN 149.A OD1 no hydrogen 2.694 N/A HIS 168.A N ALA 185.A O no hydrogen 3.002 N/A THR 169.A N ILE 150.A O no hydrogen 2.841 N/A THR 169.A OG1 THR 155.A OG1 no hydrogen 2.808 N/A ALA 170.A N ILE 187.A O no hydrogen 2.844 N/A ALA 172.A N ASN 153.A O no hydrogen 2.879 N/A SER 173.A OG ALA 170.A O no hydrogen 2.714 N/A SER 173.A OG GLY 188.A O no hydrogen 3.567 N/A VAL 174.A N SER 191.A O no hydrogen 2.769 N/A VAL 175.A N LEU 156.A O no hydrogen 2.827 N/A HIS 176.A N VAL 193.A O no hydrogen 2.847 N/A HIS 176.A ND1 GLN 177.A O no hydrogen 3.067 N/A PHE 178.A N GLY 159.A O no hydrogen 2.972 N/A CYS 179.A N HIS 176.A O no hydrogen 3.241 N/A CYS 179.A SG HIS 176.A O no hydrogen 3.505 N/A CYS 179.A SG VAL 193.A O no hydrogen 3.923 N/A HIS 180.A N ASP 196.A OD1 no hydrogen 2.806 N/A ILE 181.A N VAL 162.A O no hydrogen 2.793 N/A GLY 182.A N VAL 197.A O no hydrogen 2.800 N/A SER 183.A OG ASP 165.A O no hydrogen 3.479 N/A PHE 184.A N ASP 165.A O no hydrogen 2.964 N/A PHE 186.A N MET 201.A O no hydrogen 2.973 N/A ILE 187.A N HIS 168.A O no hydrogen 3.005 N/A GLY 188.A N VAL 203.A O no hydrogen 2.838 N/A GLY 190.A N GLY 171.A O no hydrogen 2.894 N/A SER 191.A N GLY 188.A O no hydrogen 3.285 N/A SER 191.A OG GLY 188.A O no hydrogen 2.669 N/A VAL 192.A N GLU 206.A O no hydrogen 2.798 N/A VAL 193.A N VAL 174.A O no hydrogen 2.698 N/A GLN 195.A NE2 ARG 284.A O no hydrogen 2.870 N/A ASP 196.A N GLY 285.A O no hydrogen 2.994 N/A VAL 197.A N HIS 180.A O no hydrogen 2.860 N/A LYS 199.A N SER 274.A OG no hydrogen 2.979 N/A LYS 199.A NZ TYR 200.A OH no hydrogen 2.817 N/A TYR 200.A N SER 183.A O no hydrogen 2.856 N/A MET 201.A N PRO 198.A O no hydrogen 3.247 N/A MET 202.A N GLY 212.A O no hydrogen 2.879 N/A VAL 203.A N PHE 186.A O no hydrogen 2.958 N/A ALA 204.A N GLU 209.A O no hydrogen 3.006 N/A GLY 205.A N SER 191.A OG no hydrogen 3.208 N/A ARG 207.A NE SER 194.A OG no hydrogen 3.117 N/A ALA 208.A N VAL 192.A O no hydrogen 2.806 N/A GLU 209.A N ALA 204.A O no hydrogen 3.142 N/A LEU 210.A N LYS 288.A O no hydrogen 2.993 N/A ARG 211.A N MET 202.A O no hydrogen 2.811 N/A ARG 211.A NE ALA 204.A O no hydrogen 3.357 N/A ARG 211.A NH2 ALA 204.A O no hydrogen 3.132 N/A ASN 214.A N TYR 200.A O no hydrogen 2.684 N/A ASN 214.A ND2 PHE 184.A O no hydrogen 2.713 N/A GLY 217.A N ASN 214.A OD1 no hydrogen 3.275 N/A LEU 218.A N ASN 214.A O no hydrogen 2.957 N/A ARG 219.A N LEU 215.A O no hydrogen 2.922 N/A ARG 220.A N GLU 216.A O no hydrogen 3.011 N/A ASN 221.A N GLY 217.A O no hydrogen 3.016 N/A ASN 221.A N LEU 218.A O no hydrogen 3.220 N/A ASN 221.A ND2 GLY 217.A O no hydrogen 2.811 N/A GLY 222.A N ARG 219.A O no hydrogen 3.464 N/A PHE 223.A N LEU 218.A O no hydrogen 3.216 N/A THR 224.A N GLU 227.A OE1 no hydrogen 2.947 N/A GLU 227.A N THR 224.A OG1 no hydrogen 3.259 N/A MET 228.A N THR 224.A O no hydrogen 3.222 N/A LYS 229.A N MET 225.A O no hydrogen 3.183 N/A SER 230.A N SER 226.A O no hydrogen 2.895 N/A SER 230.A OG SER 226.A O no hydrogen 2.784 N/A LEU 231.A N GLU 227.A O no hydrogen 3.016 N/A ARG 232.A N MET 228.A O no hydrogen 3.041 N/A ALA 233.A N LYS 229.A O no hydrogen 3.124 N/A ALA 234.A N SER 230.A O no hydrogen 2.909 N/A TYR 235.A N LEU 231.A O no hydrogen 2.836 N/A ARG 236.A N ARG 232.A O no hydrogen 2.993 N/A LYS 237.A N ALA 233.A O no hydrogen 3.001 N/A ILE 238.A N ALA 234.A O no hydrogen 3.110 N/A PHE 239.A N TYR 235.A O no hydrogen 2.933 N/A MET 240.A N ARG 236.A O no hydrogen 2.942 N/A SER 241.A OG THR 244.A OG1 no hydrogen 2.774 N/A THR 244.A OG1 SER 241.A OG no hydrogen 2.774 N/A THR 244.A OG1 GLU 243.A OE2 no hydrogen 3.147 N/A SER 248.A OG VAL 245.A O no hydrogen 2.813 N/A SER 248.A OG GLU 251.A OE1 no hydrogen 3.548 N/A ARG 252.A NE ILE 238.A O no hydrogen 2.842 N/A LEU 253.A N PHE 249.A O no hydrogen 3.264 N/A THR 254.A N GLU 250.A O no hydrogen 2.823 N/A THR 254.A OG1 GLU 250.A O no hydrogen 2.740 N/A GLU 255.A N GLU 251.A O no hydrogen 3.020 N/A LEU 256.A N ARG 252.A O no hydrogen 3.203 N/A LEU 256.A N LEU 253.A O no hydrogen 3.154 N/A GLU 257.A N LEU 253.A O no hydrogen 3.250 N/A GLN 258.A N THR 254.A O no hydrogen 3.141 N/A ASP 259.A N GLU 255.A O no hydrogen 3.146 N/A TYR 263.A N ASP 259.A O no hydrogen 2.915 N/A SER 264.A N GLN 260.A O no hydrogen 3.289 N/A SER 264.A OG GLN 260.A O no hydrogen 2.831 N/A VAL 265.A N LEU 262.A O no hydrogen 3.111 N/A SER 269.A N VAL 265.A O no hydrogen 3.096 N/A ALA 270.A N PRO 266.A O no hydrogen 2.905 N/A MET 271.A N ALA 267.A O no hydrogen 2.853 N/A LEU 272.A N VAL 268.A O no hydrogen 2.887 N/A GLN 273.A N SER 269.A O no hydrogen 2.984 N/A GLN 273.A NE2 ASP 277.A OD1 no hydrogen 2.551 N/A SER 274.A N ALA 270.A O no hydrogen 2.896 N/A ILE 275.A N MET 271.A O no hydrogen 3.020 N/A ARG 276.A N LEU 272.A O no hydrogen 3.087 N/A ASP 277.A N GLN 273.A O no hydrogen 2.987 N/A SER 278.A N ILE 275.A O no hydrogen 3.088 N/A SER 278.A OG ASP 196.A OD2 no hydrogen 2.764 N/A PHE 279.A N ARG 276.A O no hydrogen 3.040 N/A THR 280.A N ASP 277.A O no hydrogen 3.240 N/A THR 280.A OG1 ASP 277.A O no hydrogen 2.753 N/A ARG 283.A N THR 280.A O no hydrogen 2.991 N/A ARG 283.A NE ASP 196.A OD2 no hydrogen 3.037 N/A ARG 283.A NH2 ASP 196.A OD2 no hydrogen 2.665 N/A ARG 284.A NE SER 194.A O no hydrogen 2.797 N/A ARG 284.A NH2 SER 194.A O no hydrogen 2.871 N/A GLY 285.A N SER 278.A O no hydrogen 2.878 N/A CYS 287.A N ASP 196.A O no hydrogen 3.049 N/A CYS 287.A SG GLN 195.A O no hydrogen 3.378 N/A CYS 287.A SG ASP 196.A O no hydrogen 3.558 N/A LYS 288.A NZ GLN 195.A OE1 no hydrogen 3.297 N/A LYS 288.A NZ ILE 286.A O no hydrogen 3.232 N/A