Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1sa3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N GLN 58.A OE1 no hydrogen 3.112 N/A ARG 2.A NE GLU 213.A OE1 no hydrogen 2.924 N/A ARG 2.A NE GLU 213.A OE2 no hydrogen 3.455 N/A ARG 2.A NH1 ASP 16.A OD2 no hydrogen 2.837 N/A ARG 2.A NH2 ASP 16.A OD1 no hydrogen 2.793 N/A ARG 2.A NH2 ASP 16.A OD2 no hydrogen 3.508 N/A ARG 2.A NH2 GLU 213.A OE2 no hydrogen 2.897 N/A THR 3.A N MET 1.A O no hydrogen 2.756 N/A THR 3.A OG1 GLU 59.A OE1 no hydrogen 2.678 N/A LEU 6.A N THR 3.A OG1 no hydrogen 3.148 N/A SER 7.A N THR 3.A O no hydrogen 2.720 N/A LYS 8.A N GLU 4.A O no hydrogen 3.157 N/A LYS 8.A NZ ASP 12.A OD2 no hydrogen 3.330 N/A LEU 9.A N LEU 5.A O no hydrogen 2.984 N/A TYR 10.A N LEU 6.A O no hydrogen 2.796 N/A TYR 10.A OH TYR 34.A OH no hydrogen 2.637 N/A TYR 10.A OH ARG 212.A O no hydrogen 2.542 N/A ASP 11.A N SER 7.A O no hydrogen 3.132 N/A ASP 12.A N LYS 8.A O no hydrogen 2.874 N/A PHE 13.A N LEU 9.A O no hydrogen 2.956 N/A GLY 14.A N ASP 11.A O no hydrogen 2.994 N/A ILE 15.A N TYR 10.A O no hydrogen 3.144 N/A GLN 17.A N GLY 14.A O no hydrogen 3.061 N/A LEU 18.A N ILE 15.A O no hydrogen 3.027 N/A GLN 22.A N PRO 19.A O no hydrogen 3.064 N/A THR 26.A N GLN 22.A O no hydrogen 3.005 N/A THR 26.A OG1 GLN 22.A O no hydrogen 2.772 N/A SER 27.A N HIS 23.A O no hydrogen 2.912 N/A ASP 28.A N GLY 24.A O no hydrogen 3.146 N/A ARG 29.A N VAL 25.A O no hydrogen 2.838 N/A LEU 30.A N THR 26.A O no hydrogen 2.862 N/A GLY 31.A N SER 27.A O no hydrogen 2.896 N/A LYS 32.A N ASP 28.A O no hydrogen 3.225 N/A LEU 33.A N ARG 29.A O no hydrogen 2.814 N/A TYR 34.A N LEU 30.A O no hydrogen 2.899 N/A TYR 34.A OH TYR 10.A OH no hydrogen 2.637 N/A GLU 35.A N GLY 31.A O no hydrogen 3.260 N/A LYS 36.A N LYS 32.A O no hydrogen 3.046 N/A LYS 36.A NZ ASP 40.A OD1 no hydrogen 3.554 N/A LYS 36.A NZ ASP 40.A OD2 no hydrogen 2.771 N/A TYR 37.A N LEU 33.A O no hydrogen 2.913 N/A TYR 37.A OH GLU 59.A OE1 no hydrogen 2.574 N/A ILE 38.A N TYR 34.A O no hydrogen 3.357 N/A LEU 39.A N GLU 35.A O no hydrogen 3.077 N/A ASP 40.A N LYS 36.A O no hydrogen 2.885 N/A ILE 41.A N TYR 37.A O no hydrogen 3.166 N/A PHE 42.A N ILE 38.A O no hydrogen 3.099 N/A LYS 43.A N ASP 40.A O no hydrogen 3.315 N/A SER 47.A N ASP 44.A OD2 no hydrogen 2.660 N/A SER 47.A OG ASP 44.A OD2 no hydrogen 2.799 N/A LEU 48.A N ASP 44.A O no hydrogen 3.007 N/A LYS 49.A N ILE 45.A O no hydrogen 3.022 N/A LYS 50.A N GLU 46.A O no hydrogen 2.981 N/A TYR 51.A N SER 47.A O no hydrogen 2.853 N/A ASN 52.A N LEU 48.A O no hydrogen 3.060 N/A THR 53.A OG1 LYS 50.A O no hydrogen 2.877 N/A ALA 55.A N THR 53.A OG1 no hydrogen 3.259 N/A PHE 56.A N THR 53.A O no hydrogen 2.945 N/A GLN 58.A NE2 MET 1.A O no hydrogen 3.060 N/A GLN 58.A NE2 TYR 37.A OH no hydrogen 3.080 N/A LYS 60.A N PHE 56.A O no hydrogen 2.820 N/A ASP 61.A N PRO 57.A O no hydrogen 3.147 N/A ILE 62.A N GLN 58.A O no hydrogen 3.048 N/A SER 63.A N GLU 59.A O no hydrogen 2.838 N/A SER 63.A OG ASN 52.A OD1 no hydrogen 2.856 N/A SER 63.A OG GLU 59.A O no hydrogen 2.826 N/A SER 63.A OG LYS 60.A O no hydrogen 3.158 N/A SER 64.A N LYS 60.A O no hydrogen 2.816 N/A SER 64.A OG ASN 52.A OD1 no hydrogen 3.148 N/A SER 64.A OG LYS 60.A O no hydrogen 3.016 N/A LYS 65.A N ASP 61.A O no hydrogen 3.010 N/A LYS 65.A NZ ASP 61.A OD2 no hydrogen 2.916 N/A LYS 65.A NZ VAL 217.A O no hydrogen 2.858 N/A LEU 66.A N ILE 62.A O no hydrogen 3.071 N/A LEU 67.A N SER 63.A O no hydrogen 2.985 N/A LYS 68.A N SER 64.A O no hydrogen 2.840 N/A ALA 69.A N LYS 65.A O no hydrogen 3.068 N/A LEU 70.A N LEU 67.A O no hydrogen 3.106 N/A ASN 71.A N LYS 68.A O no hydrogen 2.999 N/A LEU 72.A N LEU 67.A O no hydrogen 2.982 N/A ASN 76.A N ASP 73.A O no hydrogen 2.905 N/A ILE 77.A N LEU 74.A O no hydrogen 3.031 N/A ILE 78.A N THR 105.A O no hydrogen 2.781 N/A ASP 79.A N THR 105.A O no hydrogen 3.210 N/A SER 81.A N ARG 103.A O no hydrogen 3.205 N/A SER 82.A OG LEU 39.A O no hydrogen 2.868 N/A SER 82.A OG PHE 42.A O no hydrogen 3.210 N/A SER 83.A N THR 101.A O no hydrogen 2.943 N/A SER 83.A OG ASP 84.A O no hydrogen 3.452 N/A THR 85.A N ASP 99.A O no hydrogen 3.061 N/A ILE 91.A N GLY 94.A O no hydrogen 2.884 N/A GLY 94.A N ILE 91.A O no hydrogen 2.724 N/A THR 98.A OG1 ILE 198.A O no hydrogen 2.694 N/A ASP 99.A N LEU 116.A O no hydrogen 2.645 N/A ALA 100.A N LEU 116.A O no hydrogen 3.336 N/A THR 101.A N SER 83.A O no hydrogen 2.887 N/A ILE 102.A N VAL 114.A O no hydrogen 3.197 N/A ARG 103.A N SER 81.A O no hydrogen 2.859 N/A ARG 103.A NH1 SER 111.A OG no hydrogen 3.136 N/A PHE 104.A N ARG 112.A O no hydrogen 2.937 N/A THR 105.A N ASP 79.A O no hydrogen 2.798 N/A PHE 106.A N SER 110.A O no hydrogen 2.803 N/A GLN 109.A N PHE 106.A O no hydrogen 3.223 N/A SER 110.A N ASN 108.A OD1 no hydrogen 3.192 N/A SER 110.A OG ASN 108.A OD1 no hydrogen 2.726 N/A ARG 112.A N PHE 104.A O no hydrogen 2.873 N/A ARG 112.A NE LEU 113.A O no hydrogen 2.808 N/A ARG 112.A NH2 ASP 202.A OD2 no hydrogen 2.903 N/A VAL 114.A N ILE 102.A O no hydrogen 2.732 N/A LEU 116.A N ALA 100.A O no hydrogen 2.658 N/A ASN 117.A N LEU 203.A O no hydrogen 3.120 N/A ASN 117.A ND2 LYS 97.A O no hydrogen 2.801 N/A ILE 118.A N ASP 99.A OD2 no hydrogen 2.744 N/A LYS 119.A N ILE 205.A O no hydrogen 3.088 N/A SER 121.A N PHE 207.A O no hydrogen 3.044 N/A SER 121.A OG LYS 123.A O no hydrogen 3.384 N/A LYS 123.A N SER 121.A OG no hydrogen 2.961 N/A LYS 125.A NZ GLU 232.A OE1 no hydrogen 3.207 N/A LYS 125.A NZ GLU 232.A OE2 no hydrogen 2.703 N/A LYS 125.A NZ GLY 244.A O no hydrogen 3.391 N/A LYS 125.A NZ ASN 246.A OD1 no hydrogen 3.493 N/A VAL 126.A N GLY 262.A O no hydrogen 2.939 N/A ILE 128.A N PHE 260.A O no hydrogen 2.762 N/A TYR 131.A N MET 258.A O no hydrogen 2.848 N/A TYR 131.A OH CYS 186.A O no hydrogen 2.680 N/A VAL 133.A N GLN 155.A OE1 no hydrogen 2.722 N/A GLU 134.A N ASP 132.A OD2 no hydrogen 3.056 N/A THR 135.A N ASP 132.A O no hydrogen 3.025 N/A ILE 136.A N ASP 132.A O no hydrogen 3.219 N/A CYS 137.A N VAL 133.A O no hydrogen 2.974 N/A CYS 137.A SG VAL 133.A O no hydrogen 3.489 N/A THR 138.A N GLU 134.A O no hydrogen 2.964 N/A THR 138.A OG1 GLU 134.A O no hydrogen 2.848 N/A GLY 139.A N THR 135.A O no hydrogen 2.976 N/A VAL 140.A N ILE 136.A O no hydrogen 2.780 N/A GLY 141.A N CYS 137.A O no hydrogen 2.804 N/A ILE 142.A N CYS 137.A O no hydrogen 2.819 N/A LYS 148.A NZ GLU 134.A OE1 no hydrogen 3.062 N/A LYS 148.A NZ ASP 144.A OD1 no hydrogen 2.629 N/A GLU 149.A N GLY 145.A O no hydrogen 3.035 N/A LEU 150.A N GLU 146.A O no hydrogen 2.970 N/A ILE 151.A N LEU 147.A O no hydrogen 3.093 N/A ARG 152.A N LYS 148.A O no hydrogen 2.819 N/A ARG 152.A NE GLU 149.A OE1 no hydrogen 2.997 N/A ARG 152.A NE GLU 149.A OE2 no hydrogen 3.322 N/A ARG 152.A NH1 GLU 134.A OE2 no hydrogen 3.341 N/A ARG 152.A NH2 GLU 134.A OE2 no hydrogen 3.159 N/A ARG 152.A NH2 GLU 149.A OE2 no hydrogen 3.006 N/A LYS 153.A N GLU 149.A O no hydrogen 2.793 N/A LYS 153.A NZ ASP 157.A OD2 no hydrogen 3.198 N/A HIS 154.A N LEU 150.A O no hydrogen 3.114 N/A GLN 155.A N ILE 151.A O no hydrogen 3.005 N/A GLN 155.A NE2 ASP 132.A OD1 no hydrogen 2.801 N/A ASN 156.A N ARG 152.A O no hydrogen 2.827 N/A ASP 157.A N LYS 153.A O no hydrogen 2.868 N/A GLN 158.A N HIS 154.A O no hydrogen 2.839 N/A LYS 161.A N SER 159.A OG no hydrogen 2.997 N/A PHE 163.A N ALA 160.A O no hydrogen 3.035 N/A THR 164.A N GLN 167.A OE1 no hydrogen 3.175 N/A GLN 167.A N THR 164.A OG1 no hydrogen 3.105 N/A LYS 168.A N THR 164.A O no hydrogen 3.058 N/A GLN 169.A N PRO 165.A O no hydrogen 3.170 N/A GLN 169.A NE2 PRO 165.A O no hydrogen 3.208 N/A ARG 170.A N VAL 166.A O no hydrogen 2.806 N/A ARG 170.A NE GLU 146.A OE1 no hydrogen 2.727 N/A ARG 170.A NH1 GLU 173.A OE1 no hydrogen 2.778 N/A ARG 170.A NH2 GLU 146.A OE1 no hydrogen 2.793 N/A LEU 171.A N GLN 167.A O no hydrogen 2.867 N/A THR 172.A N LYS 168.A O no hydrogen 3.133 N/A THR 172.A OG1 LYS 168.A O no hydrogen 3.037 N/A GLU 173.A N GLN 169.A O no hydrogen 2.935 N/A LEU 174.A N ARG 170.A O no hydrogen 3.004 N/A LEU 175.A N LEU 171.A O no hydrogen 2.937 N/A GLU 176.A N THR 172.A O no hydrogen 3.204 N/A TYR 178.A N LEU 175.A O no hydrogen 2.598 N/A ARG 179.A N GLU 176.A O no hydrogen 3.327 N/A ARG 179.A NH1 GLU 176.A O no hydrogen 3.475 N/A ARG 181.A NH2 PRO 177.A O no hydrogen 3.034 N/A PHE 182.A N TYR 178.A O no hydrogen 2.741 N/A ILE 183.A N ARG 179.A O no hydrogen 3.030 N/A ARG 184.A N GLU 180.A O no hydrogen 2.930 N/A ARG 184.A NH2 ASP 223.A OD1 no hydrogen 2.929 N/A TRP 185.A N ARG 181.A O no hydrogen 2.836 N/A CYS 186.A N PHE 182.A O no hydrogen 2.990 N/A CYS 186.A SG PHE 182.A O no hydrogen 3.305 N/A VAL 187.A N ILE 183.A O no hydrogen 3.186 N/A THR 188.A N ARG 184.A O no hydrogen 2.895 N/A THR 188.A OG1 ARG 184.A O no hydrogen 2.561 N/A LEU 189.A N TRP 185.A O no hydrogen 2.713 N/A ARG 190.A N THR 188.A OG1 no hydrogen 3.195 N/A LYS 193.A NZ ASP 223.A OD1 no hydrogen 3.144 N/A LYS 193.A NZ ASP 223.A OD2 no hydrogen 3.138 N/A GLY 196.A N ASP 202.A OD2 no hydrogen 2.689 N/A LEU 199.A N ASN 197.A OD1 no hydrogen 2.928 N/A HIS 200.A N ASN 197.A O no hydrogen 2.980 N/A HIS 200.A ND1 THR 188.A O no hydrogen 2.751 N/A ASP 202.A N PRO 115.A O no hydrogen 2.794 N/A LEU 204.A N LYS 220.A O no hydrogen 2.867 N/A ILE 205.A N ASN 117.A O no hydrogen 2.910 N/A ARG 206.A N THR 218.A O no hydrogen 2.801 N/A ARG 206.A NH1 GLY 262.A O no hydrogen 3.159 N/A ARG 206.A NH1 GLY 262.A OXT no hydrogen 3.089 N/A ARG 206.A NH2 GLY 262.A OXT no hydrogen 3.405 N/A PHE 207.A N LYS 119.A O no hydrogen 2.979 N/A GLN 208.A N ASP 216.A O no hydrogen 2.850 N/A VAL 209.A N SER 121.A O no hydrogen 2.813 N/A ILE 210.A N GLU 213.A O no hydrogen 2.983 N/A ARG 212.A NH1 LEU 18.A O no hydrogen 3.091 N/A ARG 212.A NH2 LEU 18.A O no hydrogen 2.871 N/A ARG 212.A NH2 PRO 19.A O no hydrogen 3.025 N/A GLU 213.A N ILE 210.A O no hydrogen 2.978 N/A VAL 215.A N GLN 208.A O no hydrogen 2.826 N/A ASP 216.A N GLN 208.A O no hydrogen 3.457 N/A VAL 217.A N ASP 216.A OD1 no hydrogen 2.721 N/A THR 218.A N ARG 206.A O no hydrogen 2.926 N/A LYS 220.A N LEU 204.A O no hydrogen 3.057 N/A LYS 220.A NZ ASP 228.A OD2 no hydrogen 2.920 N/A ASN 221.A ND2 ALA 69.A O no hydrogen 3.025 N/A ASN 221.A ND2 ASP 224.A OD2 no hydrogen 3.161 N/A ILE 222.A N ASP 202.A O no hydrogen 3.261 N/A ASP 224.A N ASN 221.A OD1 no hydrogen 2.742 N/A TYR 225.A N ASN 221.A O no hydrogen 3.055 N/A TYR 225.A OH GLY 262.A OXT no hydrogen 2.737 N/A VAL 226.A N ILE 222.A O no hydrogen 2.939 N/A SER 227.A N ASP 223.A O no hydrogen 3.005 N/A SER 227.A OG ASP 223.A O no hydrogen 3.159 N/A ASP 228.A N ASP 224.A O no hydrogen 2.874 N/A ARG 229.A N TYR 225.A O no hydrogen 2.962 N/A ARG 229.A NE GLU 232.A OE1 no hydrogen 3.468 N/A ARG 229.A NH2 GLU 232.A OE1 no hydrogen 2.947 N/A ILE 230.A N VAL 226.A O no hydrogen 2.818 N/A ALA 231.A N SER 227.A O no hydrogen 2.927 N/A GLU 232.A N ASP 228.A O no hydrogen 2.984 N/A GLY 233.A N ARG 229.A O no hydrogen 2.732 N/A SER 234.A N ALA 231.A O no hydrogen 3.125 N/A SER 234.A OG ILE 230.A O no hydrogen 2.788 N/A ARG 237.A NH1 ARG 237.A O no hydrogen 3.475 N/A LYS 238.A N LYS 235.A O no hydrogen 2.819 N/A LYS 238.A NZ SER 234.A O no hydrogen 2.794 N/A GLY 242.A N LYS 238.A O no hydrogen 3.262 N/A GLY 242.A N PRO 239.A O no hydrogen 2.950 N/A THR 243.A N GLY 240.A O no hydrogen 2.971 N/A THR 243.A OG1 GLY 240.A O no hydrogen 2.594 N/A GLY 244.A N PRO 239.A O no hydrogen 3.054 N/A LEU 245.A N THR 243.A OG1 no hydrogen 3.295 N/A ASN 246.A N LYS 261.A O no hydrogen 2.884 N/A TRP 247.A NE1 THR 243.A OG1 no hydrogen 3.247 N/A THR 248.A N GLN 259.A O no hydrogen 2.873 N/A TYR 249.A N THR 248.A OG1 no hydrogen 2.628 N/A ALA 250.A N LYS 257.A O no hydrogen 2.990 N/A LYS 257.A NZ GLU 130.A OE2 no hydrogen 2.734 N/A MET 258.A N TYR 131.A O no hydrogen 3.016 N/A GLN 259.A N THR 248.A O no hydrogen 2.959 N/A PHE 260.A N ALA 129.A O no hydrogen 2.869 N/A LYS 261.A N ASN 246.A O no hydrogen 2.929 N/A LYS 261.A NZ SER 127.A OG no hydrogen 2.877 N/A LYS 261.A NZ GLN 259.A OE1 no hydrogen 2.768 N/A GLY 262.A N VAL 126.A O no hydrogen 2.920 N/A