Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5d51_S.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A NH1 ILE 36.A O no hydrogen 2.867 N/A VAL 5.A N SER 37.A O no hydrogen 2.872 N/A LEU 6.A N ILE 68.A O no hydrogen 2.919 N/A TRP 7.A N TYR 40.A O no hydrogen 2.833 N/A TRP 7.A NE1 GLU 72.A OE1 no hydrogen 2.986 N/A LEU 8.A N ALA 70.A O no hydrogen 2.829 N/A HIS 9.A NE2 SER 17.A OG no hydrogen 3.200 N/A GLY 10.A N GLU 72.A O no hydrogen 2.844 N/A LEU 11.A N ASN 74.A O no hydrogen 2.848 N/A THR 14.A OG1 GLU 12.A OE1.A no hydrogen 3.067 N/A THR 14.A OG1 GLU 12.A OE1.B no hydrogen 2.655 N/A SER 17.A N GLU 72.A OE2 no hydrogen 3.048 N/A SER 17.A OG HIS 9.A NE2 no hydrogen 3.200 N/A SER 17.A OG GLU 72.A OE1 no hydrogen 2.449 N/A SER 17.A OG GLU 72.A OE2 no hydrogen 3.558 N/A GLU 18.A N THR 14.A O no hydrogen 3.178 N/A SER 19.A N CYS 15.A O no hydrogen 2.814 N/A SER 19.A OG PRO 147.A O no hydrogen 2.700 N/A PHE 20.A N CYS 16.A O no hydrogen 2.927 N/A ILE 21.A N SER 17.A O no hydrogen 3.265 N/A ARG 22.A N SER 19.A O no hydrogen 2.891 N/A ARG 22.A NH1 GLU 18.A OE1 no hydrogen 2.822 N/A ARG 22.A NH2 GLU 18.A OE1 no hydrogen 3.209 N/A SER 23.A N PHE 20.A O no hydrogen 3.202 N/A SER 23.A OG PRO 26.A O no hydrogen 2.615 N/A SER 23.A OG THR 153.A OG1 no hydrogen 2.736 N/A ALA 24.A N GLU 150.A OE2 no hydrogen 3.026 N/A VAL 31.A N LEU 27.A O no hydrogen 2.973 N/A VAL 32.A N ALA 28.A O no hydrogen 2.918 N/A LEU 33.A N LYS 29.A O no hydrogen 2.921 N/A SER 34.A N ASP 30.A O no hydrogen 2.873 N/A MET 35.A N VAL 31.A O no hydrogen 3.050 N/A ILE 36.A N VAL 31.A O no hydrogen 2.932 N/A SER 37.A N THR 3.A O no hydrogen 2.935 N/A SER 37.A OG ASP 39.A OD1 no hydrogen 2.531 N/A ASP 39.A N VAL 5.A O no hydrogen 3.029 N/A THR 43.A N ASP 41.A OD1 no hydrogen 3.197 N/A THR 43.A OG1 ASP 41.A OD1 no hydrogen 3.297 N/A LEU 44.A N ASP 41.A O no hydrogen 3.186 N/A MET 45.A N ASP 41.A O no hydrogen 3.070 N/A GLN 51.A N ALA 48.A O no hydrogen 3.112 N/A ALA 52.A N ALA 48.A O no hydrogen 3.213 N/A GLU 53.A N GLY 49.A O no hydrogen 3.024 N/A ALA 54.A N HIS 50.A O no hydrogen 3.018 N/A ILE 55.A N ALA 52.A O no hydrogen 3.156 N/A LEU 56.A N GLU 53.A O no hydrogen 3.274 N/A GLU 58.A N ALA 54.A O no hydrogen 3.325 N/A ILE 59.A N ILE 55.A O no hydrogen 3.015 N/A MET 60.A N LEU 56.A O no hydrogen 3.044 N/A THR 61.A N.A GLU 57.A O no hydrogen 3.198 N/A THR 61.A N.B GLU 57.A O no hydrogen 3.225 N/A THR 61.A OG1.A GLU 57.A O no hydrogen 2.909 N/A THR 61.A OG1.B GLU 57.A O no hydrogen 3.045 N/A THR 61.A OG1.B GLU 58.A O no hydrogen 2.784 N/A LYS 62.A N GLU 58.A O no hydrogen 3.112 N/A TYR 63.A N ILE 59.A O no hydrogen 2.847 N/A GLY 65.A N ASP 101.A O no hydrogen 2.774 N/A ASN 66.A N TYR 63.A O no hydrogen 2.738 N/A TYR 67.A OH VAL 98.A O no hydrogen 2.580 N/A ILE 68.A N PRO 4.A O no hydrogen 2.895 N/A LEU 69.A N ALA 104.A O no hydrogen 2.996 N/A ALA 70.A N LEU 6.A O no hydrogen 2.908 N/A VAL 71.A N ILE 106.A O no hydrogen 2.779 N/A GLU 72.A N LEU 8.A O no hydrogen 2.937 N/A ASN 74.A N LEU 11.A O no hydrogen 2.977 N/A ASN 74.A ND2 CYS 111.A O no hydrogen 2.853 N/A ASN 74.A ND2 GLY 115.A O no hydrogen 2.988 N/A LEU 77.A N GLN 126.A O no hydrogen 3.068 N/A ASN 78.A N THR 125.A O no hydrogen 2.931 N/A ASN 78.A ND2 PRO 124.A O no hydrogen 3.020 N/A GLN 79.A NE2 PRO 124.A O no hydrogen 3.234 N/A GLY 81.A N ASN 78.A O no hydrogen 2.871 N/A MET 82.A N GLN 79.A O no hydrogen 2.868 N/A SER 83.A OG ASN 78.A O no hydrogen 3.566 N/A SER 83.A OG GLN 79.A OE1 no hydrogen 2.748 N/A CYS 84.A N GLY 81.A O no hydrogen 3.312 N/A ILE 86.A N ARG 89.A O no hydrogen 2.821 N/A ARG 89.A N ILE 86.A O no hydrogen 3.058 N/A PHE 91.A N CYS 84.A O no hydrogen 2.828 N/A GLU 93.A N PRO 90.A O no hydrogen 3.054 N/A LEU 95.A N PHE 91.A O no hydrogen 2.850 N/A LYS 96.A N ILE 92.A O no hydrogen 3.040 N/A TYR 97.A N GLU 93.A O no hydrogen 3.061 N/A VAL 98.A N GLN 94.A O no hydrogen 2.964 N/A ALA 99.A N LEU 95.A O no hydrogen 2.895 N/A LYS 100.A N.A LYS 96.A O no hydrogen 3.265 N/A LYS 100.A N.B LYS 96.A O no hydrogen 3.292 N/A LYS 100.A NZ.A TYR 97.A O no hydrogen 3.197 N/A ALA 102.A N ALA 99.A O no hydrogen 3.278 N/A LYS 103.A N TYR 67.A O no hydrogen 2.789 N/A LYS 103.A NZ ASN 66.A OD1 no hydrogen 3.304 N/A LYS 103.A NZ ASP 163.A OD1 no hydrogen 2.851 N/A ILE 105.A N PRO 138.A O no hydrogen 2.987 N/A ILE 106.A N LEU 69.A O no hydrogen 2.832 N/A SER 107.A N ILE 140.A O no hydrogen 2.848 N/A TRP 108.A N VAL 71.A O no hydrogen 2.845 N/A GLY 109.A N VAL 142.A O no hydrogen 2.776 N/A SER 110.A N GLY 144.A O no hydrogen 2.955 N/A SER 110.A OG CYS 248.A O no hydrogen 2.734 N/A SER 113.A N GLY 109.A O no hydrogen 2.970 N/A SER 113.A OG SER 107.A O no hydrogen 3.330 N/A SER 113.A OG GLY 109.A O no hydrogen 2.768 N/A TRP 114.A N SER 110.A O no hydrogen 2.824 N/A GLY 115.A N SER 110.A O no hydrogen 2.848 N/A GLN 118.A N GLN 118.A OE1 no hydrogen 2.767 N/A GLN 118.A NE2 ASN 74.A OD1 no hydrogen 2.952 N/A ALA 119.A N CYS 116.A O no hydrogen 3.023 N/A ALA 120.A N VAL 117.A O no hydrogen 3.008 N/A LYS 121.A N ASP 255.A OD2 no hydrogen 2.998 N/A ASN 123.A N ALA 120.A O no hydrogen 2.786 N/A ASN 123.A ND2 ALA 127.A O no hydrogen 3.104 N/A GLN 126.A N ASN 123.A O no hydrogen 3.078 N/A GLN 126.A NE2.A ASN 78.A OD1 no hydrogen 2.994 N/A ALA 127.A N ASN 123.A OD1 no hydrogen 2.854 N/A THR 128.A N PRO 75.A O no hydrogen 3.006 N/A THR 128.A OG1 GLN 126.A O no hydrogen 2.830 N/A VAL 130.A N ALA 112.A O no hydrogen 3.009 N/A LYS 132.A N PRO 129.A O no hydrogen 3.087 N/A VAL 133.A N VAL 130.A O no hydrogen 2.961 N/A ILE 134.A N VAL 130.A O no hydrogen 2.793 N/A LYS 137.A NZ LYS 100.A O.A no hydrogen 3.119 N/A LYS 137.A NZ LYS 100.A O.B no hydrogen 3.229 N/A LYS 137.A NZ ALA 102.A O no hydrogen 2.754 N/A ILE 140.A N ILE 105.A O no hydrogen 2.928 N/A LYS 141.A N GLY 172.A O no hydrogen 2.884 N/A LYS 141.A NZ GLN 171.A O no hydrogen 2.865 N/A VAL 142.A N SER 107.A O no hydrogen 2.991 N/A GLY 144.A N SER 110.A OG no hydrogen 2.932 N/A GLU 150.A N GLU 150.A OE1 no hydrogen 2.876 N/A MET 152.A N ILE 148.A O no hydrogen 3.095 N/A THR 153.A N ALA 149.A O no hydrogen 2.997 N/A THR 153.A OG1 SER 23.A OG no hydrogen 2.736 N/A THR 153.A OG1 ALA 149.A O no hydrogen 3.321 N/A GLY 154.A N GLU 150.A O no hydrogen 2.811 N/A VAL 155.A N VAL 151.A O no hydrogen 2.919 N/A ILE 156.A N MET 152.A O no hydrogen 3.206 N/A THR 157.A N THR 153.A O no hydrogen 2.849 N/A THR 157.A OG1 THR 153.A O no hydrogen 2.810 N/A TYR 158.A N GLY 154.A O no hydrogen 3.014 N/A MET 159.A N VAL 155.A O no hydrogen 3.005 N/A LEU 160.A N ILE 156.A O no hydrogen 2.882 N/A THR 161.A N THR 157.A O no hydrogen 2.916 N/A THR 161.A OG1 THR 157.A O no hydrogen 2.851 N/A PHE 162.A N TYR 158.A O no hydrogen 2.950 N/A ASP 163.A N MET 159.A O no hydrogen 2.800 N/A ARG 164.A NH1 ASP 163.A O no hydrogen 2.852 N/A ASP 169.A N ARG 173.A O no hydrogen 2.821 N/A GLY 172.A N ASP 169.A O no hydrogen 2.975 N/A ARG 173.A N ASP 169.A OD1 no hydrogen 2.889 N/A ARG 173.A NE ASP 169.A OD2 no hydrogen 2.823 N/A ARG 173.A NH1 GLU 250.A OE2 no hydrogen 2.937 N/A ARG 173.A NH2 ASP 169.A OD2 no hydrogen 3.226 N/A LYS 175.A N GLU 167.A O no hydrogen 2.961 N/A LYS 175.A NZ GLU 167.A OE2 no hydrogen 2.927 N/A PHE 177.A N PRO 174.A O no hydrogen 3.096 N/A TYR 178.A N PRO 174.A O no hydrogen 2.972 N/A TYR 178.A OH PRO 143.A O no hydrogen 2.617 N/A SER 179.A OG.A LYS 175.A O no hydrogen 2.488 N/A SER 179.A OG.B LYS 175.A O no hydrogen 3.361 N/A ARG 181.A N ASP 184.A OD2 no hydrogen 2.980 N/A ILE 182.A N THR 222.A O no hydrogen 2.885 N/A HIS 183.A N GLY 219.A O no hydrogen 3.276 N/A ASP 184.A N ARG 181.A O no hydrogen 3.061 N/A CYS 186.A N ILE 182.A O no hydrogen 3.113 N/A ARG 188.A NE TYR 187.A OH no hydrogen 2.988 N/A ARG 188.A NH1 PHE 210.A O no hydrogen 2.740 N/A ARG 188.A NH2 TYR 187.A OH no hydrogen 3.193 N/A ARG 189.A N CYS 186.A O no hydrogen 2.977 N/A ARG 189.A NE ASP 193.A OD1 no hydrogen 2.935 N/A ARG 189.A NH1 HIS 183.A O no hydrogen 2.995 N/A HIS 191.A N ARG 188.A O no hydrogen 2.964 N/A HIS 191.A ND1 GLN 196.A OE1 no hydrogen 2.751 N/A PHE 192.A N ARG 188.A O no hydrogen 3.182 N/A ASP 193.A N ARG 189.A O no hydrogen 2.789 N/A ALA 194.A N PRO 190.A O no hydrogen 3.068 N/A ALA 194.A N HIS 191.A O no hydrogen 3.124 N/A GLY 195.A N PHE 192.A O no hydrogen 3.067 N/A GLN 196.A N HIS 191.A O no hydrogen 2.766 N/A VAL 198.A N CYS 211.A O no hydrogen 2.961 N/A GLU 199.A N.A ASP 203.A OD2 no hydrogen 2.979 N/A GLU 199.A N.B ASP 203.A OD2 no hydrogen 2.988 N/A GLU 200.A N ASP 203.A OD2 no hydrogen 3.090 N/A ASP 203.A N GLU 200.A O no hydrogen 3.189 N/A SER 205.A OG PHE 197.A O no hydrogen 3.465 N/A ALA 206.A N ASP 203.A OD1 no hydrogen 2.793 N/A ARG 207.A N ASP 203.A O no hydrogen 3.188 N/A ARG 207.A NE ASP 202.A OD1 no hydrogen 2.847 N/A ARG 207.A NH2 ASP 202.A OD1 no hydrogen 3.443 N/A ARG 207.A NH2 ASP 202.A OD2 no hydrogen 3.056 N/A LYS 208.A N GLU 204.A O no hydrogen 3.174 N/A LYS 208.A N SER 205.A O no hydrogen 3.165 N/A GLY 209.A N ALA 206.A O no hydrogen 3.138 N/A PHE 210.A N SER 205.A O no hydrogen 2.976 N/A CYS 211.A N GLN 196.A O no hydrogen 3.040 N/A TYR 213.A OH LEU 263.A O no hydrogen 2.775 N/A MET 215.A N LEU 212.A O no hydrogen 2.924 N/A GLY 216.A N TYR 213.A O no hydrogen 3.063 N/A CYS 217.A N LEU 212.A O no hydrogen 3.202 N/A LYS 218.A N CYS 245.A O no hydrogen 2.808 N/A LYS 218.A NZ GLY 216.A O no hydrogen 2.804 N/A LYS 218.A NZ SER 258.A O no hydrogen 3.400 N/A LYS 218.A NZ ASP 261.A O no hydrogen 2.862 N/A THR 221.A N LYS 218.A O no hydrogen 3.085 N/A THR 221.A OG1 LYS 218.A O no hydrogen 3.309 N/A THR 222.A N GLY 219.A O no hydrogen 3.417 N/A THR 222.A OG1 LYS 218.A O no hydrogen 2.663 N/A TYR 223.A N GLU 250.A OE2 no hydrogen 2.908 N/A ASN 224.A N GLN 180.A O no hydrogen 3.198 N/A ALA 225.A N ASN 224.A OD1 no hydrogen 2.789 N/A SER 227.A OG.A ILE 182.A O no hydrogen 3.369 N/A SER 227.A OG.B ILE 182.A O no hydrogen 2.908 N/A THR 228.A N ALA 225.A O no hydrogen 3.244 N/A THR 228.A OG1 ALA 225.A O no hydrogen 3.269 N/A THR 229.A N ALA 225.A O no hydrogen 2.887 N/A ARG 230.A N ALA 225.A O no hydrogen 3.372 N/A ARG 230.A NH1 GLN 240.A OE1 no hydrogen 2.766 N/A TRP 231.A N SER 236.A O no hydrogen 2.778 N/A THR 235.A N TRP 231.A O no hydrogen 2.840 N/A THR 235.A OG1 ASN 232.A O no hydrogen 2.685 N/A SER 236.A OG PHE 237.A O no hydrogen 3.412 N/A SER 236.A OG SER 241.A OG no hydrogen 2.716 N/A SER 241.A N PHE 237.A O no hydrogen 3.080 N/A SER 241.A OG SER 236.A OG no hydrogen 2.716 N/A GLY 242.A N ILE 239.A O no hydrogen 2.999 N/A HIS 243.A N PRO 238.A O no hydrogen 3.056 N/A HIS 243.A ND1 GLY 244.A O no hydrogen 2.838 N/A HIS 243.A NE2 TYR 260.A OH no hydrogen 2.759 N/A SER 249.A OG TYR 223.A O no hydrogen 2.755 N/A GLU 250.A N GLY 247.A O no hydrogen 2.921 N/A PHE 253.A N GLU 250.A O no hydrogen 3.220 N/A ASP 255.A N GLY 252.A O no hydrogen 3.090 N/A TYR 260.A N SER 258.A OG no hydrogen 3.137 N/A TYR 260.A OH HIS 243.A NE2 no hydrogen 2.759 N/A ASP 261.A N SER 258.A O no hydrogen 3.152 N/A ARG 262.A NH2 GLU 199.A OE1.A no hydrogen 3.500 N/A