Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4bdg_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 9.A N PRO 5.A O no hydrogen 3.062 N/A ASP 10.A N LYS 6.A O no hydrogen 2.838 N/A GLU 11.A N LEU 8.A O no hydrogen 3.015 N/A TYR 12.A N LEU 8.A O no hydrogen 2.856 N/A ILE 13.A N PHE 27.A O no hydrogen 2.890 N/A SER 15.A N LEU 25.A O no hydrogen 2.747 N/A LEU 18.A N VAL 23.A O no hydrogen 2.671 N/A GLY 19.A N VAL 23.A O no hydrogen 3.219 N/A GLU 22.A N ILE 39.A O no hydrogen 3.483 N/A VAL 23.A N GLY 19.A O no hydrogen 2.743 N/A LYS 24.A N ILE 37.A O no hydrogen 3.017 N/A LYS 24.A NZ TYR 4.A OH no hydrogen 3.342 N/A LYS 24.A NZ THR 17.A OG1 no hydrogen 3.410 N/A LEU 25.A N LYS 16.A O no hydrogen 2.940 N/A ALA 26.A N VAL 35.A O no hydrogen 3.014 N/A PHE 27.A N ILE 13.A O no hydrogen 2.893 N/A GLU 28.A N LYS 33.A O no hydrogen 2.994 N/A ARG 29.A N GLU 11.A O no hydrogen 2.934 N/A ARG 29.A NE ARG 9.A O no hydrogen 3.090 N/A ARG 29.A NH2 ARG 9.A O no hydrogen 2.688 N/A CYS 32.A N GLU 28.A O no hydrogen 2.762 N/A CYS 32.A SG ARG 29.A O no hydrogen 3.992 N/A LYS 33.A N THR 31.A OG1 no hydrogen 3.382 N/A VAL 35.A N ALA 26.A O no hydrogen 2.828 N/A ALA 36.A N LEU 75.A O no hydrogen 2.811 N/A ILE 37.A N LYS 24.A O no hydrogen 2.712 N/A LYS 38.A N ILE 73.A O no hydrogen 2.773 N/A ILE 39.A N GLU 22.A O no hydrogen 2.998 N/A ILE 40.A N TYR 71.A O no hydrogen 2.859 N/A LYS 42.A N ASP 70.A OD1 no hydrogen 3.402 N/A LYS 42.A NZ ASP 67.A OD1 no hydrogen 2.676 N/A LYS 42.A NZ ALA 68.A O no hydrogen 2.771 N/A GLU 47.A N ASN 43.A O no hydrogen 3.198 N/A ILE 48.A N VAL 44.A O no hydrogen 2.839 N/A GLU 49.A N GLU 45.A O no hydrogen 2.985 N/A ILE 50.A N THR 46.A O no hydrogen 2.820 N/A LEU 51.A N GLU 47.A O no hydrogen 2.938 N/A LYS 52.A N ILE 48.A O no hydrogen 2.880 N/A LYS 53.A N GLU 49.A O no hydrogen 3.422 N/A LYS 53.A N ILE 50.A O no hydrogen 3.124 N/A LEU 54.A N ILE 50.A O no hydrogen 3.101 N/A ASN 55.A N TYR 111.A OH no hydrogen 2.852 N/A CYS 58.A N HIS 56.A ND1 no hydrogen 2.997 N/A CYS 58.A SG GLN 104.A OE1 no hydrogen 3.766 N/A ILE 59.A N HIS 56.A O no hydrogen 3.264 N/A ILE 60.A N ILE 140.A O no hydrogen 3.003 N/A LYS 61.A N GLU 76.A OE1 no hydrogen 3.122 N/A LYS 61.A NZ ASN 55.A OD1 no hydrogen 3.184 N/A LYS 61.A NZ HIS 56.A O no hydrogen 3.071 N/A LYS 63.A N VAL 74.A O no hydrogen 2.666 N/A ASN 64.A N VAL 74.A O no hydrogen 3.275 N/A ASN 64.A ND2 TYR 12.A OH no hydrogen 3.323 N/A PHE 65.A N ASN 64.A OD1 no hydrogen 2.801 N/A PHE 66.A N TYR 72.A O no hydrogen 2.729 N/A ALA 68.A N ASP 70.A O no hydrogen 2.951 N/A TYR 71.A N ILE 40.A O no hydrogen 2.754 N/A TYR 72.A N PHE 66.A O no hydrogen 2.751 N/A ILE 73.A N LYS 38.A O no hydrogen 2.804 N/A VAL 74.A N ASN 64.A O no hydrogen 2.836 N/A LEU 75.A N ALA 36.A O no hydrogen 2.716 N/A GLY 80.A N LEU 129.A O no hydrogen 2.863 N/A GLY 81.A N MET 78.A O no hydrogen 3.276 N/A LEU 83.A N VAL 127.A O no hydrogen 2.834 N/A PHE 84.A N PRO 124.A O no hydrogen 2.977 N/A ASP 85.A N GLU 82.A O no hydrogen 3.311 N/A LYS 86.A N LEU 83.A O no hydrogen 2.813 N/A VAL 87.A N PHE 84.A O no hydrogen 3.166 N/A VAL 88.A N PHE 84.A O no hydrogen 2.835 N/A ASN 90.A ND2 GLY 197.A O no hydrogen 3.510 N/A LYS 91.A NZ ASP 85.A O no hydrogen 2.766 N/A ARG 92.A NH1 LEU 195.A O no hydrogen 3.270 N/A ARG 92.A NH1 VAL 225.A O no hydrogen 2.855 N/A ARG 92.A NH2 VAL 225.A O no hydrogen 3.160 N/A LEU 93.A N CYS 194.A O no hydrogen 3.435 N/A LYS 94.A NZ GLU 134.A OE1 no hydrogen 3.543 N/A LYS 94.A NZ GLU 134.A OE2 no hydrogen 2.952 N/A THR 97.A OG1 GLU 134.A OE1 no hydrogen 3.230 N/A CYS 98.A N LYS 94.A O no hydrogen 3.079 N/A CYS 98.A SG LEU 93.A O no hydrogen 3.679 N/A CYS 98.A SG LYS 94.A O no hydrogen 3.502 N/A LYS 99.A N GLU 95.A O no hydrogen 3.034 N/A LYS 99.A NZ TRP 259.A O no hydrogen 2.978 N/A LYS 99.A NZ ASP 262.A OD2 no hydrogen 2.767 N/A LEU 100.A N ALA 96.A O no hydrogen 3.000 N/A TYR 101.A N THR 97.A O no hydrogen 3.084 N/A TYR 101.A OH GLU 134.A O no hydrogen 2.602 N/A PHE 102.A N CYS 98.A O no hydrogen 2.709 N/A TYR 103.A N LYS 99.A O no hydrogen 2.792 N/A GLN 104.A NE2 LEU 100.A O no hydrogen 3.033 N/A GLN 104.A NE2 CYS 136.A O no hydrogen 3.250 N/A MET 105.A N TYR 101.A O no hydrogen 2.979 N/A LEU 106.A N PHE 102.A O no hydrogen 2.761 N/A LEU 107.A N TYR 103.A O no hydrogen 2.913 N/A ALA 108.A N GLN 104.A O no hydrogen 2.872 N/A VAL 109.A N MET 105.A O no hydrogen 2.928 N/A GLN 110.A N LEU 106.A O no hydrogen 2.801 N/A GLN 110.A NE2 GLU 252.A OE2 no hydrogen 3.539 N/A TYR 111.A N LEU 107.A O no hydrogen 3.084 N/A LEU 112.A N ALA 108.A O no hydrogen 3.109 N/A HIS 113.A N VAL 109.A O no hydrogen 3.113 N/A HIS 113.A NE2 ASP 183.A OD2 no hydrogen 2.874 N/A GLU 114.A N GLN 110.A O no hydrogen 2.779 N/A ASN 115.A N TYR 111.A O no hydrogen 2.891 N/A ASN 115.A ND2 TYR 111.A O no hydrogen 2.720 N/A GLY 116.A N HIS 113.A O no hydrogen 2.965 N/A ILE 117.A N LEU 112.A O no hydrogen 2.730 N/A ILE 118.A N LYS 147.A O no hydrogen 3.064 N/A HIS 119.A N ASP 183.A OD2 no hydrogen 3.041 N/A HIS 119.A NE2 THR 141.A O no hydrogen 2.696 N/A ARG 120.A N ASP 183.A OD1 no hydrogen 2.852 N/A ASP 121.A N HIS 119.A ND1 no hydrogen 3.119 N/A ASN 126.A N LYS 123.A O no hydrogen 2.981 N/A ASN 126.A ND2 ASP 121.A O no hydrogen 2.588 N/A ASN 126.A ND2 ASP 121.A OD2 no hydrogen 3.325 N/A LEU 128.A N LYS 139.A O no hydrogen 2.769 N/A LEU 129.A N GLY 81.A O no hydrogen 2.866 N/A SER 130.A N LEU 137.A O no hydrogen 2.778 N/A SER 130.A OG LEU 137.A O no hydrogen 3.162 N/A GLU 133.A N SER 131.A OG no hydrogen 3.262 N/A CYS 136.A SG TYR 101.A OH no hydrogen 3.794 N/A CYS 136.A SG SER 131.A O no hydrogen 4.041 N/A CYS 136.A SG GLU 133.A O no hydrogen 3.411 N/A CYS 136.A SG LEU 137.A O no hydrogen 3.785 N/A LEU 137.A N SER 130.A OG no hydrogen 3.054 N/A ILE 138.A N GLN 104.A OE1 no hydrogen 2.734 N/A LYS 139.A N LEU 128.A O no hydrogen 2.804 N/A LYS 139.A NZ PRO 57.A O no hydrogen 3.226 N/A LYS 139.A NZ ILE 59.A O no hydrogen 3.403 N/A LYS 139.A NZ GLU 76.A OE1 no hydrogen 3.093 N/A ILE 140.A N CYS 58.A O no hydrogen 2.955 N/A THR 141.A N ASN 126.A O no hydrogen 2.742 N/A SER 146.A N PHE 143.A O no hydrogen 3.184 N/A SER 146.A OG PHE 143.A O no hydrogen 2.530 N/A LYS 147.A N ILE 118.A O no hydrogen 2.872 N/A LEU 149.A N GLY 116.A O no hydrogen 2.831 N/A LEU 154.A N GLU 151.A O no hydrogen 2.730 N/A MET 155.A N GLU 151.A O no hydrogen 3.000 N/A ARG 156.A N THR 152.A O no hydrogen 2.813 N/A THR 157.A N SER 153.A O no hydrogen 3.365 N/A THR 157.A OG1 SER 153.A O no hydrogen 2.627 N/A LEU 158.A N LEU 154.A O no hydrogen 2.823 N/A CYS 159.A N ARG 156.A O no hydrogen 3.258 N/A CYS 159.A SG MET 155.A O no hydrogen 3.497 N/A GLY 160.A N THR 157.A O no hydrogen 3.184 N/A LEU 165.A N PRO 162.A O no hydrogen 2.858 N/A GLU 168.A N GLU 168.A OE1 no hydrogen 2.792 N/A VAL 169.A N ALA 166.A O no hydrogen 3.239 N/A VAL 171.A N PRO 167.A O no hydrogen 2.847 N/A SER 172.A N GLU 168.A O no hydrogen 2.970 N/A SER 172.A OG GLU 168.A O no hydrogen 3.082 N/A SER 172.A OG VAL 169.A O no hydrogen 2.443 N/A GLY 174.A N VAL 171.A O no hydrogen 3.136 N/A THR 175.A N SER 172.A O no hydrogen 3.122 N/A THR 175.A OG1 SER 172.A O no hydrogen 3.159 N/A ALA 176.A N SER 172.A O no hydrogen 2.902 N/A ALA 181.A N TYR 178.A O no hydrogen 3.197 N/A VAL 182.A N ASN 179.A O no hydrogen 3.054 N/A ASP 183.A N ARG 180.A O no hydrogen 3.102 N/A CYS 184.A N ALA 181.A O no hydrogen 3.038 N/A CYS 184.A SG PHE 249.A O no hydrogen 3.495 N/A TRP 185.A N ALA 181.A O no hydrogen 3.092 N/A SER 186.A N VAL 182.A O no hydrogen 3.199 N/A SER 186.A OG VAL 182.A O no hydrogen 3.120 N/A LEU 187.A N ASP 183.A O no hydrogen 3.063 N/A GLY 188.A N CYS 184.A O no hydrogen 3.093 N/A VAL 189.A N TRP 185.A O no hydrogen 2.913 N/A ILE 190.A N SER 186.A O no hydrogen 2.831 N/A LEU 191.A N LEU 187.A O no hydrogen 2.784 N/A PHE 192.A N GLY 188.A O no hydrogen 3.255 N/A ILE 193.A N VAL 189.A O no hydrogen 3.217 N/A CYS 194.A N ILE 190.A O no hydrogen 3.002 N/A CYS 194.A SG ILE 190.A O no hydrogen 3.392 N/A LEU 195.A N LEU 191.A O no hydrogen 3.155 N/A SER 196.A N PHE 192.A O no hydrogen 3.055 N/A SER 196.A OG PHE 192.A O no hydrogen 2.828 N/A GLY 197.A N ILE 193.A O no hydrogen 2.776 N/A TYR 198.A N SER 196.A OG no hydrogen 2.970 N/A TYR 198.A OH ASN 220.A O no hydrogen 2.641 N/A SER 202.A N GLN 213.A OE1 no hydrogen 3.380 N/A ASP 212.A N SER 209.A OG no hydrogen 3.279 N/A GLN 213.A N SER 209.A O no hydrogen 2.967 N/A GLN 213.A NE2 SER 202.A O no hydrogen 2.736 N/A GLN 213.A NE2 VAL 208.A O no hydrogen 2.963 N/A ILE 214.A N LEU 210.A O no hydrogen 3.116 N/A THR 215.A N LYS 211.A O no hydrogen 2.915 N/A THR 215.A OG1 LYS 211.A O no hydrogen 3.186 N/A THR 215.A OG1 ASP 212.A O no hydrogen 3.281 N/A SER 216.A N ASP 212.A O no hydrogen 2.928 N/A SER 216.A OG ASP 212.A O no hydrogen 2.729 N/A SER 216.A OG GLN 213.A O no hydrogen 2.938 N/A LYS 218.A N GLN 213.A O no hydrogen 3.038 N/A LYS 218.A N SER 216.A OG no hydrogen 3.345 N/A ASN 220.A N PRO 200.A O no hydrogen 2.877 N/A ILE 222.A N TYR 198.A OH no hydrogen 2.811 N/A VAL 225.A N ILE 222.A O no hydrogen 3.203 N/A TRP 226.A N ILE 222.A O no hydrogen 3.245 N/A TRP 226.A NE1 TYR 198.A OH no hydrogen 2.896 N/A ALA 227.A N PRO 223.A O no hydrogen 2.769 N/A VAL 229.A N TRP 226.A O no hydrogen 2.871 N/A SER 230.A N GLU 95.A OE1 no hydrogen 2.888 N/A SER 230.A OG GLU 95.A OE2 no hydrogen 3.037 N/A ALA 233.A N SER 230.A OG no hydrogen 3.074 N/A LEU 234.A N SER 230.A O no hydrogen 3.343 N/A ASP 235.A N GLU 231.A O no hydrogen 2.838 N/A LEU 236.A N LYS 232.A O no hydrogen 3.130 N/A VAL 237.A N ALA 233.A O no hydrogen 3.281 N/A LYS 238.A N LEU 234.A O no hydrogen 2.934 N/A LYS 239.A N ASP 235.A O no hydrogen 2.916 N/A LYS 239.A NZ ASP 235.A OD2 no hydrogen 2.627 N/A LEU 240.A N LEU 236.A O no hydrogen 2.991 N/A LEU 240.A N VAL 237.A O no hydrogen 3.077 N/A LEU 241.A N VAL 237.A O no hydrogen 2.850 N/A LYS 246.A N ASP 244.A OD1 no hydrogen 3.014 N/A LYS 246.A NZ GLY 174.A O no hydrogen 2.988 N/A ALA 247.A N ASP 244.A O no hydrogen 3.139 N/A ARG 248.A N ASP 244.A O no hydrogen 2.931 N/A ARG 248.A NE VAL 242.A O no hydrogen 2.805 N/A ARG 248.A NH1 ALA 181.A O no hydrogen 2.793 N/A ARG 248.A NH2 VAL 242.A O no hydrogen 3.086 N/A PHE 249.A N LYS 239.A O no hydrogen 3.346 N/A THR 250.A N GLU 253.A OE1 no hydrogen 3.246 N/A THR 250.A OG1 GLU 252.A OE1 no hydrogen 3.201 N/A THR 251.A OG1 GLU 252.A OE2 no hydrogen 3.329 N/A GLU 253.A N THR 250.A OG1 no hydrogen 3.209 N/A ALA 254.A N THR 250.A O no hydrogen 3.005 N/A LEU 255.A N THR 251.A O no hydrogen 2.867 N/A ARG 256.A N GLU 252.A O no hydrogen 3.031 N/A HIS 257.A N ALA 254.A O no hydrogen 2.916 N/A HIS 257.A NE2 ASP 235.A OD2 no hydrogen 2.994 N/A TRP 259.A N HIS 257.A ND1 no hydrogen 2.882 N/A TRP 259.A NE1 GLU 95.A OE2 no hydrogen 2.723 N/A LEU 260.A N HIS 257.A O no hydrogen 2.983 N/A GLN 261.A N PRO 258.A O no hydrogen 3.107 N/A GLN 261.A NE2 LEU 255.A O no hydrogen 2.791 N/A GLN 261.A NE2 HIS 257.A O no hydrogen 3.025 N/A ASP 262.A N LEU 260.A O no hydrogen 2.801 N/A MET 265.A N ASP 262.A OD1 no hydrogen 2.814 N/A LYS 266.A N ASP 262.A O no hydrogen 2.981 N/A ARG 267.A N GLU 263.A O no hydrogen 2.907 N/A ARG 267.A NH1 ASP 264.A OD1 no hydrogen 2.872 N/A ARG 267.A NH2 ASP 264.A OD1 no hydrogen 3.356 N/A LYS 268.A N ASP 264.A O no hydrogen 2.967 N/A PHE 269.A N MET 265.A O no hydrogen 3.101 N/A GLN 270.A N LYS 266.A O no hydrogen 3.103 N/A ASP 271.A N ARG 267.A O no hydrogen 2.854 N/A LEU 272.A N LYS 268.A O no hydrogen 2.989 N/A LEU 273.A N PHE 269.A O no hydrogen 2.882 N/A SER 274.A N GLN 270.A O no hydrogen 3.076 N/A SER 274.A OG GLN 270.A O no hydrogen 3.188 N/A SER 274.A OG ASP 271.A O no hydrogen 3.139 N/A GLU 275.A N ASP 271.A O no hydrogen 3.219 N/A GLU 276.A N LEU 272.A O no hydrogen 3.162 N/A ASN 277.A N LEU 273.A O no hydrogen 2.911 N/A GLU 278.A N SER 274.A O no hydrogen 2.820 N/A THR 280.A N ASN 277.A O no hydrogen 3.307 N/A THR 280.A OG1 ASN 277.A O no hydrogen 3.544 N/A