Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8p78_J.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A NH2 ASP 55.A OD2 no hydrogen 2.337 N/A TYR 3.A OH ASP 55.A OD2 no hydrogen 3.120 N/A LEU 6.A N LYS 19.A O no hydrogen 2.777 N/A ASP 7.A N LYS 19.A O no hydrogen 2.966 N/A GLY 10.A N VAL 17.A O no hydrogen 3.175 N/A GLY 12.A N ALA 15.A O no hydrogen 2.634 N/A THR 16.A OG1 TYR 18.A OH no hydrogen 2.280 N/A VAL 17.A N GLY 10.A O no hydrogen 2.792 N/A TYR 18.A N ILE 25.A O no hydrogen 2.896 N/A LYS 19.A N ASP 7.A O no hydrogen 2.856 N/A ALA 20.A N VAL 23.A O no hydrogen 2.885 N/A ARG 21.A N GLU 4.A O no hydrogen 3.140 N/A VAL 23.A N ALA 20.A O no hydrogen 2.908 N/A ALA 24.A N PHE 67.A O no hydrogen 2.892 N/A ILE 25.A N TYR 18.A O no hydrogen 2.888 N/A LYS 26.A N LEU 65.A O no hydrogen 2.866 N/A LYS 26.A NZ GLU 38.A OE1 no hydrogen 3.121 N/A LYS 27.A N THR 16.A O no hydrogen 2.917 N/A ASP 29.A N ASP 29.A OD1 no hydrogen 2.441 N/A THR 34.A N ASN 32.A OD1 no hydrogen 2.872 N/A ALA 35.A N ASN 32.A OD1 no hydrogen 3.224 N/A LEU 36.A N ASN 32.A O no hydrogen 3.090 N/A ARG 37.A N ARG 33.A O no hydrogen 2.874 N/A ARG 37.A NH1 GLY 133.A O no hydrogen 2.821 N/A GLU 38.A N THR 34.A O no hydrogen 2.989 N/A ILE 39.A N ALA 35.A O no hydrogen 2.912 N/A LYS 40.A N LEU 36.A O no hydrogen 2.860 N/A LEU 41.A N ARG 37.A O no hydrogen 3.008 N/A LEU 42.A N GLU 38.A O no hydrogen 2.927 N/A GLN 43.A N ILE 39.A O no hydrogen 2.990 N/A GLU 44.A N LEU 41.A O no hydrogen 3.077 N/A LEU 45.A N LEU 42.A O no hydrogen 3.485 N/A SER 46.A N TYR 103.A OH no hydrogen 3.009 N/A ASN 49.A N HIS 47.A ND1 no hydrogen 2.934 N/A ASN 49.A ND2 LEU 127.A O no hydrogen 2.913 N/A ILE 50.A N HIS 47.A O no hydrogen 3.100 N/A ILE 51.A N LEU 129.A O no hydrogen 3.017 N/A LEU 54.A N VAL 66.A O no hydrogen 2.876 N/A PHE 57.A N SER 64.A O no hydrogen 3.018 N/A HIS 59.A N ASN 62.A O no hydrogen 2.729 N/A ASN 62.A N HIS 59.A O no hydrogen 2.909 N/A SER 64.A N PHE 57.A O no hydrogen 2.432 N/A VAL 66.A N ASP 55.A O no hydrogen 2.792 N/A PHE 67.A N ALA 24.A O no hydrogen 2.850 N/A THR 72.A N LEU 121.A O no hydrogen 2.954 N/A THR 72.A OG1 ASP 73.A O no hydrogen 3.210 N/A LEU 74.A N PRO 116.A O no hydrogen 3.132 N/A LEU 74.A N LEU 119.A O no hydrogen 2.933 N/A VAL 76.A N ASP 73.A OD1 no hydrogen 2.890 N/A ILE 77.A N ASP 73.A O no hydrogen 3.418 N/A ILE 78.A N LEU 74.A O no hydrogen 2.865 N/A LYS 79.A N GLU 75.A O no hydrogen 2.917 N/A ASP 80.A N ILE 77.A O no hydrogen 3.256 N/A SER 82.A N ASP 80.A OD1 no hydrogen 3.173 N/A SER 82.A OG ASP 80.A OD1 no hydrogen 2.369 N/A LEU 83.A N ASP 80.A O no hydrogen 3.025 N/A SER 88.A OG GLY 276.A O no hydrogen 2.720 N/A HIS 89.A N THR 86.A OG1 no hydrogen 3.359 N/A HIS 89.A ND1 THR 278.A OG1 no hydrogen 2.549 N/A ILE 90.A N THR 86.A O no hydrogen 3.077 N/A LYS 91.A N PRO 87.A O no hydrogen 2.898 N/A LYS 91.A NZ TYR 270.A O no hydrogen 2.645 N/A LYS 91.A NZ ASN 273.A O no hydrogen 2.958 N/A LYS 91.A NZ PRO 275.A O no hydrogen 2.892 N/A ALA 92.A N SER 88.A O no hydrogen 2.898 N/A TYR 93.A N HIS 89.A O no hydrogen 2.966 N/A MET 94.A N ILE 90.A O no hydrogen 2.920 N/A LEU 95.A N LYS 91.A O no hydrogen 2.824 N/A MET 96.A N ALA 92.A O no hydrogen 2.999 N/A THR 97.A N TYR 93.A O no hydrogen 2.968 N/A THR 97.A OG1 TYR 93.A O no hydrogen 2.719 N/A LEU 98.A N MET 94.A O no hydrogen 2.891 N/A GLN 99.A N LEU 95.A O no hydrogen 2.874 N/A GLY 100.A N MET 96.A O no hydrogen 2.996 N/A LEU 101.A N THR 97.A O no hydrogen 2.918 N/A GLU 102.A N LEU 98.A O no hydrogen 2.776 N/A TYR 103.A N GLN 99.A O no hydrogen 3.006 N/A LEU 104.A N GLY 100.A O no hydrogen 2.908 N/A HIS 105.A N LEU 101.A O no hydrogen 2.805 N/A HIS 105.A NE2 ASP 171.A OD2 no hydrogen 2.824 N/A GLN 106.A N GLU 102.A O no hydrogen 2.910 N/A HIS 107.A N TYR 103.A O no hydrogen 3.215 N/A HIS 107.A ND1 TYR 103.A O no hydrogen 2.874 N/A TRP 108.A N HIS 105.A O no hydrogen 2.878 N/A ILE 109.A N LEU 104.A O no hydrogen 3.081 N/A LEU 110.A N LYS 136.A O no hydrogen 2.905 N/A HIS 111.A N ASP 171.A OD2 no hydrogen 2.949 N/A HIS 111.A NE2 ALA 130.A O no hydrogen 2.612 N/A ARG 112.A N ASP 171.A OD1 no hydrogen 2.928 N/A ARG 112.A NE LEU 134.A O no hydrogen 2.669 N/A ARG 112.A NH1 TYR 166.A OH no hydrogen 3.026 N/A ARG 112.A NH2 LEU 134.A O no hydrogen 2.630 N/A ASP 113.A N HIS 111.A ND1 no hydrogen 2.960 N/A LYS 115.A NZ THR 151.A OG1 no hydrogen 3.077 N/A ASN 118.A N LYS 115.A O no hydrogen 2.927 N/A ASN 118.A ND2 ASP 113.A O no hydrogen 2.566 N/A ASN 118.A ND2 ASP 113.A OD2 no hydrogen 2.669 N/A ASN 118.A ND2 ASP 131.A OD2 no hydrogen 3.556 N/A LEU 119.A N PRO 116.A O no hydrogen 3.164 N/A LEU 120.A N LYS 128.A O no hydrogen 2.943 N/A LEU 121.A N THR 72.A O no hydrogen 2.610 N/A ASP 122.A N VAL 126.A O no hydrogen 3.173 N/A GLU 123.A N GLU 123.A OE1 no hydrogen 2.514 N/A ASN 124.A N ASP 122.A OD1 no hydrogen 3.102 N/A GLY 125.A N ASP 122.A O no hydrogen 3.117 N/A VAL 126.A N ASP 122.A OD1 no hydrogen 2.704 N/A LYS 128.A N LEU 120.A O no hydrogen 2.860 N/A LYS 128.A NZ PRO 48.A O no hydrogen 2.932 N/A LEU 129.A N ASN 49.A O no hydrogen 3.047 N/A ALA 130.A N ASN 118.A O no hydrogen 2.954 N/A PHE 132.A N GLU 38.A OE2 no hydrogen 3.408 N/A ALA 135.A N PHE 132.A O no hydrogen 3.118 N/A LYS 136.A N LEU 110.A O no hydrogen 3.024 N/A PHE 138.A N TRP 108.A O no hydrogen 2.887 N/A ARG 143.A N SER 140.A O no hydrogen 3.237 N/A TYR 145.A N ARG 164.A O no hydrogen 3.172 N/A VAL 149.A N HIS 147.A O no hydrogen 2.706 N/A ARG 152.A NE ASP 194.A OD1 no hydrogen 2.888 N/A ARG 152.A NH2 ASP 194.A OD1 no hydrogen 3.134 N/A TRP 153.A NE1 GLY 191.A O no hydrogen 2.722 N/A TYR 154.A N THR 151.A O no hydrogen 2.908 N/A TYR 154.A OH GLU 181.A OE1 no hydrogen 2.535 N/A ARG 155.A N ARG 152.A O no hydrogen 3.128 N/A ARG 155.A NE VAL 150.A O no hydrogen 3.107 N/A ARG 155.A NH2 VAL 150.A O no hydrogen 3.145 N/A GLU 158.A N GLU 158.A OE1 no hydrogen 2.942 N/A LEU 160.A N ALA 156.A O no hydrogen 3.032 N/A PHE 161.A N PRO 157.A O no hydrogen 2.705 N/A GLY 162.A N LEU 159.A O no hydrogen 2.859 N/A ALA 163.A N GLU 158.A O no hydrogen 2.821 N/A TYR 166.A OH THR 146.A O no hydrogen 2.909 N/A VAL 170.A N GLY 167.A O no hydrogen 3.398 N/A MET 172.A N VAL 168.A O no hydrogen 3.029 N/A TRP 173.A N GLY 169.A O no hydrogen 2.875 N/A ALA 174.A N VAL 170.A O no hydrogen 3.046 N/A VAL 175.A N ASP 171.A O no hydrogen 2.840 N/A GLY 176.A N MET 172.A O no hydrogen 2.876 N/A CYS 177.A N TRP 173.A O no hydrogen 2.938 N/A CYS 177.A SG TRP 153.A O no hydrogen 3.762 N/A CYS 177.A SG TRP 173.A O no hydrogen 3.495 N/A ILE 178.A N ALA 174.A O no hydrogen 2.902 N/A LEU 179.A N VAL 175.A O no hydrogen 2.890 N/A ALA 180.A N GLY 176.A O no hydrogen 2.900 N/A GLU 181.A N CYS 177.A O no hydrogen 2.879 N/A LEU 182.A N ILE 178.A O no hydrogen 2.857 N/A LEU 183.A N LEU 179.A O no hydrogen 2.936 N/A LEU 184.A N ALA 180.A O no hydrogen 2.880 N/A ARG 185.A N GLU 181.A O no hydrogen 2.694 N/A ARG 185.A NE ILE 78.A O no hydrogen 2.643 N/A ARG 185.A NH1 LEU 83.A O no hydrogen 2.946 N/A ARG 185.A NH2 ILE 78.A O no hydrogen 2.945 N/A ARG 185.A NH2 LEU 83.A O no hydrogen 3.073 N/A GLY 191.A N LEU 189.A O no hydrogen 2.885 N/A GLY 191.A N GLN 197.A OE1 no hydrogen 2.966 N/A ASP 192.A N ASP 196.A OD2 no hydrogen 3.392 N/A ASP 196.A N SER 193.A OG no hydrogen 3.270 N/A GLN 197.A N SER 193.A O no hydrogen 2.683 N/A GLN 197.A NE2 LEU 189.A O no hydrogen 2.909 N/A LEU 198.A N ASP 194.A O no hydrogen 2.956 N/A THR 199.A N LEU 195.A O no hydrogen 2.893 N/A THR 199.A OG1 LEU 195.A O no hydrogen 3.033 N/A ARG 200.A N ASP 196.A O no hydrogen 2.887 N/A ARG 200.A NE ASP 196.A OD2 no hydrogen 2.985 N/A ILE 201.A N GLN 197.A O no hydrogen 2.946 N/A PHE 202.A N LEU 198.A O no hydrogen 2.930 N/A GLU 203.A N THR 199.A O no hydrogen 2.860 N/A THR 204.A N ARG 200.A O no hydrogen 2.958 N/A THR 204.A OG1 ARG 200.A O no hydrogen 2.974 N/A LEU 205.A N ILE 201.A O no hydrogen 2.861 N/A THR 207.A N PHE 228.A O no hydrogen 2.983 N/A THR 207.A OG1 LYS 226.A O no hydrogen 2.477 N/A THR 209.A OG1 GLU 211.A OE1 no hydrogen 2.208 N/A GLU 211.A N GLU 211.A OE1 no hydrogen 3.112 N/A GLN 212.A N THR 209.A O no hydrogen 3.277 N/A GLN 212.A NE2 THR 209.A OG1 no hydrogen 2.872 N/A TRP 213.A N GLU 210.A O no hydrogen 3.372 N/A MET 216.A N TRP 213.A O no hydrogen 2.990 N/A SER 218.A N ASP 215.A O no hydrogen 2.877 N/A LEU 219.A N MET 216.A O no hydrogen 3.197 N/A ASP 221.A N PHE 161.A O no hydrogen 2.860 N/A LYS 226.A NZ SER 227.A O no hydrogen 3.168 N/A PHE 228.A N THR 207.A OG1 no hydrogen 2.826 N/A PHE 228.A N LYS 226.A O no hydrogen 2.776 N/A ILE 231.A N THR 204.A O no hydrogen 2.725 N/A HIS 235.A N PRO 232.A O no hydrogen 2.860 N/A ILE 236.A N PRO 232.A O no hydrogen 3.197 N/A PHE 237.A N LEU 233.A O no hydrogen 2.660 N/A ALA 240.A N PHE 237.A O no hydrogen 3.295 N/A LEU 244.A N ASP 243.A OD1 no hydrogen 2.662 N/A LEU 245.A N GLY 241.A O no hydrogen 2.866 N/A ASP 246.A N ASP 242.A O no hydrogen 2.896 N/A LEU 247.A N ASP 243.A O no hydrogen 2.959 N/A ILE 248.A N LEU 244.A O no hydrogen 2.888 N/A GLN 249.A N LEU 245.A O no hydrogen 2.880 N/A GLY 250.A N ASP 246.A O no hydrogen 2.944 N/A LEU 251.A N LEU 247.A O no hydrogen 2.918 N/A PHE 252.A N ILE 248.A O no hydrogen 2.952 N/A PHE 252.A N GLN 249.A O no hydrogen 3.193 N/A CYS 257.A N ASN 255.A OD1 no hydrogen 3.058 N/A ARG 259.A N ASN 255.A O no hydrogen 2.898 N/A ARG 259.A NE LEU 253.A O no hydrogen 2.876 N/A ARG 259.A NH1 GLU 158.A OE1 no hydrogen 3.090 N/A ARG 259.A NH1 GLU 158.A OE2 no hydrogen 2.628 N/A ARG 259.A NH1 GLY 169.A O no hydrogen 2.779 N/A ARG 259.A NH2 GLU 158.A OE1 no hydrogen 2.721 N/A ARG 259.A NH2 LEU 253.A O no hydrogen 3.154 N/A ARG 259.A NH2 PHE 254.A O no hydrogen 3.062 N/A ILE 260.A N GLY 250.A O no hydrogen 3.227 N/A THR 261.A N GLN 264.A OE1 no hydrogen 2.909 N/A THR 263.A OG1 GLU 102.A OE2 no hydrogen 2.950 N/A GLN 264.A N THR 261.A OG1 no hydrogen 3.063 N/A ALA 265.A N THR 261.A O no hydrogen 2.770 N/A LEU 266.A N ALA 262.A O no hydrogen 2.880 N/A LYS 267.A N THR 263.A O no hydrogen 3.013 N/A MET 268.A N ALA 265.A O no hydrogen 3.083 N/A PHE 271.A N MET 268.A O no hydrogen 3.181 N/A SER 272.A OG LYS 269.A O no hydrogen 3.375 N/A ASN 273.A ND2 ASP 243.A OD2 no hydrogen 3.070 N/A THR 278.A N SER 88.A O no hydrogen 3.200 N/A THR 278.A OG1 HIS 89.A ND1 no hydrogen 2.549 N/A GLN 282.A N PRO 279.A O no hydrogen 2.846 N/A LEU 283.A N GLY 280.A O no hydrogen 3.151 N/A ARG 285.A NE GLU 71.A OE1 no hydrogen 2.582 N/A ARG 285.A NE GLU 71.A OE2 no hydrogen 3.244 N/A ARG 285.A NH2 GLU 71.A OE2 no hydrogen 2.540 N/A