Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3rl3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 6.A N GLU 219.A OE2 no hydrogen 2.844 N/A TYR 8.A N ASP 6.A OD1 no hydrogen 2.813 N/A SER 9.A N ASP 6.A O no hydrogen 3.060 N/A SER 9.A OG GLU 219.A OE1 no hydrogen 2.543 N/A SER 9.A OG GLU 219.A OE2 no hydrogen 3.556 N/A ASN 11.A N TYR 8.A O no hydrogen 3.012 N/A THR 13.A OG1 ARG 214.A O no hydrogen 3.546 N/A GLN 14.A N GLN 14.A OE1 no hydrogen 2.817 N/A ALA 15.A N ASN 11.A O no hydrogen 2.828 N/A PHE 16.A N PRO 12.A O no hydrogen 2.865 N/A THR 17.A N THR 13.A O no hydrogen 3.119 N/A THR 17.A OG1 THR 13.A O no hydrogen 3.515 N/A HIS 18.A N GLN 14.A O no hydrogen 2.842 N/A TYR 19.A N ALA 15.A O no hydrogen 2.933 N/A TYR 19.A OH ASP 6.A OD2 no hydrogen 2.480 N/A ASN 20.A N PHE 16.A O no hydrogen 2.957 N/A ILE 21.A N THR 17.A O no hydrogen 2.852 N/A ASN 22.A N HIS 18.A O no hydrogen 3.005 N/A GLN 23.A N TYR 19.A O no hydrogen 2.977 N/A SER 24.A N ASN 20.A O no hydrogen 3.027 N/A ARG 25.A N TYR 19.A O no hydrogen 3.144 N/A ARG 25.A NE GLN 225.A OE1 no hydrogen 2.798 N/A ARG 25.A NH1 ASN 222.A OD1 no hydrogen 2.986 N/A ARG 25.A NH2 ASN 222.A OD1 no hydrogen 2.822 N/A ARG 25.A NH2 GLN 225.A OE1 no hydrogen 2.767 N/A PHE 26.A N ASN 20.A OD1 no hydrogen 2.868 N/A GLN 27.A N SER 24.A O no hydrogen 3.231 N/A VAL 31.A N GLN 27.A O no hydrogen 3.086 N/A HIS 32.A N THR 246.A O no hydrogen 3.220 N/A HIS 32.A ND1 MET 33.A O no hydrogen 2.730 N/A VAL 34.A N THR 244.A O no hydrogen 2.892 N/A TYR 39.A OH PRO 268.A O no hydrogen 2.621 N/A THR 41.A N PRO 38.A O no hydrogen 3.014 N/A THR 41.A OG1 PRO 38.A O no hydrogen 2.729 N/A LYS 43.A NZ HIS 47.A O no hydrogen 2.851 N/A LYS 43.A NZ ASP 69.A OD2 no hydrogen 2.963 N/A HIS 47.A ND1 ALA 45.A O no hydrogen 2.860 N/A THR 48.A N LEU 273.A O no hydrogen 2.895 N/A THR 48.A OG1 ASN 275.A OD1 no hydrogen 2.693 N/A ARG 49.A N ASP 69.A OD2 no hydrogen 2.848 N/A ARG 49.A NE ASP 272.A OD1 no hydrogen 2.757 N/A ARG 49.A NH1 THR 41.A O no hydrogen 2.890 N/A ARG 49.A NH2 THR 41.A O no hydrogen 3.019 N/A ARG 49.A NH2 ASP 272.A OD1 no hydrogen 3.560 N/A ARG 49.A NH2 ASP 272.A OD2 no hydrogen 2.833 N/A PHE 50.A N PHE 271.A O no hydrogen 2.775 N/A VAL 51.A N ILE 70.A O no hydrogen 2.789 N/A CYS 52.A N ILE 269.A O no hydrogen 2.753 N/A ILE 53.A N LEU 72.A O no hydrogen 2.980 N/A SER 54.A N THR 257.A OG1 no hydrogen 3.411 N/A SER 54.A OG ASP 55.A OD2 no hydrogen 2.690 N/A SER 54.A OG THR 74.A OG1 no hydrogen 2.733 N/A ASP 55.A N GLY 75.A O no hydrogen 2.739 N/A THR 56.A OG1 HIS 73.A NE2 no hydrogen 2.805 N/A HIS 57.A N ASP 76.A O no hydrogen 2.907 N/A HIS 57.A ND1 GLU 79.A OE1 no hydrogen 2.828 N/A SER 58.A OG GLU 85.A OE2 no hydrogen 2.981 N/A ARG 59.A N THR 56.A O no hydrogen 2.804 N/A ILE 63.A N THR 60.A O no hydrogen 3.196 N/A GLN 64.A NE2 GLY 62.A O no hydrogen 3.209 N/A ASP 69.A N ARG 49.A O no hydrogen 2.853 N/A ILE 70.A N ARG 49.A O no hydrogen 3.152 N/A LEU 71.A N TYR 100.A O no hydrogen 2.955 N/A LEU 72.A N VAL 51.A O no hydrogen 2.830 N/A HIS 73.A N ILE 102.A O no hydrogen 2.878 N/A HIS 73.A NE2 THR 56.A OG1 no hydrogen 2.805 N/A THR 74.A N ILE 53.A O no hydrogen 3.120 N/A THR 74.A OG1 SER 54.A OG no hydrogen 2.733 N/A GLY 75.A N HIS 73.A ND1 no hydrogen 3.050 N/A ASP 76.A N GLU 109.A OE1 no hydrogen 2.803 N/A THR 78.A N GLU 109.A OE2 no hydrogen 2.854 N/A THR 78.A OG1 GLU 109.A OE2 no hydrogen 2.655 N/A GLU 79.A N GLU 85.A OE2 no hydrogen 2.815 N/A LEU 80.A N GLU 85.A OE1 no hydrogen 2.945 N/A GLY 81.A N THR 78.A OG1 no hydrogen 2.812 N/A LEU 82.A N GLU 85.A OE1 no hydrogen 3.139 N/A GLU 85.A N LEU 82.A O no hydrogen 2.828 N/A VAL 86.A N LEU 82.A O no hydrogen 3.060 N/A LYS 87.A N PRO 83.A O no hydrogen 2.905 N/A LYS 87.A NZ ASP 91.A OD2 no hydrogen 2.811 N/A LYS 88.A N SER 84.A O no hydrogen 2.982 N/A LYS 88.A NZ ASP 61.A OD1 no hydrogen 2.963 N/A LYS 88.A NZ ASP 61.A OD2 no hydrogen 3.254 N/A PHE 89.A N GLU 85.A O no hydrogen 3.034 N/A ASN 90.A N VAL 86.A O no hydrogen 2.880 N/A ASN 90.A ND2 THR 142.A OG1 no hydrogen 2.936 N/A ASP 91.A N LYS 87.A O no hydrogen 2.867 N/A TRP 92.A N LYS 88.A O no hydrogen 3.023 N/A LEU 93.A N PHE 89.A O no hydrogen 2.926 N/A GLY 94.A N ASN 90.A O no hydrogen 2.982 N/A ASN 95.A N TRP 92.A O no hydrogen 3.158 N/A LEU 96.A N LEU 93.A O no hydrogen 3.078 N/A TYR 98.A OH PRO 66.A O no hydrogen 2.633 N/A GLU 99.A N ASP 69.A O no hydrogen 3.014 N/A LYS 101.A NZ LEU 96.A O no hydrogen 3.000 N/A LYS 101.A NZ TYR 98.A O no hydrogen 2.947 N/A ILE 102.A N LEU 71.A O no hydrogen 2.790 N/A VAL 103.A N ILE 145.A O no hydrogen 2.936 N/A ILE 104.A N HIS 73.A O no hydrogen 3.074 N/A GLY 106.A N GLU 109.A OE1 no hydrogen 2.731 N/A HIS 108.A N ASP 76.A OD1 no hydrogen 2.904 N/A HIS 108.A ND1 GLU 79.A O no hydrogen 2.716 N/A GLU 109.A N GLY 106.A O no hydrogen 3.167 N/A THR 111.A OG1 GLY 81.A O no hydrogen 2.618 N/A PHE 112.A N GLU 109.A O no hydrogen 2.993 N/A ASP 113.A N LEU 110.A O no hydrogen 3.101 N/A LYS 114.A NZ THR 111.A O no hydrogen 2.906 N/A PHE 116.A N ASP 113.A OD1 no hydrogen 3.016 N/A MET 117.A N ASP 113.A O no hydrogen 2.999 N/A ALA 118.A N LYS 114.A O no hydrogen 3.052 N/A ASP 119.A N GLU 115.A O no hydrogen 3.014 N/A LEU 120.A N PHE 116.A O no hydrogen 3.133 N/A LEU 120.A N MET 117.A O no hydrogen 3.345 N/A VAL 126.A N PHE 123.A O.A no hydrogen 3.042 N/A SER 127.A N PHE 123.A O.A no hydrogen 3.051 N/A SER 127.A N PHE 123.A O.B no hydrogen 3.046 N/A SER 127.A OG PHE 123.A O.A no hydrogen 3.440 N/A SER 127.A OG PHE 123.A O.B no hydrogen 2.936 N/A LEU 129.A N VAL 126.A O no hydrogen 3.172 N/A LYS 130.A N ASP 133.A OD2 no hydrogen 2.829 N/A ASP 133.A N LYS 130.A O no hydrogen 2.792 N/A PHE 134.A N PRO 131.A O no hydrogen 3.232 N/A LEU 140.A N ASN 136.A O no hydrogen 3.242 N/A LEU 140.A N VAL 137.A O no hydrogen 3.001 N/A LEU 141.A N GLN 138.A O no hydrogen 3.029 N/A ASN 143.A N ASN 90.A OD1 no hydrogen 2.845 N/A ASN 143.A ND2 ASN 90.A O no hydrogen 2.945 N/A SER 144.A N LEU 141.A O no hydrogen 3.138 N/A SER 144.A OG LEU 141.A O no hydrogen 3.100 N/A ILE 145.A N LYS 101.A O no hydrogen 2.774 N/A TYR 146.A OH GLN 148.A OE1 no hydrogen 2.648 N/A LEU 147.A N VAL 103.A O no hydrogen 2.900 N/A GLN 148.A N SER 150.A OG no hydrogen 2.902 N/A SER 150.A N GLY 161.A O no hydrogen 3.336 N/A VAL 152.A N ILE 159.A O no hydrogen 2.837 N/A VAL 154.A N PHE 157.A O no hydrogen 2.958 N/A LYS 155.A NZ THR 48.A OG1 no hydrogen 2.752 N/A PHE 157.A N VAL 154.A O no hydrogen 2.798 N/A ARG 158.A N ASP 193.A OD2 no hydrogen 2.838 N/A ARG 158.A NH2 GLU 151.A OE1 no hydrogen 2.809 N/A ILE 159.A N VAL 152.A O no hydrogen 2.869 N/A TYR 160.A N ILE 194.A O no hydrogen 2.985 N/A GLY 161.A N SER 150.A O no hydrogen 2.971 N/A ALA 162.A N MET 196.A O no hydrogen 3.004 N/A TRP 164.A NE1 ASP 149.A OD1 no hydrogen 2.882 N/A TRP 164.A NE1 ASP 149.A OD2 no hydrogen 2.911 N/A THR 165.A N PHE 173.A O no hydrogen 2.961 N/A TRP 167.A N LEU 175.A O no hydrogen 2.749 N/A PHE 168.A N ASN 174.A OD1 no hydrogen 2.859 N/A ASN 169.A N ASN 174.A OD1 no hydrogen 3.279 N/A GLY 170.A N ASN 174.A OD1 no hydrogen 2.951 N/A GLY 172.A N ASN 107.A O no hydrogen 2.872 N/A PHE 173.A N ASP 113.A OD2 no hydrogen 2.768 N/A ASN 174.A ND2 GLY 172.A O no hydrogen 2.999 N/A LEU 175.A N THR 165.A O no hydrogen 2.957 N/A ARG 177.A NH1 VAL 215.A O no hydrogen 3.513 N/A ARG 177.A NH1 GLY 216.A O no hydrogen 3.002 N/A ARG 177.A NH2 VAL 215.A O no hydrogen 2.806 N/A GLN 179.A NE2 ASP 183.A OD1 no hydrogen 2.874 N/A LEU 182.A N GLY 178.A O no hydrogen 2.943 N/A ASP 183.A N GLN 179.A O no hydrogen 2.838 N/A LYS 184.A N LEU 181.A O no hydrogen 2.867 N/A TRP 185.A N LEU 181.A O no hydrogen 2.913 N/A ASN 186.A N LEU 182.A O no hydrogen 2.819 N/A LEU 187.A N LYS 184.A O no hydrogen 3.074 N/A ILE 188.A N TRP 185.A O no hydrogen 3.019 N/A GLU 190.A N GLU 190.A OE1 no hydrogen 2.814 N/A THR 192.A N PRO 189.A O no hydrogen 3.164 N/A THR 192.A OG1 PRO 189.A O no hydrogen 2.731 N/A ASP 193.A N ARG 158.A O no hydrogen 2.834 N/A ILE 194.A N ARG 158.A O no hydrogen 3.036 N/A LEU 195.A N LEU 232.A O no hydrogen 2.888 N/A MET 196.A N TYR 160.A O no hydrogen 2.790 N/A THR 197.A N VAL 234.A O no hydrogen 3.093 N/A THR 197.A OG1 GLY 199.A O no hydrogen 2.747 N/A THR 197.A OG1 HIS 233.A NE2 no hydrogen 2.824 N/A HIS 198.A ND1 THR 74.A O no hydrogen 2.815 N/A LEU 202.A N CYS 217.A O no hydrogen 3.044 N/A GLY 203.A N ASP 206.A OD2 no hydrogen 2.941 N/A PHE 204.A N PRO 201.A O no hydrogen 3.363 N/A ARG 205.A NE GLY 241.A O no hydrogen 2.688 N/A ARG 205.A NH2 GLY 241.A O no hydrogen 3.268 N/A ARG 205.A NH2 TYR 242.A O no hydrogen 3.055 N/A VAL 208.A N GLN 213.A O no hydrogen 2.901 N/A GLU 211.A N VAL 208.A O no hydrogen 3.104 N/A LEU 212.A N PRO 209.A O no hydrogen 3.318 N/A GLN 213.A N VAL 208.A O no hydrogen 3.489 N/A ARG 214.A N THR 13.A OG1 no hydrogen 2.996 N/A ARG 214.A NH1 ASP 206.A OD1 no hydrogen 2.777 N/A VAL 215.A N ASP 206.A O no hydrogen 2.978 N/A GLY 216.A N ASP 206.A OD2 no hydrogen 2.806 N/A CYS 217.A N PRO 200.A O no hydrogen 3.137 N/A LEU 221.A N CYS 217.A O no hydrogen 3.077 N/A ASN 222.A N VAL 218.A O no hydrogen 2.982 N/A ASN 222.A ND2 ASP 6.A OD2 no hydrogen 2.957 N/A THR 223.A N GLU 219.A O no hydrogen 2.906 N/A THR 223.A OG1 GLU 219.A O no hydrogen 2.814 N/A VAL 224.A N LEU 220.A O no hydrogen 2.878 N/A GLN 225.A N LEU 221.A O no hydrogen 2.916 N/A GLN 225.A NE2 ASP 247.A OD2 no hydrogen 2.930 N/A ARG 226.A N ASN 222.A O no hydrogen 2.861 N/A ARG 226.A NH2 TYR 19.A OH no hydrogen 3.441 N/A ARG 227.A N THR 223.A O no hydrogen 3.081 N/A ARG 227.A NH1 ILE 188.A O no hydrogen 2.934 N/A ARG 227.A NH1 GLU 190.A OE2 no hydrogen 2.960 N/A ARG 227.A NH2 ILE 188.A O no hydrogen 2.824 N/A VAL 228.A N THR 223.A O no hydrogen 2.895 N/A ARG 229.A N VAL 224.A O no hydrogen 2.741 N/A LEU 232.A N ASP 193.A O no hydrogen 3.179 N/A HIS 233.A N THR 251.A O no hydrogen 2.859 N/A HIS 233.A NE2 THR 197.A OG1 no hydrogen 2.824 N/A VAL 234.A N LEU 195.A O no hydrogen 2.877 N/A PHE 235.A N ILE 253.A O no hydrogen 2.944 N/A GLY 236.A N HIS 198.A O no hydrogen 2.885 N/A GLY 237.A N ASP 55.A OD2 no hydrogen 2.937 N/A ILE 238.A N GLY 236.A O no hydrogen 2.851 N/A HIS 239.A ND1 THR 259.A O no hydrogen 2.891 N/A HIS 239.A NE2 ASP 55.A OD1 no hydrogen 3.029 N/A GLU 240.A N GLU 240.A OE1 no hydrogen 2.644 N/A GLY 241.A N ILE 238.A O no hydrogen 2.939 N/A TYR 242.A N HIS 239.A O no hydrogen 3.159 N/A TYR 242.A OH PRO 267.A O no hydrogen 2.574 N/A GLY 243.A N ASN 254.A O no hydrogen 2.907 N/A MET 245.A N TYR 252.A O no hydrogen 2.894 N/A THR 246.A N HIS 32.A O no hydrogen 2.970 N/A THR 246.A OG1 THR 250.A O no hydrogen 3.100 N/A ASP 247.A N THR 250.A O no hydrogen 3.150 N/A GLY 248.A N THR 246.A OG1 no hydrogen 3.009 N/A TYR 249.A N ASP 247.A OD1 no hydrogen 2.885 N/A THR 250.A N ASP 247.A OD1 no hydrogen 2.820 N/A THR 250.A OG1 PRO 230.A O no hydrogen 2.699 N/A THR 251.A N LYS 231.A O no hydrogen 2.913 N/A TYR 252.A N MET 245.A O no hydrogen 2.791 N/A TYR 252.A OH ASP 247.A OD2 no hydrogen 2.798 N/A ILE 253.A N HIS 233.A O no hydrogen 2.897 N/A ASN 254.A N GLY 243.A O no hydrogen 2.837 N/A ASN 254.A ND2 ARG 205.A O no hydrogen 3.114 N/A ASN 254.A ND2 ILE 238.A O no hydrogen 2.927 N/A ALA 255.A N PHE 235.A O no hydrogen 2.782 N/A SER 256.A N ASN 254.A OD1 no hydrogen 3.141 N/A SER 256.A OG ILE 238.A O no hydrogen 3.529 N/A SER 256.A OG ASN 254.A OD1 no hydrogen 2.802 N/A THR 257.A N SER 54.A O no hydrogen 2.759 N/A THR 257.A OG1 SER 54.A O no hydrogen 3.043 N/A CYS 258.A N ASP 55.A O no hydrogen 3.231 N/A CYS 258.A SG ASP 55.A O no hydrogen 3.298 N/A CYS 258.A SG THR 56.A O no hydrogen 3.843 N/A THR 259.A N GLN 263.A O no hydrogen 2.929 N/A THR 259.A OG1 SER 261.A OG no hydrogen 3.323 N/A SER 261.A N THR 259.A OG1 no hydrogen 3.354 N/A SER 261.A OG THR 259.A OG1 no hydrogen 3.323 N/A PHE 262.A N THR 259.A O no hydrogen 2.894 N/A GLN 263.A N THR 259.A OG1 no hydrogen 3.234 N/A THR 265.A N GLN 263.A O no hydrogen 2.821 N/A ASN 266.A N THR 257.A O no hydrogen 2.961 N/A ASN 266.A ND2 SER 256.A O no hydrogen 2.896 N/A ILE 269.A N CYS 52.A O no hydrogen 3.084 N/A PHE 271.A N PHE 50.A O no hydrogen 2.883 N/A LEU 273.A N THR 48.A O no hydrogen 3.020 N/A ASN 275.A N GLY 46.A O no hydrogen 2.851 N/A