Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4xli_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 9.A N GLU 6.A O no hydrogen 3.200 N/A ILE 10.A N ARG 7.A O no hydrogen 3.220 N/A THR 11.A N VAL 28.A O no hydrogen 2.848 N/A THR 11.A OG1 VAL 28.A O no hydrogen 3.319 N/A LYS 13.A N VAL 26.A O no hydrogen 2.988 N/A LEU 16.A N VAL 24.A O no hydrogen 2.563 N/A GLU 23.A N THR 40.A O no hydrogen 3.131 N/A VAL 24.A N GLY 17.A O no hydrogen 2.660 N/A TYR 25.A N VAL 38.A O no hydrogen 2.763 N/A TYR 25.A OH GLU 23.A OE1 no hydrogen 2.429 N/A VAL 26.A N HIS 14.A O no hydrogen 2.886 N/A GLY 27.A N VAL 36.A O no hydrogen 2.845 N/A VAL 28.A N THR 11.A O no hydrogen 2.968 N/A TRP 29.A N LEU 34.A O no hydrogen 2.974 N/A TYR 32.A N TRP 29.A O no hydrogen 2.942 N/A SER 33.A N LYS 30.A O no hydrogen 2.978 N/A VAL 36.A N GLY 27.A O no hydrogen 2.854 N/A ALA 37.A N THR 79.A O no hydrogen 2.703 N/A VAL 38.A N TYR 25.A O no hydrogen 2.868 N/A LYS 39.A N ILE 77.A O no hydrogen 2.810 N/A THR 40.A N GLU 23.A O no hydrogen 3.060 N/A THR 40.A OG1 PHE 75.A O no hydrogen 3.483 N/A GLU 45.A N GLU 45.A OE1 no hydrogen 2.776 N/A LEU 48.A N VAL 44.A O no hydrogen 2.897 N/A LYS 49.A N GLU 45.A O no hydrogen 3.152 N/A ALA 52.A N LEU 48.A O no hydrogen 2.891 N/A VAL 53.A N LYS 49.A O no hydrogen 3.066 N/A MET 54.A N GLU 50.A O no hydrogen 3.127 N/A LYS 55.A N ALA 51.A O no hydrogen 3.060 N/A GLU 56.A N VAL 53.A O no hydrogen 3.195 N/A ILE 57.A N MET 54.A O no hydrogen 3.525 N/A LYS 58.A N TYR 117.A OH no hydrogen 3.001 N/A LYS 58.A NZ LYS 55.A O no hydrogen 3.102 N/A HIS 59.A NE2 SER 113.A OG no hydrogen 2.969 N/A ASN 61.A ND2 GLN 110.A OE1 no hydrogen 3.402 N/A ASN 61.A ND2 VAL 141.A O no hydrogen 2.993 N/A LEU 62.A N HIS 59.A O no hydrogen 2.898 N/A VAL 63.A N VAL 143.A O no hydrogen 3.180 N/A GLN 64.A N GLU 80.A OE2 no hydrogen 2.835 N/A GLN 64.A NE2 ILE 57.A O no hydrogen 3.323 N/A LEU 66.A N VAL 78.A O no hydrogen 2.777 N/A GLY 67.A N VAL 78.A O no hydrogen 3.167 N/A VAL 68.A N TRP 3.A O no hydrogen 2.805 N/A CYS 69.A N TYR 76.A O no hydrogen 2.955 N/A CYS 69.A SG MET 5.A O no hydrogen 3.966 N/A THR 70.A N GLU 4.A OE1 no hydrogen 3.107 N/A THR 70.A OG1 GLU 4.A OE2 no hydrogen 2.443 N/A TYR 76.A N CYS 69.A O no hydrogen 3.041 N/A ILE 77.A N LYS 39.A O no hydrogen 2.914 N/A VAL 78.A N GLY 67.A O no hydrogen 2.943 N/A THR 79.A N ALA 37.A O no hydrogen 2.943 N/A THR 79.A OG1 GLU 80.A O no hydrogen 2.611 N/A GLU 80.A N GLN 64.A O no hydrogen 3.128 N/A TYR 84.A N VAL 135.A O no hydrogen 3.216 N/A TYR 84.A OH GLU 137.A OE1 no hydrogen 3.074 N/A TYR 84.A OH GLU 137.A OE2 no hydrogen 3.187 N/A GLY 85.A N MET 82.A O no hydrogen 3.509 N/A ASN 86.A ND2 ASP 89.A OD2 no hydrogen 3.407 N/A LEU 87.A N CYS 133.A O no hydrogen 2.839 N/A LEU 88.A N ASN 86.A OD1 no hydrogen 2.871 N/A ASP 89.A N ASN 86.A OD1 no hydrogen 3.122 N/A TYR 90.A N ASN 86.A O no hydrogen 3.177 N/A TYR 90.A OH HIS 139.A ND1 no hydrogen 3.382 N/A LEU 91.A N LEU 87.A O no hydrogen 2.994 N/A LEU 91.A N LEU 88.A O no hydrogen 3.145 N/A ARG 92.A N LEU 88.A O no hydrogen 3.049 N/A ARG 92.A NE GLY 200.A O no hydrogen 2.759 N/A ARG 92.A NH2 GLY 200.A O no hydrogen 3.172 N/A GLU 93.A N ASP 89.A O no hydrogen 3.170 N/A CYS 94.A N LEU 91.A O no hydrogen 3.444 N/A CYS 94.A SG LEU 91.A O no hydrogen 3.334 N/A CYS 94.A SG SER 95.A O no hydrogen 3.845 N/A GLU 98.A N SER 95.A O no hydrogen 2.989 N/A VAL 99.A N SER 95.A O no hydrogen 2.867 N/A VAL 102.A N THR 100.A OG1 no hydrogen 3.121 N/A VAL 103.A N THR 100.A O no hydrogen 2.962 N/A LEU 104.A N THR 100.A O no hydrogen 3.044 N/A LEU 105.A N ALA 101.A O no hydrogen 2.936 N/A TYR 106.A N VAL 102.A O no hydrogen 3.172 N/A MET 107.A N VAL 103.A O no hydrogen 2.921 N/A ALA 108.A N LEU 104.A O no hydrogen 3.029 N/A THR 109.A N LEU 105.A O no hydrogen 2.980 N/A THR 109.A OG1 LEU 105.A O no hydrogen 2.900 N/A GLN 110.A N TYR 106.A O no hydrogen 3.115 N/A GLN 110.A N MET 107.A O no hydrogen 3.193 N/A GLN 110.A NE2 TYR 106.A O no hydrogen 3.156 N/A GLN 110.A NE2 HIS 139.A O no hydrogen 3.137 N/A ILE 111.A N MET 107.A O no hydrogen 3.163 N/A SER 112.A N ALA 108.A O no hydrogen 3.015 N/A SER 112.A OG ALA 108.A O no hydrogen 3.130 N/A SER 112.A OG THR 109.A O no hydrogen 2.926 N/A SER 113.A N THR 109.A O no hydrogen 3.099 N/A SER 113.A OG HIS 59.A NE2 no hydrogen 2.969 N/A ALA 114.A N GLN 110.A O no hydrogen 3.167 N/A MET 115.A N ILE 111.A O no hydrogen 2.979 N/A GLU 116.A N SER 112.A O no hydrogen 2.888 N/A TYR 117.A N SER 113.A O no hydrogen 3.221 N/A LEU 118.A N ALA 114.A O no hydrogen 3.084 N/A GLU 119.A N MET 115.A O no hydrogen 2.907 N/A LYS 120.A N GLU 116.A O no hydrogen 3.321 N/A LYS 121.A N TYR 117.A O no hydrogen 3.359 N/A ASN 122.A N GLU 119.A O no hydrogen 3.112 N/A ASN 122.A ND2 GLY 154.A O no hydrogen 3.104 N/A PHE 123.A N LEU 118.A O no hydrogen 3.005 N/A ILE 124.A N ARG 150.A O no hydrogen 2.969 N/A HIS 125.A N ASP 185.A OD2 no hydrogen 2.807 N/A HIS 125.A NE2 ALA 144.A O no hydrogen 2.597 N/A ARG 126.A N ASP 185.A OD1 no hydrogen 3.017 N/A ARG 126.A NH1 LEU 148.A O no hydrogen 2.966 N/A ASP 127.A N HIS 125.A ND1 no hydrogen 3.074 N/A ALA 130.A N GLU 195.A OE2 no hydrogen 3.038 N/A ARG 131.A NH2 ASP 127.A OD1 no hydrogen 3.288 N/A ASN 132.A N ALA 129.A O no hydrogen 2.873 N/A ASN 132.A ND2 ASP 127.A O no hydrogen 2.662 N/A CYS 133.A N ALA 130.A O no hydrogen 3.301 N/A CYS 133.A SG ALA 129.A O no hydrogen 3.627 N/A LEU 134.A N LYS 142.A O no hydrogen 2.794 N/A VAL 135.A N GLY 85.A O no hydrogen 2.857 N/A GLY 136.A N VAL 140.A O no hydrogen 2.838 N/A VAL 140.A N GLU 137.A O no hydrogen 3.061 N/A VAL 141.A N GLN 110.A OE1 no hydrogen 2.858 N/A LYS 142.A N LEU 134.A O no hydrogen 2.960 N/A LYS 142.A NZ GLU 80.A OE1 no hydrogen 3.361 N/A LYS 142.A NZ GLU 80.A OE2 no hydrogen 3.205 N/A VAL 143.A N ASN 61.A O no hydrogen 2.805 N/A ALA 144.A N ASN 132.A O no hydrogen 3.054 N/A SER 149.A N PHE 146.A O no hydrogen 3.136 N/A SER 149.A OG HIS 125.A O no hydrogen 3.569 N/A SER 149.A OG PHE 146.A O no hydrogen 3.068 N/A ARG 150.A N ILE 124.A O no hydrogen 3.066 N/A ARG 150.A NH1 SER 149.A O no hydrogen 2.980 N/A MET 152.A N ASN 122.A O no hydrogen 3.103 N/A TYR 157.A N PHE 180.A O no hydrogen 2.757 N/A ALA 159.A N ASN 178.A O no hydrogen 3.140 N/A LYS 168.A NZ PRO 203.A O no hydrogen 2.834 N/A TRP 169.A N PRO 166.A O no hydrogen 3.210 N/A TRP 169.A NE1 GLU 195.A OE2 no hydrogen 3.008 N/A THR 170.A N ILE 167.A O no hydrogen 3.225 N/A THR 170.A OG1 PRO 166.A O no hydrogen 2.580 N/A GLU 173.A N GLU 173.A OE1 no hydrogen 2.865 N/A SER 174.A N ALA 171.A O no hydrogen 2.861 N/A SER 174.A OG THR 179.A O no hydrogen 2.965 N/A LEU 175.A N ALA 171.A O no hydrogen 3.000 N/A ALA 176.A N PRO 172.A O no hydrogen 2.743 N/A TYR 177.A N GLU 173.A O no hydrogen 3.128 N/A ASN 178.A ND2 ALA 159.A O no hydrogen 3.568 N/A PHE 180.A N TYR 157.A O no hydrogen 2.581 N/A SER 181.A N SER 184.A OG no hydrogen 2.948 N/A LYS 183.A N SER 181.A OG no hydrogen 2.869 N/A LYS 183.A NZ ARG 247.A O no hydrogen 3.061 N/A LYS 183.A NZ PRO 248.A O no hydrogen 3.047 N/A SER 184.A N SER 181.A O no hydrogen 3.026 N/A SER 184.A OG SER 181.A O no hydrogen 2.697 N/A ASP 185.A N SER 181.A O no hydrogen 3.330 N/A VAL 186.A N ILE 182.A O no hydrogen 2.907 N/A TRP 187.A N LYS 183.A O no hydrogen 3.170 N/A ALA 188.A N SER 184.A O no hydrogen 3.384 N/A PHE 189.A N ASP 185.A O no hydrogen 2.960 N/A GLY 190.A N VAL 186.A O no hydrogen 3.029 N/A VAL 191.A N TRP 187.A O no hydrogen 3.212 N/A VAL 191.A N ALA 188.A O no hydrogen 2.778 N/A LEU 192.A N ALA 188.A O no hydrogen 2.694 N/A LEU 193.A N PHE 189.A O no hydrogen 2.822 N/A TRP 194.A N GLY 190.A O no hydrogen 3.211 N/A TRP 194.A NE1 GLU 223.A O no hydrogen 2.819 N/A GLU 195.A N VAL 191.A O no hydrogen 2.943 N/A ILE 196.A N LEU 192.A O no hydrogen 2.812 N/A ALA 197.A N LEU 193.A O no hydrogen 2.831 N/A THR 198.A N TRP 194.A O no hydrogen 3.164 N/A THR 198.A OG1 TRP 194.A O no hydrogen 2.620 N/A THR 198.A OG1 GLU 195.A O no hydrogen 2.983 N/A TYR 199.A N ILE 196.A O no hydrogen 3.023 N/A TYR 199.A OH VAL 99.A O no hydrogen 2.721 N/A GLY 200.A N GLU 195.A O no hydrogen 2.980 N/A MET 201.A N THR 198.A OG1 no hydrogen 3.250 N/A ILE 207.A N TYR 204.A O no hydrogen 3.043 N/A SER 210.A OG ASP 208.A OD2 no hydrogen 3.410 N/A GLN 211.A N ASP 208.A O no hydrogen 2.928 N/A VAL 212.A N LEU 209.A O no hydrogen 3.284 N/A TYR 213.A OH GLU 217.A OE2 no hydrogen 3.083 N/A LEU 215.A N GLN 211.A O no hydrogen 2.910 N/A LEU 216.A N VAL 212.A O no hydrogen 2.991 N/A GLU 217.A N TYR 213.A O no hydrogen 2.905 N/A LYS 218.A N ASP 214.A O no hydrogen 3.002 N/A LYS 218.A N LEU 215.A O no hydrogen 3.069 N/A LYS 218.A NZ ASP 214.A OD1 no hydrogen 3.566 N/A GLY 219.A N LEU 216.A O no hydrogen 3.188 N/A TYR 220.A N LEU 215.A O no hydrogen 3.218 N/A ARG 221.A NE TRP 240.A O no hydrogen 3.020 N/A ARG 221.A NH1 LEU 216.A O no hydrogen 2.954 N/A ARG 221.A NH1 TYR 220.A O no hydrogen 2.872 N/A ARG 221.A NH2 TRP 240.A O no hydrogen 3.017 N/A GLU 223.A N GLU 223.A OE1 no hydrogen 2.900 N/A GLN 224.A NE2 CYS 228.A O no hydrogen 2.713 N/A CYS 228.A N PRO 225.A O no hydrogen 3.109 N/A CYS 228.A SG PRO 229.A O no hydrogen 3.625 N/A TYR 233.A N PRO 229.A O no hydrogen 3.046 N/A TYR 233.A OH MET 222.A O no hydrogen 2.611 N/A GLU 234.A N PRO 230.A O no hydrogen 2.829 N/A LEU 235.A N LYS 231.A O no hydrogen 2.970 N/A MET 236.A N VAL 232.A O no hydrogen 3.054 N/A ARG 237.A N TYR 233.A O no hydrogen 2.627 N/A ARG 237.A NH1 TYR 233.A OH no hydrogen 3.346 N/A ALA 238.A N GLU 234.A O no hydrogen 2.833 N/A CYS 239.A N LEU 235.A O no hydrogen 2.962 N/A CYS 239.A SG LEU 235.A O no hydrogen 3.374 N/A TRP 240.A N ARG 237.A O no hydrogen 2.969 N/A LYS 241.A N ALA 238.A O no hydrogen 3.159 N/A ASP 246.A N SER 243.A O no hydrogen 2.939 N/A ARG 247.A N PRO 244.A O no hydrogen 3.336 N/A ARG 247.A NE LYS 241.A O no hydrogen 2.855 N/A ARG 247.A NH1 GLU 173.A OE1 no hydrogen 3.488 N/A ARG 247.A NH1 GLU 173.A OE2 no hydrogen 2.988 N/A ARG 247.A NH1 LYS 183.A O no hydrogen 2.951 N/A ARG 247.A NH2 GLU 173.A OE1 no hydrogen 2.873 N/A ARG 247.A NH2 LYS 241.A O no hydrogen 3.240 N/A ARG 247.A NH2 TRP 242.A O no hydrogen 3.140 N/A PHE 250.A N GLU 119.A OE2 no hydrogen 2.673 N/A ALA 251.A N GLU 119.A OE1 no hydrogen 3.204 N/A GLU 252.A N SER 249.A OG no hydrogen 3.011 N/A THR 253.A N SER 249.A O no hydrogen 2.963 N/A THR 253.A OG1 SER 249.A O no hydrogen 3.340 N/A HIS 254.A N PHE 250.A O no hydrogen 2.746 N/A GLN 255.A N ALA 251.A O no hydrogen 2.818 N/A ALA 256.A N GLU 252.A O no hydrogen 2.864 N/A PHE 257.A N THR 253.A O no hydrogen 3.114 N/A GLU 258.A N HIS 254.A O no hydrogen 3.000 N/A THR 259.A N GLN 255.A O no hydrogen 3.029 N/A THR 259.A OG1 GLN 255.A O no hydrogen 2.892 N/A MET 260.A N ALA 256.A O no hydrogen 3.102 N/A PHE 261.A N PHE 257.A O no hydrogen 2.821 N/A HIS 262.A N GLU 258.A O no hydrogen 3.041 N/A HIS 262.A NE2 GLU 258.A OE2 no hydrogen 2.536 N/A ASP 263.A N THR 259.A O no hydrogen 3.175 N/A SER 264.A N MET 260.A O no hydrogen 3.037 N/A