Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3qwl_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 5.A N GLY 1.A O no hydrogen 3.074 N/A SER 7.A N GLU 3.A O no hydrogen 3.034 N/A SER 7.A OG GLU 4.A O no hydrogen 2.686 N/A LEU 8.A N GLU 4.A O no hydrogen 2.884 N/A GLU 9.A N LYS 5.A O no hydrogen 2.824 N/A ILE 10.A N LYS 6.A O no hydrogen 2.989 N/A LEU 11.A N SER 7.A O no hydrogen 3.174 N/A LEU 12.A N LEU 8.A O no hydrogen 2.850 N/A LYS 13.A N ILE 10.A O no hydrogen 2.978 N/A ASP 14.A N LEU 11.A O no hydrogen 3.481 N/A LEU 17.A N PRO 49.A O no hydrogen 2.814 N/A LYS 21.A N ASP 18.A OD2 no hydrogen 3.176 N/A LEU 22.A N ASP 18.A O no hydrogen 2.995 N/A CYS 23.A N THR 19.A O no hydrogen 2.946 N/A CYS 23.A SG.A SER 209.A O no hydrogen 4.045 N/A CYS 23.A SG.B SER 209.A O no hydrogen 2.811 N/A THR 24.A N GLU 20.A O no hydrogen 3.081 N/A THR 24.A OG1 LYS 21.A O no hydrogen 3.247 N/A THR 24.A OG1 HIS 271.A ND1 no hydrogen 2.739 N/A PHE 25.A N LYS 21.A O no hydrogen 2.962 N/A SER 26.A N LEU 22.A O no hydrogen 3.011 N/A SER 26.A OG LEU 22.A O no hydrogen 2.779 N/A GLN 27.A N CYS 23.A O no hydrogen 2.960 N/A GLN 27.A NE2 LYS 206.A O no hydrogen 3.065 N/A GLN 27.A NE2 SER 209.A OG no hydrogen 2.470 N/A ARG 28.A N THR 24.A O no hydrogen 3.308 N/A ARG 28.A N PHE 25.A O no hydrogen 3.068 N/A ARG 28.A NH2 THR 268.A O no hydrogen 2.785 N/A PHE 29.A N PHE 25.A O no hydrogen 2.865 N/A LEU 31.A N ASP 205.A OD2 no hydrogen 3.140 N/A TYR 35.A N PRO 32.A O no hydrogen 2.994 N/A TYR 35.A OH GLU 9.A OE1 no hydrogen 2.643 N/A ARG 36.A N SER 33.A O no hydrogen 3.484 N/A ARG 36.A NE ASP 205.A OD1 no hydrogen 2.890 N/A ARG 36.A NH1 ASP 205.A OD1 no hydrogen 3.486 N/A ARG 36.A NH1 ASP 205.A OD2 no hydrogen 2.820 N/A ARG 36.A NH2 SER 33.A OG no hydrogen 3.152 N/A VAL 39.A N TYR 35.A O no hydrogen 2.951 N/A TRP 40.A N ARG 36.A O no hydrogen 2.809 N/A TRP 40.A NE1 ASP 205.A OD1 no hydrogen 2.880 N/A LYS 41.A N ALA 37.A O no hydrogen 2.880 N/A LYS 41.A NZ ASP 130.A OD1 no hydrogen 2.975 N/A LYS 41.A NZ ASP 130.A OD2 no hydrogen 3.262 N/A VAL 42.A N LEU 38.A O no hydrogen 3.018 N/A LEU 43.A N VAL 39.A O no hydrogen 2.810 N/A LEU 44.A N TRP 40.A O no hydrogen 2.952 N/A GLY 45.A N VAL 42.A O no hydrogen 3.071 N/A ILE 46.A N LYS 41.A O no hydrogen 2.754 N/A LEU 47.A N LYS 41.A O no hydrogen 3.191 N/A HIS 51.A N ASP 15.A O no hydrogen 3.245 N/A SER 53.A N HIS 50.A O no hydrogen 2.940 N/A HIS 54.A N HIS 51.A O no hydrogen 3.195 N/A HIS 54.A NE2 PRO 48.A O no hydrogen 2.749 N/A VAL 57.A N SER 53.A O no hydrogen 3.168 N/A MET 58.A N HIS 54.A O no hydrogen 2.945 N/A MET 59.A N ALA 55.A O no hydrogen 2.975 N/A TYR 60.A N LYS 56.A O no hydrogen 3.040 N/A ARG 61.A N VAL 57.A O no hydrogen 2.948 N/A ARG 61.A NH1 GLN 64.A OE1 no hydrogen 2.883 N/A LYS 62.A N MET 58.A O no hydrogen 2.803 N/A GLU 63.A N MET 59.A O no hydrogen 2.936 N/A GLN 64.A N TYR 60.A O no hydrogen 3.022 N/A TYR 65.A N ARG 61.A O no hydrogen 2.883 N/A LEU 66.A N LYS 62.A O no hydrogen 2.968 N/A ASP 67.A N GLU 63.A O no hydrogen 3.007 N/A VAL 68.A N GLN 64.A O no hydrogen 3.126 N/A VAL 68.A N TYR 65.A O no hydrogen 3.205 N/A LEU 69.A N TYR 65.A O no hydrogen 2.989 N/A HIS 70.A N LEU 66.A O no hydrogen 3.044 N/A ALA 71.A N ASP 67.A O no hydrogen 3.091 N/A LEU 72.A N VAL 68.A O no hydrogen 2.948 N/A LYS 73.A N LEU 69.A O no hydrogen 3.196 N/A VAL 74.A N HIS 70.A O no hydrogen 2.962 N/A VAL 75.A N ALA 71.A O no hydrogen 3.295 N/A ARG 76.A N LYS 73.A O no hydrogen 2.987 N/A PHE 77.A N LEU 72.A O no hydrogen 2.966 N/A SER 79.A N THR 82.A OG1 no hydrogen 2.904 N/A SER 79.A OG THR 82.A OG1 no hydrogen 3.429 N/A THR 82.A N SER 79.A O no hydrogen 3.445 N/A THR 82.A OG1 SER 79.A O no hydrogen 3.519 N/A THR 82.A OG1 SER 79.A OG no hydrogen 3.429 N/A GLN 84.A NE2 TYR 88.A OH no hydrogen 3.430 N/A VAL 87.A N PRO 83.A O no hydrogen 3.091 N/A TYR 88.A N GLN 84.A O no hydrogen 3.105 N/A TYR 88.A OH SER 128.A OG no hydrogen 3.122 N/A LEU 89.A N ALA 85.A O no hydrogen 3.133 N/A ARG 90.A N GLU 86.A O no hydrogen 2.949 N/A ARG 90.A NH1 GLN 93.A OE1 no hydrogen 2.932 N/A MET 91.A N VAL 87.A O no hydrogen 2.815 N/A TYR 92.A N TYR 88.A O no hydrogen 2.891 N/A GLN 93.A N LEU 89.A O no hydrogen 2.833 N/A GLN 93.A NE2 ASP 111.A OD1 no hydrogen 3.190 N/A LEU 94.A N ARG 90.A O no hydrogen 2.807 N/A GLU 95.A N MET 91.A O no hydrogen 2.915 N/A SER 96.A N TYR 92.A O no hydrogen 2.902 N/A SER 96.A OG TYR 92.A O no hydrogen 2.731 N/A GLY 97.A N LEU 94.A O no hydrogen 3.233 N/A LYS 98.A N GLN 93.A O no hydrogen 2.825 N/A SER 102.A OG SER 104.A OG no hydrogen 2.728 N/A SER 104.A N SER 102.A OG no hydrogen 3.145 N/A SER 104.A OG SER 102.A OG no hydrogen 2.728 N/A PHE 105.A N SER 102.A O no hydrogen 3.157 N/A GLU 108.A N ASP 111.A OD2 no hydrogen 2.827 N/A GLU 112.A N GLU 108.A O no hydrogen 3.024 N/A VAL 113.A N PRO 109.A O no hydrogen 3.098 N/A PHE 114.A N ASP 110.A O no hydrogen 3.037 N/A LEU 115.A N ASP 111.A O no hydrogen 2.884 N/A ALA 116.A N GLU 112.A O no hydrogen 2.927 N/A ILE 117.A N VAL 113.A O no hydrogen 3.037 N/A ALA 118.A N PHE 114.A O no hydrogen 2.900 N/A LYS 119.A N LEU 115.A O no hydrogen 3.055 N/A ALA 120.A N ALA 116.A O no hydrogen 3.200 N/A MET 121.A N ILE 117.A O no hydrogen 2.791 N/A GLU 122.A N ALA 118.A O no hydrogen 2.967 N/A GLU 123.A N ALA 120.A O no hydrogen 3.113 N/A MET 124.A N MET 121.A O no hydrogen 2.920 N/A VAL 125.A N MET 121.A O no hydrogen 2.942 N/A SER 128.A OG TYR 88.A OH no hydrogen 3.122 N/A ASP 130.A N ASP 127.A OD2 no hydrogen 2.918 N/A CYS 131.A N ASP 127.A O no hydrogen 2.810 N/A TYR 132.A N SER 128.A O no hydrogen 2.864 N/A TYR 132.A OH GLU 95.A OE2 no hydrogen 2.560 N/A TRP 133.A N VAL 129.A O no hydrogen 3.124 N/A ILE 134.A N ASP 130.A O no hydrogen 2.954 N/A THR 135.A N CYS 131.A O no hydrogen 2.926 N/A THR 135.A OG1 CYS 131.A O no hydrogen 2.800 N/A ARG 136.A N TYR 132.A O no hydrogen 2.915 N/A ARG 137.A N TRP 133.A O no hydrogen 2.940 N/A ARG 137.A NE LEU 44.A O no hydrogen 2.922 N/A ARG 137.A NH2 LEU 44.A O no hydrogen 3.244 N/A PHE 138.A N ILE 134.A O no hydrogen 2.836 N/A VAL 139.A N THR 135.A O no hydrogen 2.999 N/A ASN 140.A N ARG 136.A O no hydrogen 2.986 N/A GLN 141.A N ARG 137.A O no hydrogen 2.986 N/A LEU 142.A N PHE 138.A O no hydrogen 3.329 N/A ASN 143.A N VAL 139.A O no hydrogen 3.110 N/A THR 144.A N GLN 141.A O no hydrogen 3.117 N/A THR 144.A OG1 ASN 140.A O no hydrogen 2.748 N/A THR 144.A OG1 ASN 140.A OD1 no hydrogen 3.556 N/A LYS 145.A N THR 144.A OG1 no hydrogen 2.717 N/A TYR 146.A N GLN 141.A O no hydrogen 2.896 N/A TYR 146.A OH VAL 207.A O no hydrogen 2.765 N/A ARG 147.A N THR 144.A O no hydrogen 3.029 N/A SER 149.A N TYR 146.A O no hydrogen 3.001 N/A LEU 150.A N TYR 146.A O no hydrogen 3.020 N/A GLN 152.A N SER 149.A O no hydrogen 2.725 N/A GLN 152.A NE2 ASP 148.A O no hydrogen 2.824 N/A LEU 153.A N LEU 150.A O no hydrogen 3.172 N/A ALA 156.A N GLN 152.A O no hydrogen 3.147 N/A PHE 157.A N LEU 153.A O no hydrogen 2.793 N/A GLU 158.A N PRO 154.A O no hydrogen 3.071 N/A GLN 159.A N LYS 155.A O no hydrogen 3.120 N/A TYR 160.A N ALA 156.A O no hydrogen 2.946 N/A LEU 161.A N PHE 157.A O no hydrogen 2.884 N/A ASN 162.A N GLU 158.A O no hydrogen 2.940 N/A LEU 163.A N GLN 159.A O no hydrogen 3.183 N/A GLU 164.A N TYR 160.A O no hydrogen 3.049 N/A ASP 165.A N LEU 161.A O no hydrogen 2.764 N/A LEU 168.A N ASP 165.A OD1 no hydrogen 3.041 N/A LEU 169.A N ASP 165.A O no hydrogen 3.306 N/A THR 170.A N GLY 166.A O no hydrogen 2.663 N/A THR 170.A OG1 GLY 166.A O no hydrogen 2.755 N/A HIS 171.A N ARG 167.A O no hydrogen 2.961 N/A HIS 171.A NE2 LEU 233.A O no hydrogen 2.891 N/A LEU 172.A N LEU 168.A O no hydrogen 3.078 N/A ARG 173.A N LEU 169.A O no hydrogen 2.873 N/A MET 174.A N THR 170.A O no hydrogen 3.005 N/A CYS 175.A N HIS 171.A O no hydrogen 3.401 N/A CYS 175.A SG HIS 171.A O no hydrogen 3.592 N/A CYS 175.A SG ASN 234.A O no hydrogen 3.829 N/A SER 176.A N ARG 173.A O no hydrogen 3.062 N/A ALA 177.A N LEU 172.A O no hydrogen 2.787 N/A LYS 180.A N ALA 177.A O no hydrogen 2.810 N/A LEU 181.A N ALA 178.A O no hydrogen 3.215 N/A TYR 183.A N LEU 181.A O no hydrogen 2.869 N/A TYR 183.A OH ALA 178.A O no hydrogen 2.877 N/A TRP 186.A N PRO 182.A O no hydrogen 3.157 N/A PHE 187.A N TYR 183.A O no hydrogen 2.685 N/A LYS 188.A N ASP 184.A O no hydrogen 3.050 N/A ARG 189.A N ASP 184.A O no hydrogen 2.970 N/A CYS 190.A SG LYS 188.A O no hydrogen 3.905 N/A PHE 191.A N LEU 185.A O no hydrogen 2.935 N/A ALA 192.A N ARG 189.A O no hydrogen 2.878 N/A CYS 194.A N PHE 191.A O no hydrogen 2.887 N/A LEU 195.A N PHE 191.A O no hydrogen 3.268 N/A GLU 197.A N GLU 197.A OE1 no hydrogen 2.884 N/A SER 199.A N PRO 196.A O no hydrogen 3.047 N/A SER 199.A OG SER 251.A OG no hydrogen 2.951 N/A LEU 200.A N PRO 196.A O no hydrogen 2.828 N/A GLN 201.A N GLU 197.A O no hydrogen 3.028 N/A GLN 201.A NE2 SER 198.A O no hydrogen 3.504 N/A ARG 202.A N SER 199.A O no hydrogen 3.174 N/A ARG 202.A NH1 SER 256.A OG no hydrogen 3.299 N/A ARG 202.A NH2 ASP 252.A O no hydrogen 2.909 N/A ARG 202.A NH2 SER 256.A OG no hydrogen 3.011 N/A TRP 204.A N LEU 200.A O no hydrogen 2.904 N/A TRP 204.A NE1 CYS 190.A O no hydrogen 2.858 N/A ASP 205.A N GLN 201.A O no hydrogen 2.887 N/A LYS 206.A N VAL 203.A O no hydrogen 2.948 N/A LYS 206.A NZ SER 26.A O no hydrogen 2.681 N/A VAL 207.A N VAL 203.A O no hydrogen 3.209 N/A VAL 208.A N TRP 204.A O no hydrogen 2.725 N/A SER 209.A N ASP 205.A O no hydrogen 3.086 N/A SER 209.A OG ASP 205.A O no hydrogen 2.808 N/A SER 209.A OG LYS 206.A O no hydrogen 3.213 N/A GLY 210.A N VAL 207.A O no hydrogen 3.141 N/A SER 211.A N LYS 206.A O no hydrogen 2.872 N/A ILE 214.A N SER 211.A OG no hydrogen 3.100 N/A LEU 215.A N CYS 212.A O no hydrogen 3.107 N/A VAL 216.A N LYS 213.A O no hydrogen 2.977 N/A PHE 217.A N ILE 214.A O no hydrogen 3.195 N/A VAL 218.A N ILE 214.A O no hydrogen 3.129 N/A ALA 219.A N LEU 215.A O no hydrogen 3.038 N/A VAL 220.A N VAL 216.A O no hydrogen 2.775 N/A GLU 221.A N PHE 217.A O no hydrogen 2.812 N/A ILE 222.A N VAL 218.A O no hydrogen 2.865 N/A LEU 223.A N ALA 219.A O no hydrogen 3.225 N/A LEU 224.A N VAL 220.A O no hydrogen 3.044 N/A THR 225.A N GLU 221.A O no hydrogen 2.716 N/A THR 225.A OG1 GLU 221.A O no hydrogen 2.909 N/A PHE 226.A N ILE 222.A O no hydrogen 2.931 N/A LYS 227.A N LEU 224.A O no hydrogen 3.372 N/A LYS 227.A NZ ASP 165.A OD1 no hydrogen 3.434 N/A LYS 227.A NZ ASP 165.A OD2 no hydrogen 2.392 N/A VAL 230.A N PHE 226.A O no hydrogen 2.954 N/A MET 231.A N LYS 227.A O no hydrogen 2.996 N/A ALA 232.A N ILE 228.A O no hydrogen 3.296 N/A ALA 232.A N LYS 229.A O no hydrogen 3.206 N/A LEU 233.A N VAL 230.A O no hydrogen 3.158 N/A ILE 239.A N SER 235.A O no hydrogen 3.237 N/A THR 240.A N ALA 236.A O no hydrogen 3.115 N/A THR 240.A OG1 LYS 180.A O no hydrogen 2.830 N/A THR 240.A OG1 ALA 236.A O no hydrogen 3.043 N/A LYS 241.A N GLU 237.A O no hydrogen 2.788 N/A PHE 242.A N LYS 238.A O no hydrogen 2.888 N/A LEU 243.A N ILE 239.A O no hydrogen 3.078 N/A GLU 244.A N THR 240.A O no hydrogen 3.023 N/A GLU 244.A N LYS 241.A O no hydrogen 3.238 N/A ASN 245.A N PHE 242.A O no hydrogen 2.880 N/A GLN 248.A NE2 CYS 194.A O no hydrogen 2.598 N/A GLN 248.A NE2 ILE 246.A O no hydrogen 3.509 N/A SER 250.A OG ASP 249.A OD2 no hydrogen 3.539 N/A SER 251.A N GLN 248.A O no hydrogen 3.270 N/A SER 251.A OG SER 199.A OG no hydrogen 2.951 N/A SER 251.A OG GLN 248.A O no hydrogen 3.058 N/A ILE 254.A N SER 250.A O no hydrogen 2.789 N/A VAL 255.A N SER 251.A O no hydrogen 3.031 N/A SER 256.A N ASP 252.A O no hydrogen 3.101 N/A SER 256.A OG ASP 252.A O no hydrogen 2.946 N/A LYS 257.A N ALA 253.A O no hydrogen 2.987 N/A ALA 258.A N ILE 254.A O no hydrogen 2.782 N/A ILE 259.A N VAL 255.A O no hydrogen 2.938 N/A ASP 260.A N SER 256.A O no hydrogen 3.206 N/A LEU 261.A N LYS 257.A O no hydrogen 2.907 N/A TRP 262.A N ALA 258.A O no hydrogen 2.981 N/A HIS 263.A N ILE 259.A O no hydrogen 3.009 N/A HIS 263.A NE2 GLN 27.A O no hydrogen 2.934 N/A LYS 264.A N ASP 260.A O no hydrogen 2.961 N/A LYS 264.A NZ GLU 164.A OE1 no hydrogen 2.820 N/A LYS 264.A NZ GLU 164.A OE2 no hydrogen 3.531 N/A HIS 265.A N LEU 261.A O no hydrogen 2.990 N/A HIS 265.A NE2 GLU 164.A OE1 no hydrogen 2.751 N/A CYS 266.A N TRP 262.A O no hydrogen 2.881 N/A GLY 267.A N HIS 263.A O no hydrogen 2.965 N/A HIS 271.A ND1 THR 24.A OG1 no hydrogen 2.739 N/A