Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8qel_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A OG1 ASP 76.A OD2 no hydrogen 2.713 N/A VAL 4.A N ASP 76.A OD1 no hydrogen 2.935 N/A ASP 5.A N THR 3.A OG1 no hydrogen 3.420 N/A PHE 8.A N ASP 5.A OD2 no hydrogen 2.938 N/A GLY 9.A N ASP 5.A O no hydrogen 3.365 N/A MET 10.A N LYS 6.A O no hydrogen 3.148 N/A ASP 11.A N ARG 7.A O no hydrogen 2.927 N/A PHE 12.A N PHE 8.A O no hydrogen 2.981 N/A LYS 13.A N LYS 30.A O no hydrogen 3.036 N/A GLU 16.A N LYS 28.A O no hydrogen 2.895 N/A ILE 18.A N VAL 26.A O no hydrogen 3.005 N/A GLY 19.A N VAL 26.A O no hydrogen 3.196 N/A GLN 25.A N ARG 42.A O no hydrogen 3.176 N/A GLN 25.A NE2 GLY 21.A O no hydrogen 3.386 N/A GLN 25.A NE2 PRO 79.A O no hydrogen 2.957 N/A VAL 26.A N GLY 19.A O no hydrogen 2.845 N/A PHE 27.A N ILE 40.A O no hydrogen 2.846 N/A LYS 28.A N GLU 16.A O no hydrogen 2.826 N/A ALA 29.A N TYR 38.A O no hydrogen 3.032 N/A LYS 30.A N LYS 13.A O no hydrogen 2.888 N/A HIS 31.A N LYS 36.A O no hydrogen 2.992 N/A ARG 32.A N ASP 11.A O no hydrogen 2.977 N/A ARG 32.A NE PHE 12.A O no hydrogen 3.227 N/A ARG 32.A NH2 GLY 9.A O no hydrogen 2.626 N/A ILE 33.A N HIS 31.A ND1 no hydrogen 3.113 N/A ASP 34.A N HIS 31.A ND1 no hydrogen 3.055 N/A GLY 35.A N HIS 31.A O no hydrogen 3.109 N/A LYS 36.A N ASP 34.A OD1 no hydrogen 2.831 N/A TYR 38.A N ALA 29.A O no hydrogen 2.903 N/A TYR 38.A OH ASP 34.A OD2 no hydrogen 2.875 N/A VAL 39.A N MET 92.A O no hydrogen 3.091 N/A ILE 40.A N PHE 27.A O no hydrogen 2.900 N/A LYS 41.A N ILE 90.A O no hydrogen 2.966 N/A LYS 41.A NZ GLU 53.A OE1 no hydrogen 3.087 N/A LYS 41.A NZ GLU 53.A OE2 no hydrogen 3.210 N/A LYS 41.A NZ ASP 158.A OD2 no hydrogen 3.185 N/A ARG 42.A N GLN 25.A O no hydrogen 2.856 N/A ARG 42.A NE ASP 76.A OD2 no hydrogen 2.944 N/A ARG 42.A NH1 GLN 25.A OE1 no hydrogen 2.730 N/A ARG 42.A NH2 HIS 2.A O no hydrogen 2.634 N/A ARG 42.A NH2 ASP 76.A OD2 no hydrogen 3.081 N/A VAL 43.A N LEU 88.A O no hydrogen 2.855 N/A LYS 44.A NZ ASP 78.A OD2 no hydrogen 3.303 N/A TYR 45.A N LYS 86.A O no hydrogen 3.037 N/A TYR 45.A OH GLU 51.A OE1 no hydrogen 2.685 N/A ASN 47.A N ASN 46.A OD1 no hydrogen 3.042 N/A LYS 49.A N ASN 47.A OD1 no hydrogen 3.392 N/A GLU 51.A N GLU 48.A O no hydrogen 3.121 N/A ARG 52.A N LYS 49.A O no hydrogen 3.314 N/A LYS 55.A N GLU 51.A O no hydrogen 3.054 N/A LYS 55.A NZ GLU 51.A OE2 no hydrogen 2.923 N/A ALA 56.A N ARG 52.A O no hydrogen 2.933 N/A LEU 57.A N GLU 53.A O no hydrogen 2.850 N/A ALA 58.A N VAL 54.A O no hydrogen 2.887 N/A LYS 59.A N ALA 56.A O no hydrogen 2.958 N/A LEU 60.A N LEU 57.A O no hydrogen 3.408 N/A ASP 61.A N TYR 130.A OH no hydrogen 2.943 N/A ASN 64.A N HIS 62.A ND1 no hydrogen 2.944 N/A VAL 66.A N ILE 156.A O no hydrogen 3.164 N/A HIS 67.A N GLU 93.A OE2 no hydrogen 3.203 N/A ASN 69.A N GLN 91.A O no hydrogen 2.827 N/A CYS 71.A SG TYR 68.A OH no hydrogen 3.575 N/A TRP 72.A N PHE 89.A O no hydrogen 3.094 N/A TRP 72.A NE1 ASP 5.A OD2 no hydrogen 2.934 N/A GLY 74.A N CYS 87.A O no hydrogen 2.867 N/A PHE 75.A N ASP 5.A OD1 no hydrogen 3.200 N/A ASP 76.A N THR 85.A O no hydrogen 3.280 N/A TYR 77.A N ASP 76.A OD1 no hydrogen 2.814 N/A ASP 78.A N SER 83.A O no hydrogen 2.991 N/A GLU 80.A N ASP 78.A OD1 no hydrogen 3.237 N/A THR 81.A N ASP 78.A O no hydrogen 3.023 N/A THR 85.A N ASP 76.A O no hydrogen 2.966 N/A CYS 87.A N GLY 74.A O no hydrogen 2.852 N/A CYS 87.A SG ASP 76.A O no hydrogen 4.000 N/A CYS 87.A SG TYR 77.A O no hydrogen 3.622 N/A CYS 87.A SG THR 85.A O no hydrogen 3.784 N/A LEU 88.A N VAL 43.A O no hydrogen 2.844 N/A PHE 89.A N TRP 72.A O no hydrogen 2.849 N/A ILE 90.A N LYS 41.A O no hydrogen 2.797 N/A GLN 91.A N GLY 70.A O no hydrogen 2.844 N/A MET 92.A N VAL 39.A O no hydrogen 2.870 N/A GLU 93.A N HIS 67.A O no hydrogen 2.976 N/A CYS 95.A SG GLU 93.A O no hydrogen 3.927 N/A GLY 98.A N CYS 95.A O no hydrogen 3.436 N/A THR 99.A N GLN 102.A OE1 no hydrogen 3.064 N/A LEU 100.A N ILE 146.A O no hydrogen 2.842 N/A GLU 101.A N PRO 143.A O no hydrogen 3.181 N/A GLN 102.A N THR 99.A OG1 no hydrogen 3.316 N/A TRP 103.A N THR 99.A O no hydrogen 3.179 N/A ILE 104.A N LEU 100.A O no hydrogen 2.925 N/A GLU 105.A N GLU 101.A O no hydrogen 3.048 N/A LYS 106.A N GLN 102.A O no hydrogen 3.118 N/A ARG 107.A N ILE 104.A O no hydrogen 3.165 N/A ARG 107.A NH1 GLU 205.A O no hydrogen 3.403 N/A ARG 107.A NH2 LEU 206.A O no hydrogen 2.426 N/A ARG 108.A N GLU 105.A O no hydrogen 3.465 N/A ARG 108.A NE GLU 105.A OE1 no hydrogen 3.356 N/A ARG 108.A NH1 CYS 210.A O no hydrogen 3.009 N/A ARG 108.A NH1 THR 216.A OG1 no hydrogen 2.933 N/A ARG 108.A NH2 GLU 105.A OE2 no hydrogen 3.081 N/A LYS 114.A NZ GLU 236.A OE1 no hydrogen 3.081 N/A LYS 114.A NZ GLU 236.A OE2 no hydrogen 2.720 N/A LEU 116.A N ASP 113.A OD1 no hydrogen 3.097 N/A ALA 117.A N ASP 113.A O no hydrogen 3.175 N/A LEU 118.A N LYS 114.A O no hydrogen 2.896 N/A GLU 119.A N VAL 115.A O no hydrogen 3.040 N/A GLU 119.A N LEU 116.A O no hydrogen 3.168 N/A LEU 120.A N LEU 116.A O no hydrogen 3.212 N/A PHE 121.A N ALA 117.A O no hydrogen 3.216 N/A GLU 122.A N LEU 118.A O no hydrogen 2.957 N/A GLN 123.A N GLU 119.A O no hydrogen 3.225 N/A GLN 123.A NE2 GLU 119.A O no hydrogen 3.639 N/A GLN 123.A NE2 GLU 119.A OE1 no hydrogen 3.239 N/A GLN 123.A NE2 LYS 152.A O no hydrogen 2.851 N/A ILE 124.A N LEU 120.A O no hydrogen 3.074 N/A THR 125.A N PHE 121.A O no hydrogen 2.909 N/A THR 125.A OG1 PHE 121.A O no hydrogen 2.811 N/A LYS 126.A N GLU 122.A O no hydrogen 2.808 N/A GLY 127.A N GLN 123.A O no hydrogen 3.016 N/A VAL 128.A N ILE 124.A O no hydrogen 3.043 N/A ASP 129.A N THR 125.A O no hydrogen 2.859 N/A TYR 130.A N LYS 126.A O no hydrogen 3.146 N/A ILE 131.A N GLY 127.A O no hydrogen 3.177 N/A HIS 132.A N VAL 128.A O no hydrogen 2.892 N/A HIS 132.A NE2 ASP 195.A OD2 no hydrogen 3.000 N/A SER 133.A N ASP 129.A O no hydrogen 2.882 N/A SER 133.A OG TYR 130.A O no hydrogen 2.600 N/A LYS 134.A N TYR 130.A O no hydrogen 2.930 N/A LYS 134.A NZ TYR 130.A OH no hydrogen 3.249 N/A LYS 135.A N HIS 132.A O no hydrogen 3.177 N/A LEU 136.A N ILE 131.A O no hydrogen 3.112 N/A ILE 137.A N THR 163.A O no hydrogen 2.867 N/A ASN 138.A N ASP 195.A OD2 no hydrogen 2.917 N/A ASN 138.A ND2 ASP 158.A O no hydrogen 3.170 N/A ARG 139.A N ASP 195.A OD1 no hydrogen 2.932 N/A ARG 139.A NE TYR 190.A OH no hydrogen 2.881 N/A ASP 140.A N ASN 138.A OD1 no hydrogen 3.053 N/A ASN 145.A N LYS 142.A O no hydrogen 2.958 N/A ASN 145.A ND2 ASP 140.A O no hydrogen 2.862 N/A ILE 146.A N PRO 143.A O no hydrogen 3.371 N/A PHE 147.A N LYS 155.A O no hydrogen 2.894 N/A LEU 148.A N GLY 98.A O no hydrogen 2.905 N/A VAL 149.A N GLN 153.A O no hydrogen 2.972 N/A GLN 153.A N ASP 150.A O no hydrogen 2.900 N/A VAL 154.A N GLN 123.A OE1 no hydrogen 2.894 N/A LYS 155.A N PHE 147.A O no hydrogen 2.896 N/A LYS 155.A NZ GLU 93.A OE1 no hydrogen 3.514 N/A LYS 155.A NZ GLU 93.A OE2 no hydrogen 3.066 N/A ILE 156.A N ASN 64.A O no hydrogen 2.959 N/A GLY 157.A N ASN 145.A O no hydrogen 3.046 N/A PHE 159.A N GLU 53.A OE1 no hydrogen 3.383 N/A GLY 160.A N ASP 158.A OD1 no hydrogen 2.903 N/A VAL 162.A N PHE 159.A O no hydrogen 3.230 N/A THR 163.A N ILE 137.A O no hydrogen 3.178 N/A LEU 165.A N LYS 135.A O no hydrogen 3.223 N/A ASN 167.A ND2 ASP 189.A OD1 no hydrogen 2.614 N/A GLY 169.A N ASN 167.A OD1 no hydrogen 2.991 N/A ARG 171.A N GLN 188.A O no hydrogen 3.378 N/A ARG 171.A NE TYR 190.A O no hydrogen 2.974 N/A ARG 171.A NH1 SER 164.A O no hydrogen 3.158 N/A ARG 171.A NH1 LEU 165.A O no hydrogen 3.481 N/A ARG 171.A NH1 TYR 190.A O no hydrogen 3.034 N/A ARG 171.A NH2 SER 164.A O no hydrogen 3.190 N/A SER 173.A OG ILE 185.A O no hydrogen 3.184 N/A TYR 179.A OH GLU 205.A OE1 no hydrogen 2.623 N/A SER 181.A OG GLU 183.A OE1 no hydrogen 3.056 N/A SER 181.A OG GLU 183.A OE2 no hydrogen 3.428 N/A GLN 184.A N SER 181.A OG no hydrogen 3.317 N/A GLN 184.A NE2 ARG 139.A O no hydrogen 2.867 N/A ILE 185.A N SER 181.A O no hydrogen 3.157 N/A SER 186.A N PRO 182.A O no hydrogen 3.301 N/A SER 186.A OG PRO 182.A O no hydrogen 3.121 N/A SER 187.A OG ASP 189.A O no hydrogen 3.455 N/A ASP 189.A N SER 187.A OG no hydrogen 3.127 N/A GLY 191.A N GLU 193.A OE2 no hydrogen 2.854 N/A VAL 194.A N GLY 191.A O no hydrogen 3.343 N/A ASP 195.A N LYS 192.A O no hydrogen 3.103 N/A LEU 196.A N LYS 192.A O no hydrogen 3.392 N/A TYR 197.A N GLU 193.A O no hydrogen 3.055 N/A LEU 199.A N ASP 195.A O no hydrogen 3.025 N/A GLY 200.A N LEU 196.A O no hydrogen 3.229 N/A GLY 200.A N TYR 197.A O no hydrogen 2.989 N/A LEU 201.A N TYR 197.A O no hydrogen 3.268 N/A ILE 202.A N ALA 198.A O no hydrogen 2.967 N/A LEU 203.A N LEU 199.A O no hydrogen 2.904 N/A ALA 204.A N GLY 200.A O no hydrogen 2.886 N/A GLU 205.A N LEU 201.A O no hydrogen 2.944 N/A LEU 206.A N ILE 202.A O no hydrogen 2.879 N/A LEU 207.A N LEU 203.A O no hydrogen 2.827 N/A ASP 211.A N GLU 215.A OE1 no hydrogen 3.184 N/A GLU 215.A N THR 212.A OG1 no hydrogen 3.154 N/A THR 216.A N THR 212.A O no hydrogen 3.155 N/A THR 216.A OG1 THR 212.A O no hydrogen 3.055 N/A SER 217.A N ALA 213.A O no hydrogen 3.031 N/A SER 217.A OG ALA 213.A O no hydrogen 3.018 N/A LYS 218.A N PHE 214.A O no hydrogen 3.278 N/A PHE 219.A N GLU 215.A O no hydrogen 2.820 N/A PHE 220.A N THR 216.A O no hydrogen 2.899 N/A THR 221.A N SER 217.A O no hydrogen 3.113 N/A THR 221.A OG1 SER 217.A O no hydrogen 2.749 N/A ASP 222.A N LYS 218.A O no hydrogen 3.237 N/A LEU 223.A N PHE 219.A O no hydrogen 3.369 N/A ARG 224.A N PHE 220.A O no hydrogen 3.034 N/A ARG 224.A NH1 MET 180.A O no hydrogen 2.856 N/A ARG 224.A NH2 MET 180.A O no hydrogen 3.063 N/A ASP 225.A N ASP 222.A O no hydrogen 3.287 N/A ILE 227.A N ASP 222.A O no hydrogen 2.891 N/A ASP 233.A N GLU 236.A OE1 no hydrogen 3.059 N/A LYS 235.A NZ ASP 233.A OD2 no hydrogen 2.951 N/A LYS 237.A N ASP 233.A O no hydrogen 2.899 N/A LYS 237.A NZ ILE 228.A O no hydrogen 2.970 N/A THR 238.A OG1 LYS 234.A O no hydrogen 2.967 N/A THR 238.A OG1 LYS 235.A O no hydrogen 3.040 N/A LEU 240.A N GLU 236.A O no hydrogen 3.064 N/A GLN 241.A N LYS 237.A O no hydrogen 3.179 N/A LEU 243.A N LEU 239.A O no hydrogen 3.119 N/A LEU 244.A N LEU 240.A O no hydrogen 3.064 N/A SER 245.A N LYS 242.A O no hydrogen 3.261 N/A SER 245.A OG LYS 247.A O no hydrogen 3.396 N/A SER 245.A OG ASP 250.A OD2 no hydrogen 3.310 N/A LYS 247.A N SER 245.A OG no hydrogen 2.978 N/A ASP 250.A N LYS 247.A O no hydrogen 3.090 N/A ARG 251.A N PRO 248.A O no hydrogen 3.233 N/A ARG 251.A NE SER 245.A O no hydrogen 3.074 N/A ARG 251.A NH1 GLU 183.A OE1 no hydrogen 3.209 N/A ARG 251.A NH1 GLU 183.A OE2 no hydrogen 3.144 N/A ARG 251.A NH1 GLU 193.A O no hydrogen 2.999 N/A ARG 251.A NH2 GLU 183.A OE2 no hydrogen 2.483 N/A ARG 251.A NH2 SER 245.A O no hydrogen 2.842 N/A THR 254.A OG1 ASP 129.A OD1 no hydrogen 3.262 N/A GLU 256.A N ASN 253.A OD1 no hydrogen 2.871 N/A ILE 257.A N ASN 253.A O no hydrogen 3.042 N/A LEU 258.A N THR 254.A O no hydrogen 3.104 N/A ARG 259.A N SER 255.A O no hydrogen 3.349 N/A THR 260.A N GLU 256.A O no hydrogen 3.149 N/A THR 260.A OG1 GLU 256.A O no hydrogen 2.982 N/A LEU 261.A N ILE 257.A O no hydrogen 3.055 N/A THR 262.A N LEU 258.A O no hydrogen 3.248 N/A THR 262.A OG1 LEU 258.A O no hydrogen 2.594 N/A THR 262.A OG1 ARG 259.A O no hydrogen 3.219 N/A VAL 263.A N ARG 259.A O no hydrogen 3.067 N/A TRP 264.A N THR 260.A O no hydrogen 3.072 N/A LYS 265.A N LEU 261.A O no hydrogen 3.222 N/A LYS 265.A NZ GLU 122.A OE1 no hydrogen 2.752 N/A LYS 265.A NZ GLU 122.A OE2 no hydrogen 3.518 N/A LYS 266.A N VAL 263.A O no hydrogen 3.267 N/A