Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8xb1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 2.A OG LEU 4.A O no hydrogen 3.455 N/A SER 2.A OG ASP 189.A OD2 no hydrogen 2.737 N/A GLN 3.A NE2 ARG 203.A O no hydrogen 3.568 N/A LEU 4.A N ASP 189.A OD2 no hydrogen 2.839 N/A GLN 5.A N VAL 168.A O no hydrogen 3.173 N/A VAL 7.A N SER 166.A O no hydrogen 3.107 N/A GLN 8.A N PHE 18.A O no hydrogen 3.168 N/A THR 10.A N GLU 16.A O no hydrogen 3.002 N/A GLU 16.A N SER 13.A O no hydrogen 3.204 N/A TYR 17.A N ASN 15.A O no hydrogen 3.118 N/A TYR 17.A OH TYR 19.A OH no hydrogen 3.074 N/A PHE 18.A N GLN 8.A O no hydrogen 3.398 N/A VAL 20.A N MET 6.A O no hydrogen 3.131 N/A ARG 23.A N ASP 21.A OD1 no hydrogen 3.227 N/A TYR 25.A N PHE 22.A O no hydrogen 2.889 N/A TYR 27.A OH GLU 32.A OE1 no hydrogen 3.018 N/A LYS 30.A N ASP 28.A OD1 no hydrogen 3.398 N/A GLU 32.A N LEU 29.A O no hydrogen 3.001 N/A PHE 33.A N ALA 108.A O no hydrogen 2.663 N/A ARG 35.A NH2 PRO 114.A O no hydrogen 2.239 N/A ASN 37.A N PRO 34.A O no hydrogen 3.466 N/A LEU 38.A N ARG 35.A O no hydrogen 3.299 N/A GLU 39.A N THR 56.A O no hydrogen 2.775 N/A LEU 44.A N VAL 52.A O no hydrogen 3.128 N/A LYS 51.A N MET 73.A O no hydrogen 2.937 N/A VAL 52.A N GLY 45.A O no hydrogen 2.920 N/A MET 53.A N VAL 71.A O no hydrogen 3.150 N/A ALA 55.A N VAL 69.A O no hydrogen 2.863 N/A THR 56.A OG1 GLU 39.A O no hydrogen 2.968 N/A ALA 57.A N SER 66.A O no hydrogen 3.038 N/A GLY 59.A N VAL 65.A O no hydrogen 3.397 N/A VAL 69.A N ALA 55.A O no hydrogen 2.760 N/A ALA 70.A N PHE 119.A O no hydrogen 3.281 N/A VAL 71.A N MET 53.A O no hydrogen 3.023 N/A LYS 72.A N LEU 117.A O no hydrogen 2.897 N/A LYS 72.A NZ GLU 89.A OE2 no hydrogen 3.255 N/A LYS 72.A NZ ASP 189.A O no hydrogen 3.468 N/A MET 73.A N LYS 51.A O no hydrogen 2.889 N/A ARG 83.A N SER 80.A O no hydrogen 2.949 N/A LEU 86.A N ARG 83.A O no hydrogen 2.867 N/A MET 87.A N ARG 83.A O no hydrogen 3.107 N/A SER 88.A N GLU 84.A O no hydrogen 3.081 N/A SER 88.A OG GLU 84.A O no hydrogen 2.953 N/A GLU 89.A N ALA 85.A O no hydrogen 3.430 N/A LEU 90.A N LEU 86.A O no hydrogen 3.016 N/A LYS 91.A N MET 87.A O no hydrogen 2.891 N/A LYS 91.A NZ PHE 22.A O no hydrogen 2.971 N/A MET 92.A N SER 88.A O no hydrogen 2.996 N/A MET 93.A N GLU 89.A O no hydrogen 2.842 N/A THR 94.A N LEU 90.A O no hydrogen 2.886 N/A THR 94.A OG1 LEU 90.A O no hydrogen 3.132 N/A THR 94.A OG1 LYS 91.A O no hydrogen 2.543 N/A GLN 95.A N MET 92.A O no hydrogen 2.993 N/A LEU 96.A N MET 93.A O no hydrogen 3.227 N/A HIS 99.A N ASN 104.A OD1 no hydrogen 3.269 N/A ASN 101.A N HIS 99.A ND1 no hydrogen 3.096 N/A ASN 101.A ND2 VAL 185.A O no hydrogen 3.320 N/A ILE 102.A N HIS 99.A O no hydrogen 3.278 N/A VAL 103.A N ILE 187.A O no hydrogen 2.799 N/A ASN 104.A N GLU 120.A OE1 no hydrogen 3.060 N/A ASN 104.A ND2 HIS 99.A O no hydrogen 2.998 N/A LEU 106.A N ILE 118.A O no hydrogen 2.802 N/A GLY 107.A N ILE 118.A O no hydrogen 3.330 N/A ALA 108.A N TRP 31.A O no hydrogen 3.069 N/A CYS 109.A N TYR 116.A O no hydrogen 2.913 N/A CYS 109.A SG PHE 33.A O no hydrogen 3.559 N/A THR 110.A N GLU 32.A OE1 no hydrogen 3.113 N/A THR 110.A N GLU 32.A OE2 no hydrogen 2.921 N/A THR 110.A OG1 GLU 32.A OE1 no hydrogen 2.435 N/A SER 112.A OG GLU 32.A OE2 no hydrogen 3.142 N/A TYR 116.A N CYS 109.A O no hydrogen 3.092 N/A LEU 117.A N LYS 72.A O no hydrogen 3.235 N/A ILE 118.A N GLY 107.A O no hydrogen 2.884 N/A PHE 119.A N ALA 70.A O no hydrogen 2.749 N/A GLU 120.A N ASN 104.A O no hydrogen 3.037 N/A TYR 124.A N VAL 179.A O no hydrogen 3.028 N/A GLY 125.A N CYS 122.A O no hydrogen 3.327 N/A LEU 127.A N VAL 177.A O no hydrogen 2.423 N/A LEU 128.A N ALA 174.A O no hydrogen 3.338 N/A ASN 129.A N ASP 126.A OD1 no hydrogen 2.545 N/A ASN 129.A ND2 ASP 126.A OD2 no hydrogen 3.171 N/A TYR 130.A N ASP 126.A O no hydrogen 2.997 N/A LEU 131.A N LEU 127.A O no hydrogen 2.605 N/A ARG 132.A N LEU 128.A O no hydrogen 3.069 N/A ARG 132.A NE GLY 239.A O no hydrogen 2.734 N/A SER 133.A N ASN 129.A O no hydrogen 3.193 N/A SER 133.A OG ASN 129.A O no hydrogen 3.162 N/A LYS 134.A N LEU 131.A O no hydrogen 2.990 N/A ARG 135.A N ARG 132.A O no hydrogen 3.355 N/A SER 139.A OG LYS 137.A O no hydrogen 3.334 N/A THR 144.A N ASP 147.A OD2 no hydrogen 2.723 N/A PHE 145.A N THR 144.A OG1 no hydrogen 2.537 N/A LEU 149.A N PHE 145.A O no hydrogen 3.067 N/A CYS 150.A N GLU 146.A O no hydrogen 2.625 N/A PHE 151.A N ASP 147.A O no hydrogen 2.799 N/A ALA 152.A N LEU 148.A O no hydrogen 3.355 N/A TYR 153.A N LEU 149.A O no hydrogen 3.016 N/A GLN 154.A N CYS 150.A O no hydrogen 2.968 N/A GLN 154.A NE2 CYS 150.A O no hydrogen 2.940 N/A GLN 154.A NE2 LYS 183.A O no hydrogen 3.308 N/A VAL 155.A N PHE 151.A O no hydrogen 3.134 N/A ALA 156.A N ALA 152.A O no hydrogen 3.121 N/A LYS 157.A N TYR 153.A O no hydrogen 2.990 N/A GLY 158.A N GLN 154.A O no hydrogen 2.900 N/A MET 159.A N VAL 155.A O no hydrogen 2.834 N/A GLU 160.A N ALA 156.A O no hydrogen 2.594 N/A PHE 161.A N LYS 157.A O no hydrogen 2.962 N/A LEU 162.A N GLY 158.A O no hydrogen 2.940 N/A GLU 163.A N MET 159.A O no hydrogen 2.956 N/A PHE 164.A N GLU 160.A O no hydrogen 3.192 N/A LYS 165.A N PHE 161.A O no hydrogen 3.167 N/A SER 166.A N GLU 163.A O no hydrogen 2.857 N/A SER 166.A OG VAL 7.A O no hydrogen 3.139 N/A CYS 167.A N LEU 162.A O no hydrogen 2.771 N/A CYS 167.A SG LYS 165.A O no hydrogen 4.006 N/A VAL 168.A N GLN 5.A O no hydrogen 2.978 N/A HIS 169.A N ASP 224.A OD2 no hydrogen 2.705 N/A HIS 169.A NE2 CYS 188.A O no hydrogen 2.771 N/A ARG 170.A N GLN 3.A O no hydrogen 2.877 N/A ARG 170.A NH2 GLU 1.A OE1 no hydrogen 3.309 N/A ARG 170.A NH2 SER 2.A O no hydrogen 3.529 N/A ASP 171.A N HIS 169.A ND1 no hydrogen 3.031 N/A ALA 174.A N GLU 234.A OE1 no hydrogen 3.096 N/A ARG 175.A NE TYR 196.A OH no hydrogen 2.618 N/A ARG 175.A NH2 TYR 196.A OH no hydrogen 3.191 N/A ASN 176.A N ALA 173.A O no hydrogen 3.007 N/A ASN 176.A ND2 ASP 171.A O no hydrogen 2.634 N/A VAL 177.A N ALA 174.A O no hydrogen 3.144 N/A LEU 178.A N LYS 186.A O no hydrogen 3.112 N/A VAL 179.A N GLY 125.A O no hydrogen 2.598 N/A THR 180.A N VAL 184.A O no hydrogen 2.700 N/A THR 180.A OG1 TYR 121.A O no hydrogen 3.532 N/A HIS 181.A N THR 180.A OG1 no hydrogen 2.779 N/A VAL 185.A N GLN 154.A OE1 no hydrogen 3.069 N/A LYS 186.A N LEU 178.A O no hydrogen 2.966 N/A LYS 186.A NZ HIS 99.A O no hydrogen 3.425 N/A LYS 186.A NZ GLU 100.A O no hydrogen 2.983 N/A LYS 186.A NZ ILE 102.A O no hydrogen 3.245 N/A LYS 186.A NZ GLU 120.A OE1 no hydrogen 3.303 N/A ILE 187.A N ASN 101.A O no hydrogen 2.831 N/A CYS 188.A N ASN 176.A O no hydrogen 3.119 N/A CYS 188.A SG ASN 176.A O no hydrogen 3.796 N/A ASN 195.A N ASP 193.A OD2 no hydrogen 2.795 N/A TYR 196.A OH ASP 171.A OD2 no hydrogen 2.407 N/A VAL 197.A N LEU 204.A O no hydrogen 2.723 N/A ARG 199.A N ALA 202.A O no hydrogen 2.987 N/A LEU 204.A N VAL 197.A O no hydrogen 2.630 N/A LYS 207.A NZ ASN 241.A OD1 no hydrogen 2.798 N/A LYS 207.A NZ PRO 242.A O no hydrogen 2.595 N/A LYS 207.A NZ TYR 243.A O no hydrogen 3.024 N/A LYS 207.A NZ ILE 246.A O no hydrogen 3.213 N/A TRP 208.A N PRO 205.A O no hydrogen 2.930 N/A TRP 208.A NE1 GLU 234.A OE1 no hydrogen 3.150 N/A MET 209.A N VAL 206.A O no hydrogen 3.053 N/A GLU 212.A N GLU 212.A OE1 no hydrogen 2.668 N/A SER 213.A N ALA 210.A O no hydrogen 2.739 N/A SER 213.A OG ILE 218.A O no hydrogen 2.628 N/A LEU 214.A N ALA 210.A O no hydrogen 2.928 N/A PHE 215.A N PRO 211.A O no hydrogen 3.021 N/A GLU 216.A N GLU 212.A O no hydrogen 3.369 N/A GLY 217.A N SER 213.A O no hydrogen 3.269 N/A ILE 218.A N GLU 212.A O no hydrogen 3.028 N/A TYR 219.A N TYR 17.A OH no hydrogen 2.978 N/A THR 220.A N SER 223.A OG no hydrogen 2.757 N/A THR 220.A OG1 SER 223.A OG no hydrogen 2.972 N/A LYS 222.A NZ ARG 287.A O no hydrogen 2.657 N/A SER 223.A N THR 220.A OG1 no hydrogen 3.304 N/A SER 223.A OG GLU 212.A OE2 no hydrogen 3.460 N/A SER 223.A OG THR 220.A O no hydrogen 3.349 N/A SER 223.A OG THR 220.A OG1 no hydrogen 2.972 N/A ASP 224.A N THR 220.A O no hydrogen 3.311 N/A ASP 224.A N ILE 221.A O no hydrogen 3.215 N/A TRP 226.A N LYS 222.A O no hydrogen 3.319 N/A SER 227.A N SER 223.A O no hydrogen 3.270 N/A SER 227.A OG TRP 208.A O no hydrogen 2.953 N/A SER 227.A OG SER 223.A O no hydrogen 3.257 N/A TYR 228.A N ASP 224.A O no hydrogen 2.723 N/A TYR 228.A OH ALA 152.A O no hydrogen 2.670 N/A GLY 229.A N VAL 225.A O no hydrogen 2.938 N/A ILE 230.A N TRP 226.A O no hydrogen 3.159 N/A LEU 231.A N SER 227.A O no hydrogen 2.834 N/A LEU 232.A N TYR 228.A O no hydrogen 2.731 N/A TRP 233.A N GLY 229.A O no hydrogen 2.964 N/A TRP 233.A NE1 ASP 263.A O no hydrogen 2.904 N/A GLU 234.A N ILE 230.A O no hydrogen 2.873 N/A ILE 235.A N LEU 231.A O no hydrogen 2.803 N/A PHE 236.A N LEU 232.A O no hydrogen 3.171 N/A LEU 238.A N ILE 235.A O no hydrogen 2.951 N/A VAL 240.A N SER 237.A OG no hydrogen 2.984 N/A ASN 241.A ND2 ASN 195.A OD1 no hydrogen 3.196 N/A ILE 246.A N TYR 243.A O no hydrogen 3.253 N/A PHE 252.A N ASP 249.A O no hydrogen 2.925 N/A PHE 252.A N ASP 249.A OD1 no hydrogen 2.972 N/A TYR 253.A N ASP 249.A O no hydrogen 3.404 N/A LYS 254.A N ALA 250.A O no hydrogen 3.240 N/A LEU 255.A N ASN 251.A O no hydrogen 2.999 N/A ILE 256.A N PHE 252.A O no hydrogen 3.210 N/A GLN 257.A N TYR 253.A O no hydrogen 3.121 N/A ASN 258.A N LYS 254.A O no hydrogen 3.196 N/A ASN 258.A N LEU 255.A O no hydrogen 3.212 N/A GLY 259.A N ILE 256.A O no hydrogen 3.173 N/A PHE 260.A N LEU 255.A O no hydrogen 3.159 N/A TYR 267.A N PHE 236.A O no hydrogen 3.134 N/A ALA 268.A N PRO 265.A O no hydrogen 3.177 N/A GLU 271.A N THR 269.A OG1 no hydrogen 3.131 N/A TYR 273.A N THR 269.A O no hydrogen 3.318 N/A TYR 273.A OH MET 262.A O no hydrogen 2.809 N/A ILE 274.A N GLU 271.A O no hydrogen 2.990 N/A MET 276.A N ILE 272.A O no hydrogen 3.324 N/A GLN 277.A N TYR 273.A O no hydrogen 3.049 N/A SER 278.A N ILE 274.A O no hydrogen 3.049 N/A SER 278.A N ILE 275.A O no hydrogen 3.163 N/A SER 278.A OG ILE 274.A O no hydrogen 2.905 N/A SER 278.A OG ILE 275.A O no hydrogen 3.280 N/A CYS 279.A N ILE 275.A O no hydrogen 3.391 N/A CYS 279.A SG ILE 275.A O no hydrogen 3.210 N/A TRP 280.A N MET 276.A O no hydrogen 3.274 N/A ALA 281.A N SER 278.A O no hydrogen 3.151 N/A SER 284.A OG ASP 14.A OD2 no hydrogen 2.510 N/A ARG 285.A N ASP 283.A OD1 no hydrogen 2.967 N/A LYS 286.A N ASP 283.A O no hydrogen 3.070 N/A ARG 287.A N SER 284.A O no hydrogen 3.376 N/A ARG 287.A NE ALA 281.A O no hydrogen 2.970 N/A ARG 287.A NH1 GLU 212.A OE2 no hydrogen 2.729 N/A ARG 287.A NH1 LYS 222.A O no hydrogen 3.181 N/A ARG 287.A NH2 GLU 212.A OE1 no hydrogen 3.089 N/A ARG 287.A NH2 GLU 212.A OE2 no hydrogen 3.458 N/A ARG 287.A NH2 ALA 281.A O no hydrogen 3.085 N/A ARG 287.A NH2 PHE 282.A O no hydrogen 3.005 N/A SER 289.A OG ASN 292.A OD1 no hydrogen 2.624 N/A ASN 292.A N SER 289.A OG no hydrogen 3.023 N/A THR 294.A N PRO 291.A O no hydrogen 2.591 N/A THR 294.A OG1 PRO 291.A O no hydrogen 2.560 N/A THR 294.A OG1 SER 295.A OG no hydrogen 3.211 N/A SER 295.A OG THR 294.A OG1 no hydrogen 3.211 N/A PHE 296.A N ASN 292.A O no hydrogen 3.402 N/A GLY 298.A N THR 294.A O no hydrogen 3.021 N/A CYS 299.A N SER 295.A O no hydrogen 3.210 N/A LEU 301.A N LEU 297.A O no hydrogen 3.181 N/A ALA 304.A N LEU 301.A O no hydrogen 2.844 N/A