Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3h1b_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 7.A N GLY 3.A O no hydrogen 3.491 N/A LYS 8.A N PRO 4.A O no hydrogen 3.423 N/A LEU 9.A N GLU 5.A O no hydrogen 2.769 N/A LYS 10.A N ILE 6.A O no hydrogen 2.792 N/A LYS 10.A NZ ASP 237.A OD2 no hydrogen 2.689 N/A LYS 11.A N VAL 7.A O no hydrogen 2.997 N/A ILE 12.A N LYS 8.A O no hydrogen 2.903 N/A LEU 13.A N LEU 9.A O no hydrogen 3.055 N/A ARG 14.A N LYS 10.A O no hydrogen 2.973 N/A ARG 14.A NH1 GLU 189.A O no hydrogen 3.260 N/A GLU 15.A N LYS 11.A O no hydrogen 2.967 N/A LYS 16.A N ILE 12.A O no hydrogen 2.807 N/A MET 29.A N PRO 25.A O no hydrogen 3.085 N/A ARG 30.A N LEU 26.A O no hydrogen 2.872 N/A ARG 30.A NE VAL 79.A O no hydrogen 2.839 N/A ARG 30.A NH1 GLU 111.A OE1 no hydrogen 2.837 N/A ARG 30.A NH1 GLU 111.A OE2 no hydrogen 3.408 N/A ARG 30.A NH2 VAL 79.A O no hydrogen 2.749 N/A ARG 30.A NH2 GLU 111.A OE2 no hydrogen 2.837 N/A LYS 31.A N ASP 27.A O no hydrogen 2.802 N/A LYS 31.A NZ ASP 27.A OD2 no hydrogen 2.547 N/A GLY 32.A N VAL 28.A O no hydrogen 3.172 N/A MET 33.A N MET 29.A O no hydrogen 3.281 N/A GLU 34.A N ARG 30.A O no hydrogen 3.223 N/A LYS 35.A N LYS 31.A O no hydrogen 3.021 N/A LYS 35.A N GLY 32.A O no hydrogen 3.020 N/A VAL 36.A N GLY 32.A O no hydrogen 3.014 N/A ALA 37.A N GLU 34.A O no hydrogen 3.391 N/A ILE 44.A N ALA 41.A O no hydrogen 3.360 N/A GLN 45.A N ARG 60.A O no hydrogen 2.813 N/A VAL 49.A N ALA 56.A O no hydrogen 3.255 N/A VAL 51.A N CYS 54.A O no hydrogen 3.044 N/A CYS 54.A N VAL 51.A O no hydrogen 2.875 N/A CYS 54.A SG ALA 52.A O no hydrogen 3.841 N/A CYS 54.A SG ASP 105.A O no hydrogen 3.880 N/A CYS 54.A SG ASP 120.A OD2 no hydrogen 3.262 N/A ALA 56.A N VAL 49.A O no hydrogen 2.920 N/A TRP 58.A N GLU 47.A O no hydrogen 3.014 N/A VAL 59.A N ALA 101.A O no hydrogen 2.776 N/A ARG 60.A N GLN 45.A O no hydrogen 2.875 N/A ALA 61.A N SER 94.A OG no hydrogen 3.261 N/A CYS 64.A SG ALA 61.A O no hydrogen 3.567 N/A CYS 64.A SG SER 94.A O no hydrogen 3.936 N/A CYS 64.A SG SER 94.A OG no hydrogen 3.423 N/A GLN 65.A N GLN 98.A O no hydrogen 3.361 N/A LYS 68.A N GLN 65.A O no hydrogen 3.453 N/A ALA 69.A N HIS 137.A O no hydrogen 3.316 N/A ILE 70.A N ALA 100.A O no hydrogen 2.960 N/A LEU 71.A N SER 139.A O no hydrogen 3.002 N/A TYR 72.A N LEU 102.A O no hydrogen 2.823 N/A TYR 72.A OH ASP 143.A OD1 no hydrogen 2.691 N/A LEU 73.A N SER 141.A O no hydrogen 2.794 N/A HIS 74.A ND1 GLY 75.A O no hydrogen 2.848 N/A GLY 75.A N HIS 86.A NE2 no hydrogen 3.298 N/A VAL 79.A N GLY 76.A O no hydrogen 3.165 N/A MET 80.A N GLY 76.A O no hydrogen 2.974 N/A SER 82.A N THR 85.A OG1 no hydrogen 2.947 N/A SER 82.A OG GLU 34.A OE1 no hydrogen 3.353 N/A SER 82.A OG GLU 34.A OE2 no hydrogen 2.550 N/A ASN 84.A N SER 82.A OG no hydrogen 3.103 N/A ASN 84.A ND2 GLU 34.A O no hydrogen 3.669 N/A ASN 84.A ND2 GLU 34.A OE1 no hydrogen 2.620 N/A THR 85.A N SER 82.A OG no hydrogen 3.340 N/A THR 85.A OG1 SER 82.A O no hydrogen 2.987 N/A THR 85.A OG1 HIS 86.A ND1 no hydrogen 2.990 N/A HIS 86.A ND1 THR 85.A OG1 no hydrogen 2.990 N/A HIS 86.A NE2 ASP 143.A OD2 no hydrogen 2.673 N/A ARG 87.A N ILE 83.A O no hydrogen 3.265 N/A ARG 87.A NE GLU 57.A OE1 no hydrogen 2.759 N/A ARG 87.A NH2 GLU 57.A OE1 no hydrogen 3.459 N/A ARG 87.A NH2 GLU 57.A OE2 no hydrogen 3.294 N/A SER 88.A OG HIS 274.A NE2 no hydrogen 3.414 N/A VAL 90.A N HIS 86.A O no hydrogen 2.967 N/A GLY 91.A N ARG 87.A O no hydrogen 3.120 N/A GLU 92.A N SER 88.A O no hydrogen 3.227 N/A GLU 92.A N MET 89.A O no hydrogen 3.210 N/A ILE 93.A N MET 89.A O no hydrogen 3.091 N/A SER 94.A N VAL 90.A O no hydrogen 2.546 N/A SER 94.A OG VAL 59.A O no hydrogen 3.228 N/A SER 94.A OG ALA 99.A O no hydrogen 2.613 N/A ARG 95.A N GLY 91.A O no hydrogen 2.799 N/A ARG 95.A NE GLU 92.A OE1 no hydrogen 2.887 N/A ARG 95.A NH1 ASP 43.A OD2 no hydrogen 2.935 N/A ARG 95.A NH1 GLU 92.A OE1 no hydrogen 3.431 N/A ARG 95.A NH1 GLU 92.A OE2 no hydrogen 3.113 N/A ARG 95.A NH2 ASP 43.A OD1 no hydrogen 2.982 N/A ALA 96.A N GLU 92.A O no hydrogen 3.037 N/A ALA 96.A N ILE 93.A O no hydrogen 3.221 N/A SER 97.A N ILE 93.A O no hydrogen 3.031 N/A SER 97.A OG ILE 93.A O no hydrogen 2.933 N/A SER 97.A OG SER 94.A O no hydrogen 3.544 N/A ALA 99.A N SER 94.A O no hydrogen 3.190 N/A ALA 101.A N VAL 59.A O no hydrogen 3.104 N/A LEU 102.A N ILE 70.A O no hydrogen 2.553 N/A LEU 103.A N GLU 57.A O no hydrogen 2.902 N/A LEU 104.A N TYR 72.A O no hydrogen 3.427 N/A ASP 105.A N ALA 55.A O no hydrogen 2.962 N/A TYR 106.A OH HIS 74.A O no hydrogen 2.936 N/A ARG 107.A N ASP 120.A OD2 no hydrogen 2.761 N/A ARG 107.A NE ASP 120.A OD1 no hydrogen 3.284 N/A ARG 107.A NE ASP 120.A OD2 no hydrogen 3.189 N/A ARG 107.A NH2 GLU 119.A OE2 no hydrogen 3.405 N/A ARG 107.A NH2 ASP 120.A OD1 no hydrogen 2.699 N/A ALA 109.A N TYR 78.A O no hydrogen 2.718 N/A HIS 112.A N LEU 108.A O no hydrogen 2.986 N/A PHE 114.A N TYR 206.A O no hydrogen 2.986 N/A ALA 116.A N PRO 113.A O no hydrogen 3.146 N/A GLU 119.A N PRO 115.A O no hydrogen 3.295 N/A ASP 120.A N ALA 116.A O no hydrogen 3.010 N/A GLY 121.A N ALA 117.A O no hydrogen 2.963 N/A VAL 122.A N VAL 118.A O no hydrogen 3.004 N/A ALA 123.A N GLU 119.A O no hydrogen 2.872 N/A ALA 124.A N ASP 120.A O no hydrogen 2.591 N/A TYR 125.A N GLY 121.A O no hydrogen 2.833 N/A TYR 125.A OH PRO 163.A O no hydrogen 2.668 N/A ARG 126.A N VAL 122.A O no hydrogen 2.887 N/A ARG 126.A NH2 GLN 160.A OE1 no hydrogen 2.829 N/A TRP 127.A N ALA 123.A O no hydrogen 2.945 N/A LEU 128.A N ALA 124.A O no hydrogen 2.944 N/A LEU 129.A N TYR 125.A O no hydrogen 3.139 N/A ASP 130.A N ARG 126.A O no hydrogen 2.946 N/A GLN 131.A N LEU 128.A O no hydrogen 2.893 N/A GLY 132.A N LEU 129.A O no hydrogen 3.350 N/A HIS 137.A N LYS 134.A O no hydrogen 2.686 N/A LEU 138.A N PRO 135.A O no hydrogen 3.008 N/A SER 139.A N ALA 69.A O no hydrogen 3.227 N/A SER 139.A OG SER 167.A OG no hydrogen 2.579 N/A ILE 140.A N SER 167.A O no hydrogen 3.311 N/A SER 141.A N LEU 71.A O no hydrogen 2.988 N/A SER 141.A OG ILE 169.A O no hydrogen 2.829 N/A GLY 142.A N ILE 169.A O no hydrogen 3.383 N/A ASP 143.A N LEU 73.A O no hydrogen 3.332 N/A SER 144.A N ILE 171.A O no hydrogen 2.926 N/A SER 144.A OG HIS 268.A NE2 no hydrogen 2.739 N/A GLY 146.A N ASP 143.A O no hydrogen 2.576 N/A GLY 147.A N SER 144.A O no hydrogen 2.945 N/A GLY 148.A N SER 144.A O no hydrogen 3.396 N/A LEU 149.A N ALA 145.A O no hydrogen 2.959 N/A VAL 150.A N GLY 146.A O no hydrogen 3.149 N/A LEU 151.A N GLY 148.A O no hydrogen 2.852 N/A ALA 152.A N GLY 148.A O no hydrogen 3.010 N/A VAL 153.A N LEU 149.A O no hydrogen 2.763 N/A LEU 154.A N VAL 150.A O no hydrogen 3.181 N/A VAL 155.A N LEU 151.A O no hydrogen 2.782 N/A SER 156.A N ALA 152.A O no hydrogen 3.010 N/A ALA 157.A N VAL 153.A O no hydrogen 2.915 N/A ARG 158.A N LEU 154.A O no hydrogen 2.880 N/A ARG 158.A NH1 ASN 223.A O no hydrogen 2.775 N/A ARG 158.A NH1 LYS 225.A O no hydrogen 2.985 N/A ARG 158.A NH2 ASP 159.A OD1 no hydrogen 2.971 N/A ARG 158.A NH2 ASN 223.A O no hydrogen 2.959 N/A ASP 159.A N VAL 155.A O no hydrogen 2.989 N/A GLN 160.A N ALA 157.A O no hydrogen 3.276 N/A GLY 161.A N ARG 158.A O no hydrogen 2.939 N/A LEU 162.A N ALA 157.A O no hydrogen 2.834 N/A ALA 166.A N LEU 138.A O no hydrogen 2.783 N/A SER 167.A OG SER 139.A OG no hydrogen 2.579 N/A ALA 168.A N PRO 229.A O no hydrogen 2.947 N/A ILE 169.A N ILE 140.A O no hydrogen 3.018 N/A ILE 171.A N GLY 142.A O no hydrogen 2.633 N/A SER 172.A N HIS 233.A O no hydrogen 2.876 N/A SER 172.A OG GLU 238.A OE2 no hydrogen 2.489 N/A TRP 174.A N SER 144.A O no hydrogen 2.805 N/A TRP 174.A NE1 ASP 176.A O no hydrogen 2.791 N/A ALA 175.A N ASP 243.A OD1 no hydrogen 2.983 N/A MET 177.A N SER 218.A OG no hydrogen 2.968 N/A THR 178.A N ASP 176.A OD1 no hydrogen 3.312 N/A THR 178.A OG1 ASP 176.A OD1 no hydrogen 2.479 N/A CYS 179.A SG MET 177.A O no hydrogen 3.991 N/A CYS 179.A SG ASN 200.A OD1 no hydrogen 3.702 N/A SER 183.A N ASP 242.A OD2 no hydrogen 2.732 N/A SER 183.A OG VAL 239.A O no hydrogen 2.790 N/A SER 183.A OG ASP 242.A OD2 no hydrogen 2.695 N/A PHE 184.A N ASN 181.A O no hydrogen 3.114 N/A LYS 185.A N ASP 182.A O no hydrogen 3.141 N/A THR 186.A N ASP 182.A O no hydrogen 3.109 N/A ARG 187.A N SER 183.A O no hydrogen 3.207 N/A ALA 188.A N LYS 185.A O no hydrogen 3.115 N/A ASP 191.A N ARG 187.A O no hydrogen 3.174 N/A LYS 201.A N GLY 197.A O no hydrogen 3.082 N/A MET 202.A N GLY 198.A O no hydrogen 3.184 N/A ALA 203.A N ILE 199.A O no hydrogen 3.272 N/A ALA 204.A N ASN 200.A O no hydrogen 3.256 N/A ARG 205.A N LYS 201.A O no hydrogen 2.925 N/A TYR 206.A N MET 202.A O no hydrogen 2.890 N/A TYR 206.A N ALA 203.A O no hydrogen 3.044 N/A LEU 207.A N ALA 203.A O no hydrogen 2.624 N/A ASN 208.A N ALA 204.A O no hydrogen 3.070 N/A ALA 210.A N LEU 207.A O no hydrogen 3.060 N/A LYS 213.A N ASP 211.A OD1 no hydrogen 3.070 N/A HIS 214.A N ASP 211.A O no hydrogen 2.901 N/A TYR 216.A N HIS 214.A ND1 no hydrogen 3.046 N/A TYR 216.A OH ASP 159.A OD2 no hydrogen 2.486 N/A ALA 217.A N HIS 214.A O no hydrogen 2.922 N/A SER 218.A N HIS 214.A O no hydrogen 2.746 N/A SER 218.A OG ALA 212.A O no hydrogen 2.229 N/A ASN 220.A N ALA 175.A O no hydrogen 3.217 N/A ASN 220.A ND2 ASP 243.A O no hydrogen 3.025 N/A PHE 221.A N SER 218.A O no hydrogen 3.132 N/A ALA 222.A N PRO 219.A O no hydrogen 3.167 N/A LEU 224.A N ASP 254.A OD2 no hydrogen 3.172 N/A LEU 227.A N LEU 224.A O no hydrogen 3.269 N/A LEU 230.A N LYS 257.A O no hydrogen 2.926 N/A LEU 231.A N ALA 168.A O no hydrogen 2.916 N/A ILE 232.A N THR 259.A O no hydrogen 3.138 N/A HIS 233.A N PRO 170.A O no hydrogen 3.332 N/A VAL 234.A N GLU 261.A O no hydrogen 3.481 N/A GLY 235.A N GLU 238.A OE2 no hydrogen 2.956 N/A ARG 236.A N TRP 263.A O no hydrogen 2.967 N/A ARG 236.A NE ASP 264.A OD2 no hydrogen 3.170 N/A ARG 236.A NH1 ASP 264.A OD2 no hydrogen 2.967 N/A ASP 237.A N MET 266.A O no hydrogen 3.219 N/A VAL 239.A N ASP 191.A OD2 no hydrogen 2.686 N/A LEU 241.A N GLU 238.A O no hydrogen 3.422 N/A ASP 242.A N SER 183.A OG no hydrogen 2.951 N/A ILE 245.A N LEU 241.A O no hydrogen 3.163 N/A LYS 246.A N ASP 242.A O no hydrogen 2.847 N/A LEU 247.A N ASP 243.A O no hydrogen 2.916 N/A ASP 248.A N SER 244.A O no hydrogen 2.910 N/A ALA 249.A N ILE 245.A O no hydrogen 3.023 N/A LYS 250.A N LYS 246.A O no hydrogen 2.989 N/A LYS 250.A NZ ALA 222.A O no hydrogen 3.093 N/A LYS 250.A NZ ASP 254.A OD2 no hydrogen 3.060 N/A ALA 251.A N LEU 247.A O no hydrogen 2.848 N/A LYS 252.A N ASP 248.A O no hydrogen 2.915 N/A ALA 253.A N ALA 249.A O no hydrogen 2.881 N/A ASP 254.A N LYS 250.A O no hydrogen 2.807 N/A GLY 255.A N ALA 251.A O no hydrogen 2.876 N/A VAL 256.A N ALA 251.A O no hydrogen 2.954 N/A SER 258.A OG ASP 248.A OD1 no hydrogen 2.926 N/A THR 259.A N LEU 230.A O no hydrogen 3.134 N/A GLU 261.A N ILE 232.A O no hydrogen 2.948 N/A TRP 263.A N VAL 234.A O no hydrogen 3.354 N/A TRP 263.A NE1 GLU 261.A OE1 no hydrogen 3.134 N/A MET 266.A N TRP 263.A O no hydrogen 3.427 N/A HIS 268.A ND1 GLU 238.A OE1 no hydrogen 2.796 N/A HIS 268.A NE2 SER 144.A OG no hydrogen 2.739 N/A VAL 269.A N SER 172.A OG no hydrogen 3.175 N/A HIS 271.A N HIS 271.A ND1 no hydrogen 2.763 N/A ALA 272.A N VAL 269.A O no hydrogen 3.242 N/A PHE 273.A N TRP 270.A O no hydrogen 3.093 N/A HIS 274.A N HIS 271.A O no hydrogen 3.221 N/A MET 276.A N PHE 273.A O no hydrogen 3.168 N/A LEU 277.A N HIS 274.A O no hydrogen 3.513 N/A GLU 279.A N GLU 279.A OE1 no hydrogen 2.582 N/A LYS 281.A N LEU 277.A O no hydrogen 3.164 N/A LYS 281.A NZ HIS 274.A O no hydrogen 2.894 N/A GLN 282.A N PRO 278.A O no hydrogen 2.843 N/A ALA 283.A N GLU 279.A O no hydrogen 2.809 N/A ILE 284.A N GLY 280.A O no hydrogen 2.972 N/A VAL 285.A N LYS 281.A O no hydrogen 3.051 N/A ARG 286.A NE GLU 261.A OE2 no hydrogen 2.793 N/A ARG 286.A NH2 GLU 261.A OE2 no hydrogen 2.890 N/A VAL 287.A N ALA 283.A O no hydrogen 3.129 N/A GLY 288.A N ILE 284.A O no hydrogen 3.185 N/A GLU 289.A N VAL 285.A O no hydrogen 3.158 N/A PHE 290.A N ARG 286.A O no hydrogen 3.125 N/A MET 291.A N VAL 287.A O no hydrogen 3.037 N/A ARG 292.A N GLY 288.A O no hydrogen 2.928 N/A ARG 292.A NE ALA 96.A O no hydrogen 3.333 N/A ARG 292.A NH2 ALA 96.A O no hydrogen 3.153 N/A GLU 293.A N GLU 289.A O no hydrogen 2.764 N/A GLN 294.A N PHE 290.A O no hydrogen 2.817 N/A TRP 295.A N MET 291.A O no hydrogen 3.009 N/A TRP 295.A NE1 LEU 138.A O no hydrogen 3.245 N/A ALA 296.A N ARG 292.A O no hydrogen 3.083 N/A ALA 297.A N GLU 293.A O no hydrogen 3.287 N/A