Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3a2c_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 4.A OG GLY 5.A O no hydrogen 3.557 N/A LYS 9.A N VAL 77.A O no hydrogen 2.712 N/A LYS 9.A NZ ASP 76.A OD2 no hydrogen 2.638 N/A ILE 13.A N ASN 80.A OD1 no hydrogen 2.752 N/A ASP 15.A N ALA 12.A O no hydrogen 2.719 N/A ASP 16.A N ILE 13.A O no hydrogen 2.834 N/A TYR 17.A N ILE 13.A O no hydrogen 2.839 N/A TYR 17.A OH ASP 76.A OD1 no hydrogen 2.860 N/A LYS 18.A N PHE 36.A O no hydrogen 3.048 N/A LEU 24.A N THR 20.A O no hydrogen 2.815 N/A GLY 25.A N SER 21.A O no hydrogen 3.030 N/A LEU 26.A N GLN 22.A O no hydrogen 3.298 N/A GLY 27.A N VAL 23.A O no hydrogen 2.648 N/A ILE 28.A N LEU 24.A O no hydrogen 3.386 N/A ASN 29.A N LEU 26.A O no hydrogen 2.837 N/A GLY 30.A N GLY 27.A O no hydrogen 2.681 N/A LYS 31.A N LEU 26.A O no hydrogen 3.360 N/A LEU 33.A N LEU 46.A O no hydrogen 3.014 N/A ILE 35.A N PHE 44.A O no hydrogen 2.713 N/A ASN 37.A N GLU 42.A O no hydrogen 2.856 N/A LYS 38.A N ASP 16.A O no hydrogen 3.097 N/A LYS 38.A NZ ILE 14.A O no hydrogen 2.856 N/A THR 40.A N ASN 37.A OD1 no hydrogen 2.604 N/A GLN 41.A N ASN 37.A O no hydrogen 2.509 N/A LYS 43.A NZ ASP 96.A OD2 no hydrogen 2.707 N/A PHE 44.A N ILE 35.A O no hydrogen 2.802 N/A ALA 45.A N MET 92.A O no hydrogen 2.898 N/A LEU 46.A N LEU 33.A O no hydrogen 2.769 N/A LYS 47.A N ILE 90.A O no hydrogen 3.023 N/A LYS 47.A NZ GLU 58.A OE1 no hydrogen 2.896 N/A LEU 49.A N LEU 88.A O no hydrogen 2.787 N/A ASP 51.A N LYS 86.A O no hydrogen 2.721 N/A CYS 52.A SG GLN 50.A O no hydrogen 3.838 N/A ARG 56.A N CYS 52.A O no hydrogen 2.834 N/A ARG 56.A NE ASP 51.A OD1 no hydrogen 2.668 N/A ARG 56.A NH2 ASP 51.A OD2 no hydrogen 2.331 N/A ARG 56.A NH2 GLU 79.A OE1 no hydrogen 2.288 N/A ARG 57.A N PRO 53.A O no hydrogen 2.989 N/A ARG 57.A N LYS 54.A O no hydrogen 2.933 N/A GLU 58.A N LYS 54.A O no hydrogen 2.981 N/A VAL 59.A N ALA 55.A O no hydrogen 3.050 N/A GLU 60.A N ARG 56.A O no hydrogen 3.247 N/A LEU 61.A N ARG 57.A O no hydrogen 2.981 N/A HIS 62.A N GLU 58.A O no hydrogen 2.983 N/A HIS 62.A NE2 VAL 72.A O no hydrogen 2.995 N/A TRP 63.A N VAL 59.A O no hydrogen 2.961 N/A ARG 64.A N GLU 60.A O no hydrogen 3.075 N/A ARG 64.A NE GLU 60.A OE1 no hydrogen 3.462 N/A ARG 64.A NH2 GLU 167.A OE2 no hydrogen 3.083 N/A ALA 65.A N LEU 61.A O no hydrogen 2.901 N/A SER 66.A N TRP 63.A O no hydrogen 3.301 N/A SER 66.A OG HIS 62.A O no hydrogen 2.594 N/A SER 66.A OG TRP 63.A O no hydrogen 3.413 N/A CYS 68.A N ALA 65.A O no hydrogen 3.267 N/A HIS 70.A ND1 LEU 157.A O no hydrogen 3.200 N/A ILE 71.A N CYS 68.A O no hydrogen 3.462 N/A VAL 72.A N LEU 159.A O no hydrogen 3.251 N/A ARG 73.A N GLU 93.A OE1 no hydrogen 2.615 N/A VAL 75.A N VAL 91.A O no hydrogen 2.556 N/A ASP 76.A N VAL 91.A O no hydrogen 3.283 N/A TYR 78.A N LEU 89.A O no hydrogen 2.773 N/A TYR 78.A OH ASP 16.A OD2 no hydrogen 2.761 N/A GLU 79.A N LYS 9.A O no hydrogen 2.872 N/A ASN 80.A N CYS 87.A O no hydrogen 2.963 N/A ASN 80.A ND2 ASN 11.A O no hydrogen 2.882 N/A ASN 80.A ND2 GLU 79.A O no hydrogen 2.663 N/A TYR 82.A N ARG 85.A O no hydrogen 2.895 N/A LYS 86.A NZ ASP 51.A OD2 no hydrogen 2.823 N/A LYS 86.A NZ GLU 79.A OE1 no hydrogen 2.952 N/A CYS 87.A N ASN 80.A O no hydrogen 2.907 N/A CYS 87.A SG ASN 80.A O no hydrogen 3.410 N/A LEU 88.A N LEU 49.A O no hydrogen 2.574 N/A LEU 89.A N TYR 78.A O no hydrogen 2.748 N/A ILE 90.A N LYS 47.A O no hydrogen 2.884 N/A VAL 91.A N ASP 76.A O no hydrogen 2.801 N/A MET 92.A N ALA 45.A O no hydrogen 2.837 N/A GLU 93.A N ARG 73.A O no hydrogen 2.851 N/A CYS 94.A SG ASP 96.A OD2 no hydrogen 3.514 N/A ASP 96.A N THR 149.A O no hydrogen 2.783 N/A GLY 97.A N TYR 148.A O no hydrogen 2.643 N/A LEU 100.A N LEU 146.A O no hydrogen 2.737 N/A SER 102.A N GLU 99.A O no hydrogen 3.046 N/A SER 102.A OG GLU 99.A O no hydrogen 2.761 N/A ARG 103.A N GLU 99.A O no hydrogen 3.276 N/A ARG 103.A NH1 SER 150.A O no hydrogen 2.676 N/A GLN 105.A N PHE 101.A O no hydrogen 3.121 N/A GLN 105.A NE2 LEU 272.A O no hydrogen 2.669 N/A ASP 106.A N SER 102.A O no hydrogen 3.068 N/A ARG 107.A NH1 ALA 111.A O no hydrogen 2.760 N/A ARG 107.A NH1 GLU 116.A OE1 no hydrogen 3.472 N/A ARG 107.A NH2 GLU 116.A OE1 no hydrogen 3.342 N/A ARG 107.A NH2 GLU 116.A OE2 no hydrogen 2.975 N/A GLN 110.A NE2 ARG 107.A O no hydrogen 2.553 N/A GLU 114.A N THR 264.A O no hydrogen 3.006 N/A ARG 115.A NH1 VAL 261.A O no hydrogen 2.809 N/A GLU 116.A N THR 113.A OG1 no hydrogen 3.348 N/A ALA 117.A N THR 113.A O no hydrogen 3.055 N/A SER 118.A N GLU 114.A O no hydrogen 2.856 N/A SER 118.A OG TRP 254.A O no hydrogen 2.468 N/A SER 118.A OG SER 258.A OG no hydrogen 3.257 N/A GLU 119.A N ARG 115.A O no hydrogen 3.109 N/A ILE 120.A N GLU 116.A O no hydrogen 2.970 N/A MET 121.A N ALA 117.A O no hydrogen 2.928 N/A LYS 122.A N SER 118.A O no hydrogen 2.936 N/A SER 123.A N ILE 120.A O no hydrogen 2.796 N/A ILE 124.A N ILE 120.A O no hydrogen 3.194 N/A GLY 125.A N MET 121.A O no hydrogen 3.147 N/A GLU 126.A N LYS 122.A O no hydrogen 3.056 N/A GLU 126.A N SER 123.A O no hydrogen 3.204 N/A ALA 127.A N SER 123.A O no hydrogen 3.414 N/A ILE 128.A N ILE 124.A O no hydrogen 2.971 N/A GLN 129.A N GLY 125.A O no hydrogen 2.748 N/A TYR 130.A N GLU 126.A O no hydrogen 3.178 N/A LEU 131.A N ALA 127.A O no hydrogen 3.107 N/A HIS 132.A N ILE 128.A O no hydrogen 2.892 N/A HIS 132.A NE2 ASP 182.A OD2 no hydrogen 2.521 N/A SER 133.A N GLN 129.A O no hydrogen 3.235 N/A SER 133.A OG TYR 130.A O no hydrogen 2.996 N/A ILE 134.A N LEU 131.A O no hydrogen 2.683 N/A ASN 135.A N HIS 132.A O no hydrogen 3.006 N/A ASN 135.A ND2 THR 168.A OG1 no hydrogen 2.616 N/A ILE 136.A N LEU 131.A O no hydrogen 3.250 N/A ALA 137.A N LYS 166.A O no hydrogen 2.824 N/A HIS 138.A N ASP 182.A OD2 no hydrogen 2.998 N/A HIS 138.A NE2 THR 160.A O no hydrogen 2.904 N/A ARG 139.A N ASP 182.A OD1 no hydrogen 2.766 N/A ASP 140.A N HIS 138.A ND1 no hydrogen 3.087 N/A LYS 142.A NZ ASP 140.A OD1 no hydrogen 3.336 N/A LYS 142.A NZ ASP 140.A OD2 no hydrogen 3.260 N/A ASN 145.A N LYS 142.A O no hydrogen 2.979 N/A ASN 145.A ND2 ASP 140.A O no hydrogen 2.699 N/A ASN 145.A ND2 ASP 140.A OD2 no hydrogen 3.004 N/A LEU 146.A N PRO 143.A O no hydrogen 2.881 N/A LEU 147.A N LYS 158.A O no hydrogen 3.121 N/A TYR 148.A N GLY 98.A O no hydrogen 2.903 N/A THR 149.A N ILE 156.A O no hydrogen 2.906 N/A ALA 155.A N ARG 152.A O no hydrogen 3.251 N/A ILE 156.A N THR 149.A OG1 no hydrogen 3.269 N/A LYS 158.A N LEU 147.A O no hydrogen 2.884 N/A LYS 158.A NZ PRO 69.A O no hydrogen 2.860 N/A LYS 158.A NZ GLU 93.A OE1 no hydrogen 2.810 N/A LYS 158.A NZ GLU 93.A OE2 no hydrogen 3.416 N/A LEU 159.A N HIS 70.A O no hydrogen 2.618 N/A THR 160.A N ASN 145.A O no hydrogen 2.802 N/A THR 160.A OG1 ASN 145.A O no hydrogen 3.210 N/A THR 160.A OG1 ASP 161.A OD2 no hydrogen 2.524 N/A ALA 165.A N PHE 162.A O no hydrogen 3.440 N/A LYS 166.A N ALA 137.A O no hydrogen 2.998 N/A THR 168.A N ASN 135.A O no hydrogen 2.672 N/A THR 169.A OG1 SER 170.A O no hydrogen 3.410 N/A VAL 175.A N ALA 172.A O no hydrogen 3.219 N/A LEU 176.A N PRO 173.A O no hydrogen 2.588 N/A LYS 179.A NZ HIS 132.A O no hydrogen 3.078 N/A SER 180.A OG TYR 177.A O no hydrogen 2.887 N/A CYS 181.A N ASP 178.A O no hydrogen 3.000 N/A ASP 182.A N ASP 178.A O no hydrogen 3.388 N/A MET 183.A N SER 180.A O no hydrogen 3.314 N/A TRP 184.A N SER 180.A O no hydrogen 3.226 N/A TRP 184.A N CYS 181.A O no hydrogen 3.198 N/A SER 185.A N CYS 181.A O no hydrogen 3.114 N/A SER 185.A OG CYS 181.A O no hydrogen 3.238 N/A LEU 186.A N ASP 182.A O no hydrogen 3.146 N/A GLY 187.A N MET 183.A O no hydrogen 3.107 N/A VAL 188.A N TRP 184.A O no hydrogen 2.907 N/A ILE 189.A N SER 185.A O no hydrogen 2.804 N/A MET 190.A N LEU 186.A O no hydrogen 2.867 N/A TYR 191.A N GLY 187.A O no hydrogen 3.017 N/A TYR 191.A OH GLU 215.A O no hydrogen 2.665 N/A ILE 192.A N VAL 188.A O no hydrogen 3.082 N/A LEU 193.A N ILE 189.A O no hydrogen 2.941 N/A LEU 194.A N MET 190.A O no hydrogen 3.258 N/A LEU 194.A N TYR 191.A O no hydrogen 3.119 N/A CYS 195.A N ILE 192.A O no hydrogen 2.852 N/A CYS 195.A SG TYR 191.A O no hydrogen 3.624 N/A CYS 195.A SG TYR 197.A O no hydrogen 3.231 N/A GLY 196.A N ILE 192.A O no hydrogen 2.777 N/A LYS 206.A N SER 202.A O no hydrogen 3.024 N/A THR 207.A N PRO 203.A O no hydrogen 2.874 N/A THR 207.A OG1 PRO 203.A O no hydrogen 2.825 N/A ARG 208.A N GLY 204.A O no hydrogen 2.941 N/A ILE 209.A N MET 205.A O no hydrogen 3.070 N/A ARG 210.A N LYS 206.A O no hydrogen 3.206 N/A MET 211.A N THR 207.A O no hydrogen 2.700 N/A GLY 212.A N ILE 209.A O no hydrogen 2.782 N/A GLN 213.A N ARG 208.A O no hydrogen 2.808 N/A TRP 221.A N PRO 217.A O no hydrogen 3.008 N/A SER 222.A N PRO 219.A O no hydrogen 3.399 N/A SER 222.A OG PRO 219.A O no hydrogen 3.051 N/A SER 222.A OG GLU 223.A OE1 no hydrogen 3.073 N/A SER 222.A OG GLU 223.A OE2 no hydrogen 2.897 N/A VAL 224.A N TRP 221.A O no hydrogen 3.116 N/A SER 225.A N GLU 114.A OE1 no hydrogen 3.080 N/A SER 225.A OG GLU 114.A OE2 no hydrogen 2.912 N/A LYS 229.A NZ TRP 221.A O no hydrogen 3.212 N/A LYS 229.A NZ VAL 224.A O no hydrogen 3.378 N/A MET 230.A N GLU 226.A O no hydrogen 3.108 N/A LEU 231.A N GLU 227.A O no hydrogen 3.284 N/A ILE 232.A N VAL 228.A O no hydrogen 2.703 N/A ARG 233.A N LYS 229.A O no hydrogen 2.836 N/A ARG 233.A NH2 GLU 226.A OE2 no hydrogen 2.491 N/A ASN 234.A N MET 230.A O no hydrogen 2.843 N/A LEU 235.A N LEU 231.A O no hydrogen 3.046 N/A LEU 236.A N ILE 232.A O no hydrogen 2.797 N/A LYS 237.A N ASN 234.A O no hydrogen 2.875 N/A LYS 237.A NZ GLN 242.A OE1 no hydrogen 3.197 N/A THR 238.A OG1 ARG 210.A O no hydrogen 3.330 N/A THR 241.A N GLU 239.A OE2 no hydrogen 3.190 N/A THR 241.A OG1 GLU 239.A OE2 no hydrogen 2.719 N/A GLN 242.A N GLU 239.A O no hydrogen 2.881 N/A ARG 243.A N PRO 240.A O no hydrogen 2.772 N/A ARG 243.A NE LYS 237.A O no hydrogen 2.516 N/A ARG 243.A NH1 SER 180.A O no hydrogen 2.811 N/A ARG 243.A NH2 LYS 237.A O no hydrogen 3.092 N/A ARG 243.A NH2 THR 238.A O no hydrogen 3.130 N/A THR 245.A N GLU 248.A OE1 no hydrogen 3.124 N/A GLU 248.A N THR 245.A OG1 no hydrogen 3.421 N/A PHE 249.A N THR 245.A O no hydrogen 2.872 N/A MET 250.A N ILE 246.A O no hydrogen 2.898 N/A ASN 251.A N THR 247.A O no hydrogen 3.159 N/A ASN 251.A ND2 THR 247.A O no hydrogen 2.541 N/A HIS 252.A N PHE 249.A O no hydrogen 3.043 N/A TRP 254.A N HIS 252.A ND1 no hydrogen 2.919 N/A TRP 254.A NE1 GLU 114.A OE2 no hydrogen 2.852 N/A MET 256.A N HIS 252.A O no hydrogen 2.819 N/A GLN 257.A N PRO 253.A O no hydrogen 2.934 N/A SER 258.A OG SER 118.A OG no hydrogen 3.257 N/A SER 258.A OG ILE 255.A O no hydrogen 3.246 N/A VAL 261.A N SER 258.A O no hydrogen 2.665 N/A THR 264.A OG1 GLU 223.A O no hydrogen 3.399 N/A LEU 266.A N PHE 112.A O no hydrogen 3.003 N/A THR 268.A OG1 LEU 193.A O no hydrogen 2.654 N/A SER 269.A OG ILE 104.A O no hydrogen 2.834 N/A VAL 271.A N HIS 267.A O no hydrogen 2.730 N/A LEU 272.A N THR 268.A O no hydrogen 2.752 N/A LYS 273.A N SER 269.A O no hydrogen 3.098 N/A GLU 274.A N ARG 270.A O no hydrogen 3.220 N/A