Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3c2r_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 5.A N VAL 2.A O no hydrogen 3.002 N/A LEU 6.A N TYR 3.A O no hydrogen 2.668 N/A LEU 7.A N GLU 4.A O no hydrogen 3.172 N/A GLY 11.A N ASN 10.A OD1 no hydrogen 2.718 N/A TRP 13.A NE1 PRO 8.A O no hydrogen 2.812 N/A ARG 14.A N GLY 11.A O no hydrogen 3.197 N/A ARG 14.A NE GLU 60.A OE2 no hydrogen 3.354 N/A ARG 14.A NH1 VAL 9.A O no hydrogen 2.705 N/A GLN 15.A NE2 ASN 19.A OD1 no hydrogen 2.806 N/A ASP 16.A N ALA 12.A O no hydrogen 2.997 N/A VAL 17.A N TRP 13.A O no hydrogen 3.368 N/A THR 18.A N ARG 14.A O no hydrogen 3.229 N/A THR 18.A OG1 ARG 14.A O no hydrogen 3.380 N/A THR 18.A OG1 GLN 64.A OE1 no hydrogen 2.446 N/A ASN 19.A N GLN 15.A O no hydrogen 2.840 N/A TRP 20.A N ASP 16.A O no hydrogen 2.901 N/A TRP 20.A N VAL 17.A O no hydrogen 2.989 N/A LEU 21.A N VAL 17.A O no hydrogen 3.055 N/A SER 22.A N THR 18.A O no hydrogen 3.121 N/A SER 22.A OG THR 18.A O no hydrogen 3.296 N/A GLU 23.A N ASN 19.A O no hydrogen 3.070 N/A ASP 24.A N LEU 21.A O no hydrogen 3.125 N/A VAL 25.A N LEU 21.A O no hydrogen 3.033 N/A VAL 25.A N SER 22.A O no hydrogen 3.302 N/A GLY 32.A N ASP 29.A OD1 no hydrogen 3.144 N/A TYR 33.A N ASP 29.A O no hydrogen 3.129 N/A VAL 34.A N PHE 30.A O no hydrogen 3.106 N/A VAL 35.A N GLY 31.A O no hydrogen 3.118 N/A GLY 36.A N GLY 32.A O no hydrogen 3.092 N/A LYS 40.A N GLY 96.A O no hydrogen 2.802 N/A ALA 42.A N ILE 94.A O no hydrogen 2.789 N/A ASN 43.A N LYS 264.A O no hydrogen 2.813 N/A ASN 43.A ND2 TYR 45.A OH no hydrogen 2.953 N/A LEU 44.A N ALA 92.A O no hydrogen 2.875 N/A TYR 45.A N SER 262.A O no hydrogen 2.682 N/A CYS 46.A N ILE 89.A O no hydrogen 3.025 N/A CYS 46.A SG GLN 48.A O no hydrogen 3.275 N/A LYS 47.A N ASP 260.A O no hydrogen 2.774 N/A GLY 50.A N LEU 79.A O no hydrogen 2.955 N/A MET 51.A N THR 120.A OG1 no hydrogen 2.818 N/A LEU 52.A N SER 77.A O no hydrogen 3.066 N/A CYS 53.A N SER 116.A OG no hydrogen 2.830 N/A CYS 53.A SG GLU 75.A OE2 no hydrogen 3.894 N/A CYS 53.A SG SER 115.A OG no hydrogen 3.306 N/A GLY 54.A N GLU 75.A OE2 no hydrogen 2.739 N/A VAL 55.A N GLU 75.A OE2 no hydrogen 2.738 N/A ALA 58.A N GLY 54.A O no hydrogen 2.930 N/A GLN 59.A N VAL 55.A O no hydrogen 2.818 N/A GLN 59.A NE2 ASN 63.A OD1 no hydrogen 2.790 N/A GLU 60.A N PRO 56.A O no hydrogen 3.012 N/A VAL 61.A N PHE 57.A O no hydrogen 3.239 N/A PHE 62.A N ALA 58.A O no hydrogen 3.000 N/A ASN 63.A N GLN 59.A O no hydrogen 2.830 N/A GLN 64.A N GLU 60.A O no hydrogen 3.086 N/A GLN 64.A NE2 ARG 14.A O no hydrogen 2.988 N/A GLN 64.A NE2 GLU 60.A OE2 no hydrogen 2.832 N/A CYS 65.A N VAL 61.A O no hydrogen 3.235 N/A CYS 65.A SG VAL 61.A O no hydrogen 3.432 N/A GLU 66.A N ASN 63.A O no hydrogen 2.888 N/A LEU 67.A N PHE 62.A O no hydrogen 3.018 N/A GLN 68.A N THR 95.A O no hydrogen 2.976 N/A GLU 70.A N LYS 93.A O no hydrogen 2.700 N/A TRP 71.A NE1 GLN 59.A OE1 no hydrogen 2.897 N/A LEU 72.A N VAL 91.A O no hydrogen 2.868 N/A GLY 76.A N LEU 52.A O no hydrogen 2.782 N/A SER 77.A N LYS 74.A O no hydrogen 3.199 N/A SER 77.A OG LYS 74.A O no hydrogen 2.638 N/A LEU 79.A N GLY 50.A O no hydrogen 2.827 N/A SER 82.A N GLU 80.A O no hydrogen 2.563 N/A ILE 89.A N CYS 46.A O no hydrogen 3.142 N/A VAL 91.A N LEU 44.A O no hydrogen 2.769 N/A LYS 93.A N GLU 70.A O no hydrogen 2.810 N/A ILE 94.A N ALA 42.A O no hydrogen 2.927 N/A THR 95.A N GLN 68.A O no hydrogen 2.969 N/A GLY 96.A N LYS 40.A O no hydrogen 3.144 N/A ALA 98.A N ASP 38.A O no hydrogen 2.784 N/A LYS 99.A N GLY 36.A O no hydrogen 3.006 N/A LYS 99.A NZ ASN 100.A OD1 no hydrogen 2.741 N/A ASN 100.A ND2 CYS 65.A O no hydrogen 2.799 N/A ILE 101.A N PRO 97.A O no hydrogen 3.162 N/A LEU 102.A N ALA 98.A O no hydrogen 3.268 N/A LEU 103.A N LYS 99.A O no hydrogen 3.001 N/A ALA 104.A N ASN 100.A O no hydrogen 3.040 N/A GLU 105.A N ILE 101.A O no hydrogen 2.986 N/A ARG 106.A NH1 ASN 110.A OD1 no hydrogen 3.567 N/A ALA 108.A N ALA 104.A O no hydrogen 3.014 N/A LEU 109.A N GLU 105.A O no hydrogen 3.115 N/A ASN 110.A N ARG 106.A O no hydrogen 2.845 N/A ILE 111.A N THR 107.A O no hydrogen 3.179 N/A LEU 112.A N ALA 108.A O no hydrogen 3.014 N/A SER 113.A N LEU 109.A O no hydrogen 2.821 N/A SER 113.A OG LEU 109.A O no hydrogen 3.259 N/A SER 113.A OG ASN 110.A O no hydrogen 3.231 N/A ARG 114.A N ASN 110.A O no hydrogen 3.436 N/A ARG 114.A NH1 ASN 110.A O no hydrogen 3.386 N/A SER 115.A N ILE 111.A O no hydrogen 2.911 N/A SER 115.A OG SER 155.A OG no hydrogen 2.664 N/A SER 116.A N LEU 112.A O no hydrogen 2.850 N/A SER 116.A OG MET 51.A O no hydrogen 3.487 N/A SER 116.A OG CYS 53.A O no hydrogen 3.195 N/A SER 116.A OG LEU 112.A O no hydrogen 2.909 N/A GLY 117.A N SER 113.A O no hydrogen 2.969 N/A ILE 118.A N ARG 114.A O no hydrogen 3.031 N/A ALA 119.A N SER 115.A O no hydrogen 2.977 N/A THR 120.A N SER 116.A O no hydrogen 2.846 N/A THR 120.A OG1 SER 116.A O no hydrogen 2.787 N/A ALA 121.A N GLY 117.A O no hydrogen 2.827 N/A SER 122.A N ILE 118.A O no hydrogen 2.870 N/A SER 122.A OG ILE 118.A O no hydrogen 2.717 N/A SER 122.A OG ILE 252.A O no hydrogen 2.736 N/A HIS 123.A N ALA 119.A O no hydrogen 2.876 N/A LYS 124.A N THR 120.A O no hydrogen 2.833 N/A ILE 125.A N ALA 121.A O no hydrogen 3.146 N/A ILE 126.A N SER 122.A O no hydrogen 3.122 N/A SER 127.A N HIS 123.A O no hydrogen 3.134 N/A SER 127.A OG HIS 123.A O no hydrogen 3.102 N/A SER 127.A OG LYS 124.A O no hydrogen 3.368 N/A LEU 128.A N LYS 124.A O no hydrogen 3.161 N/A ALA 129.A N ILE 125.A O no hydrogen 3.040 N/A SER 131.A N SER 127.A O no hydrogen 2.810 N/A SER 131.A OG LEU 128.A O no hydrogen 3.004 N/A THR 132.A OG1 ALA 129.A O no hydrogen 2.928 N/A TYR 134.A OH THR 137.A O no hydrogen 3.344 N/A TYR 134.A OH ILE 244.A O no hydrogen 2.887 N/A THR 137.A N TYR 134.A OH no hydrogen 2.989 N/A ALA 139.A N TYR 247.A O no hydrogen 2.874 N/A GLY 140.A N ASP 162.A O no hydrogen 2.915 N/A LYS 143.A N THR 141.A OG1 no hydrogen 3.125 N/A THR 145.A N GLU 152.A OE1 no hydrogen 2.620 N/A THR 145.A OG1 GLU 152.A OE1 no hydrogen 3.342 N/A THR 145.A OG1 GLU 152.A OE2 no hydrogen 2.429 N/A LEU 148.A N THR 145.A O no hydrogen 2.962 N/A ARG 149.A NE THR 144.A OG1 no hydrogen 3.086 N/A ARG 149.A NH2 ARG 142.A O no hydrogen 3.037 N/A ARG 149.A NH2 THR 144.A OG1 no hydrogen 3.398 N/A ARG 150.A NH1 ASP 16.A OD2 no hydrogen 3.290 N/A GLU 152.A N LEU 148.A O no hydrogen 3.084 N/A LYS 153.A N ARG 149.A O no hydrogen 2.899 N/A LYS 153.A NZ THR 141.A O no hydrogen 2.687 N/A LYS 153.A NZ THR 163.A O no hydrogen 2.954 N/A LYS 153.A NZ ARG 165.A O no hydrogen 2.998 N/A TYR 154.A N ARG 150.A O no hydrogen 3.096 N/A TYR 154.A OH GLU 75.A OE1 no hydrogen 2.504 N/A SER 155.A N LEU 151.A O no hydrogen 2.977 N/A SER 155.A OG SER 115.A O no hydrogen 3.256 N/A SER 155.A OG SER 115.A OG no hydrogen 2.664 N/A SER 155.A OG LEU 151.A O no hydrogen 2.994 N/A MET 156.A N GLU 152.A O no hydrogen 3.051 N/A LEU 157.A N LYS 153.A O no hydrogen 3.211 N/A VAL 158.A N TYR 154.A O no hydrogen 3.202 N/A GLY 159.A N SER 155.A O no hydrogen 2.830 N/A GLY 160.A N LEU 157.A O no hydrogen 2.869 N/A CYS 161.A N MET 156.A O no hydrogen 3.066 N/A CYS 161.A SG SER 122.A O no hydrogen 3.126 N/A ASP 162.A N ILE 138.A O no hydrogen 2.772 N/A THR 163.A OG1 HIS 164.A O no hydrogen 3.072 N/A HIS 164.A N ASP 162.A OD1 no hydrogen 2.683 N/A ASP 167.A N SER 170.A OG no hydrogen 3.404 N/A SER 169.A N ASP 167.A OD1 no hydrogen 2.627 N/A SER 170.A N ASP 167.A O no hydrogen 3.338 N/A SER 170.A OG ASP 167.A OD1 no hydrogen 2.781 N/A VAL 172.A N LYS 201.A O no hydrogen 3.320 N/A LEU 174.A N GLU 203.A O no hydrogen 2.857 N/A LYS 175.A N HIS 178.A ND1 no hydrogen 3.045 N/A LYS 175.A NZ GLU 205.A OE1 no hydrogen 3.408 N/A ILE 179.A N LYS 175.A O no hydrogen 3.066 N/A ILE 179.A N ASP 176.A O no hydrogen 2.904 N/A TRP 180.A N ASP 176.A O no hydrogen 2.617 N/A ALA 181.A N ASN 177.A O no hydrogen 2.962 N/A THR 182.A N HIS 178.A O no hydrogen 3.225 N/A THR 182.A OG1 HIS 178.A O no hydrogen 2.685 N/A THR 182.A OG1 ILE 179.A O no hydrogen 3.395 N/A THR 182.A OG1 SER 184.A O no hydrogen 3.292 N/A GLY 183.A N ILE 179.A O no hydrogen 2.718 N/A ILE 185.A N GLU 214.A OE1 no hydrogen 3.340 N/A THR 186.A OG1 GLU 214.A OE2 no hydrogen 2.858 N/A ASN 187.A N SER 184.A OG no hydrogen 2.883 N/A ASN 187.A ND2 THR 182.A O no hydrogen 3.243 N/A ALA 188.A N SER 184.A O no hydrogen 2.848 N/A VAL 189.A N ILE 185.A O no hydrogen 2.980 N/A LYS 190.A N THR 186.A O no hydrogen 2.850 N/A ASN 191.A N ASN 187.A O no hydrogen 2.976 N/A ALA 192.A N ALA 188.A O no hydrogen 2.833 N/A ARG 193.A N VAL 189.A O no hydrogen 2.815 N/A ARG 193.A NH1 GLY 197.A O no hydrogen 2.841 N/A ARG 193.A NH1 VAL 200.A O no hydrogen 2.884 N/A ARG 193.A NH2 GLY 219.A O no hydrogen 3.222 N/A ARG 193.A NH2 ASP 221.A OD2 no hydrogen 2.749 N/A ALA 194.A N LYS 190.A O no hydrogen 2.886 N/A VAL 195.A N ALA 192.A O no hydrogen 3.200 N/A CYS 196.A N ALA 192.A O no hydrogen 2.882 N/A CYS 196.A SG ALA 192.A O no hydrogen 3.245 N/A CYS 196.A SG GLY 197.A O no hydrogen 3.499 N/A CYS 196.A SG VAL 200.A O no hydrogen 3.718 N/A GLY 197.A N ARG 193.A O no hydrogen 3.081 N/A ILE 202.A N ASP 221.A OD2 no hydrogen 2.987 N/A GLU 203.A N VAL 172.A O no hydrogen 2.715 N/A VAL 204.A N VAL 222.A O no hydrogen 3.077 N/A GLU 205.A N LEU 174.A O no hydrogen 2.900 N/A CYS 206.A SG VAL 204.A O no hydrogen 3.804 N/A LEU 207.A N GLU 211.A OE2 no hydrogen 3.326 N/A GLU 209.A N GLU 209.A OE1 no hydrogen 2.501 N/A ASP 210.A N SER 208.A OG no hydrogen 3.340 N/A ALA 212.A N SER 208.A O no hydrogen 2.693 N/A THR 213.A N GLU 209.A O no hydrogen 3.147 N/A ALA 215.A N GLU 211.A O no hydrogen 2.776 N/A ILE 216.A N ALA 212.A O no hydrogen 2.840 N/A GLU 217.A N THR 213.A O no hydrogen 2.900 N/A ALA 218.A N GLU 214.A O no hydrogen 2.687 N/A ALA 220.A N ALA 215.A O no hydrogen 3.026 N/A ASP 221.A N ILE 202.A O no hydrogen 2.861 N/A VAL 222.A N ILE 202.A O no hydrogen 3.273 N/A ILE 223.A N LEU 230.A O no hydrogen 2.940 N/A MET 224.A N VAL 204.A O no hydrogen 2.940 N/A LEU 225.A N GLU 232.A O no hydrogen 2.965 N/A LEU 230.A N ASP 221.A O no hydrogen 3.005 N/A LEU 231.A N ASP 245.A OD1 no hydrogen 2.842 N/A GLU 232.A N ILE 223.A O no hydrogen 2.740 N/A CYS 233.A N ILE 246.A O no hydrogen 2.850 N/A SER 234.A N LEU 225.A O no hydrogen 3.433 N/A SER 234.A OG SER 248.A OG no hydrogen 3.229 N/A GLY 235.A N SER 248.A O no hydrogen 3.462 N/A ASP 242.A N TYR 247.A OH no hydrogen 3.117 N/A ASP 243.A N ASP 242.A OD1 no hydrogen 2.406 N/A ILE 246.A N LEU 231.A O no hydrogen 2.926 N/A TYR 247.A N THR 137.A O no hydrogen 2.945 N/A SER 248.A N CYS 233.A O no hydrogen 3.167 N/A SER 248.A OG GLU 232.A OE2 no hydrogen 2.517 N/A SER 248.A OG SER 234.A OG no hydrogen 3.229 N/A THR 249.A N ALA 139.A O no hydrogen 3.022 N/A SER 250.A OG GLN 254.A OE1 no hydrogen 3.274 N/A SER 251.A N THR 249.A OG1 no hydrogen 3.041 N/A SER 251.A OG THR 249.A OG1 no hydrogen 2.993 N/A HIS 253.A N SER 250.A O no hydrogen 3.249 N/A GLN 254.A N SER 250.A O no hydrogen 2.726 N/A THR 256.A OG1 PRO 257.A O no hydrogen 3.405 N/A ILE 259.A N SER 113.A O no hydrogen 3.035 N/A ASP 260.A N GLN 48.A OE1 no hydrogen 2.704 N/A SER 262.A N TYR 45.A O no hydrogen 2.923 N/A LYS 264.A N ASN 43.A O no hydrogen 3.067 N/A ALA 266.A N GLU 41.A O no hydrogen 2.728 N/A