Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2itz_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 11.A N ILE 84.A O no hydrogen 2.714 N/A LYS 12.A NZ GLU 38.A OE1 no hydrogen 2.990 N/A LYS 12.A NZ GLU 38.A OE2 no hydrogen 2.857 N/A GLU 15.A N LYS 12.A O no hydrogen 2.839 N/A PHE 16.A N GLU 13.A O no hydrogen 3.327 N/A LYS 17.A N LEU 34.A O no hydrogen 2.847 N/A LYS 17.A NZ PHE 16.A O no hydrogen 3.014 N/A LYS 18.A NZ GLU 287.A OE1 no hydrogen 3.191 N/A LEU 22.A N VAL 30.A O no hydrogen 2.840 N/A GLY 23.A N VAL 30.A O no hydrogen 3.079 N/A VAL 30.A N GLY 23.A O no hydrogen 2.830 N/A TYR 31.A N ILE 48.A O no hydrogen 2.832 N/A TYR 31.A OH GLU 50.A OE2 no hydrogen 2.981 N/A LYS 32.A N LYS 20.A O no hydrogen 2.885 N/A GLY 33.A N VAL 46.A O no hydrogen 2.759 N/A TRP 35.A N ILE 44.A O no hydrogen 2.883 N/A ILE 36.A N GLU 15.A O no hydrogen 2.681 N/A GLU 38.A N GLU 15.A OE2 no hydrogen 3.265 N/A LYS 41.A NZ ASP 292.A OD1 no hydrogen 3.414 N/A LYS 43.A N ASP 292.A O no hydrogen 2.815 N/A LYS 43.A NZ ASP 289.A O no hydrogen 3.255 N/A ILE 44.A N TRP 35.A O no hydrogen 2.837 N/A VAL 46.A N GLY 33.A O no hydrogen 3.133 N/A ALA 47.A N THR 94.A O no hydrogen 2.713 N/A ILE 48.A N TYR 31.A O no hydrogen 2.745 N/A LYS 49.A N LEU 92.A O no hydrogen 2.804 N/A GLU 50.A N THR 29.A O no hydrogen 3.075 N/A ARG 52.A NH1 ALA 26.A O no hydrogen 2.498 N/A LYS 58.A NZ LYS 58.A O no hydrogen 2.676 N/A ALA 59.A N SER 56.A O no hydrogen 2.817 N/A LYS 61.A NZ ASP 65.A OD2 no hydrogen 3.293 N/A GLU 62.A N ALA 59.A O no hydrogen 3.238 N/A ILE 63.A N ALA 59.A O no hydrogen 3.042 N/A LEU 64.A N ASN 60.A O no hydrogen 2.954 N/A GLU 66.A N GLU 62.A O no hydrogen 3.249 N/A ALA 67.A N ILE 63.A O no hydrogen 3.037 N/A TYR 68.A N LEU 64.A O no hydrogen 2.968 N/A VAL 69.A N ASP 65.A O no hydrogen 3.014 N/A MET 70.A N GLU 66.A O no hydrogen 2.760 N/A ALA 71.A N ALA 67.A O no hydrogen 2.740 N/A SER 72.A N VAL 69.A O no hydrogen 2.707 N/A SER 72.A OG ASN 4.A OD1 no hydrogen 2.725 N/A SER 72.A OG TYR 68.A O no hydrogen 3.014 N/A ASP 74.A N TYR 131.A OH no hydrogen 2.767 N/A HIS 77.A N ASN 75.A OD1 no hydrogen 2.732 N/A HIS 77.A ND1 VAL 155.A O no hydrogen 3.115 N/A VAL 78.A N ASN 75.A O no hydrogen 3.334 N/A CYS 79.A N ILE 157.A O no hydrogen 2.847 N/A LEU 81.A N MET 70.A O no hydrogen 3.020 N/A LEU 82.A N ILE 93.A O no hydrogen 2.632 N/A ILE 84.A N ARG 9.A O no hydrogen 2.807 N/A CYS 85.A N GLN 91.A O no hydrogen 2.908 N/A CYS 85.A SG LEU 11.A O no hydrogen 3.204 N/A THR 87.A OG1 THR 89.A O no hydrogen 2.557 N/A GLN 91.A N CYS 85.A O no hydrogen 3.070 N/A LEU 92.A N LYS 49.A O no hydrogen 3.097 N/A ILE 93.A N GLY 83.A O no hydrogen 2.955 N/A THR 94.A N ALA 47.A O no hydrogen 2.938 N/A THR 94.A OG1 ARG 80.A O no hydrogen 2.502 N/A LEU 96.A N PRO 45.A O no hydrogen 3.125 N/A PHE 99.A N VAL 149.A O no hydrogen 3.211 N/A GLY 100.A N MET 97.A O no hydrogen 2.887 N/A CYS 101.A SG ALA 144.A O no hydrogen 3.846 N/A CYS 101.A SG ARG 145.A O no hydrogen 3.366 N/A LEU 102.A N VAL 147.A O no hydrogen 2.655 N/A LEU 103.A N ALA 144.A O no hydrogen 3.391 N/A TYR 105.A N CYS 101.A O no hydrogen 3.146 N/A VAL 106.A N LEU 102.A O no hydrogen 2.822 N/A ARG 107.A N LEU 103.A O no hydrogen 3.132 N/A ARG 107.A NE GLY 205.A O no hydrogen 3.001 N/A ARG 107.A NH2 GLY 205.A O no hydrogen 3.063 N/A GLU 108.A N ASP 104.A O no hydrogen 2.741 N/A HIS 109.A N TYR 105.A O no hydrogen 2.956 N/A HIS 109.A N VAL 106.A O no hydrogen 3.212 N/A HIS 109.A ND1 TYR 105.A O no hydrogen 3.145 N/A ASN 112.A N HIS 109.A O no hydrogen 2.835 N/A ILE 113.A N LYS 110.A O no hydrogen 3.356 N/A SER 115.A N ASP 278.A OD2 no hydrogen 3.318 N/A SER 115.A OG ASP 278.A OD1 no hydrogen 3.139 N/A GLN 116.A NE2 ALA 266.A O no hydrogen 2.779 N/A TYR 117.A N GLY 114.A O no hydrogen 3.029 N/A LEU 118.A N GLY 114.A O no hydrogen 3.401 N/A LEU 119.A N SER 115.A O no hydrogen 3.093 N/A ASN 120.A N GLN 116.A O no hydrogen 2.920 N/A TRP 121.A N TYR 117.A O no hydrogen 2.862 N/A TRP 121.A NE1 PRO 152.A O no hydrogen 2.864 N/A CYS 122.A N LEU 118.A O no hydrogen 3.128 N/A CYS 122.A SG LEU 118.A O no hydrogen 3.225 N/A VAL 123.A N LEU 119.A O no hydrogen 3.019 N/A GLN 124.A N ASN 120.A O no hydrogen 2.871 N/A GLN 124.A NE2 GLN 153.A O no hydrogen 2.881 N/A ILE 125.A N TRP 121.A O no hydrogen 2.815 N/A ALA 126.A N CYS 122.A O no hydrogen 3.008 N/A LYS 127.A N VAL 123.A O no hydrogen 3.020 N/A LYS 127.A N GLN 124.A O no hydrogen 3.088 N/A GLY 128.A N GLN 124.A O no hydrogen 2.979 N/A MET 129.A N ILE 125.A O no hydrogen 2.899 N/A ASN 130.A N ALA 126.A O no hydrogen 3.004 N/A TYR 131.A N LYS 127.A O no hydrogen 2.846 N/A LEU 132.A N GLY 128.A O no hydrogen 3.116 N/A GLU 133.A N MET 129.A O no hydrogen 2.976 N/A ASP 134.A N ASN 130.A O no hydrogen 3.011 N/A ARG 135.A N TYR 131.A O no hydrogen 3.189 N/A ARG 135.A NH2 SER 72.A O no hydrogen 3.097 N/A ARG 136.A N GLU 133.A O no hydrogen 2.619 N/A LEU 137.A N LEU 132.A O no hydrogen 2.717 N/A VAL 138.A N LYS 164.A O no hydrogen 2.691 N/A HIS 139.A N ASP 190.A OD2 no hydrogen 2.734 N/A HIS 139.A NE2 THR 158.A O no hydrogen 3.047 N/A ARG 140.A N ASP 190.A OD1 no hydrogen 3.068 N/A ARG 140.A NH2 ARG 162.A O no hydrogen 2.259 N/A ASP 141.A N HIS 139.A ND1 no hydrogen 2.854 N/A ALA 144.A N GLU 200.A OE2 no hydrogen 2.991 N/A ARG 145.A NH1 ASP 141.A OD1 no hydrogen 2.970 N/A ASN 146.A N ALA 143.A O no hydrogen 2.872 N/A ASN 146.A ND2 ASP 141.A O no hydrogen 2.587 N/A VAL 147.A N ALA 144.A O no hydrogen 3.195 N/A LEU 148.A N LYS 156.A O no hydrogen 2.859 N/A VAL 149.A N GLY 100.A O no hydrogen 2.734 N/A LYS 150.A N HIS 154.A O no hydrogen 2.803 N/A LYS 150.A NZ ASP 297.A OD2 no hydrogen 2.723 N/A THR 151.A OG1 GLN 153.A OE1 no hydrogen 3.374 N/A GLN 153.A N THR 151.A OG1 no hydrogen 3.200 N/A HIS 154.A N THR 151.A O no hydrogen 2.777 N/A VAL 155.A N GLN 124.A OE1 no hydrogen 2.744 N/A LYS 156.A N LEU 148.A O no hydrogen 3.007 N/A LYS 156.A NZ ASP 297.A OD1 no hydrogen 2.855 N/A LYS 156.A NZ ASP 297.A OD2 no hydrogen 3.404 N/A ILE 157.A N HIS 77.A O no hydrogen 2.810 N/A THR 158.A N ASN 146.A O no hydrogen 2.969 N/A ARG 162.A NH2 TYR 185.A OH no hydrogen 3.134 N/A ALA 163.A N PHE 160.A O no hydrogen 3.070 N/A LYS 164.A N VAL 138.A O no hydrogen 3.033 N/A LEU 166.A N ARG 136.A O no hydrogen 3.232 N/A LYS 173.A NZ PRO 208.A O no hydrogen 3.488 N/A LYS 173.A NZ TYR 209.A O no hydrogen 3.035 N/A LYS 173.A NZ ILE 212.A O no hydrogen 2.896 N/A TRP 174.A NE1 GLU 200.A OE2 no hydrogen 2.684 N/A MET 175.A N ILE 172.A O no hydrogen 2.899 N/A SER 179.A N ALA 176.A O no hydrogen 3.157 N/A SER 179.A OG ILE 184.A O no hydrogen 2.673 N/A ILE 180.A N ALA 176.A O no hydrogen 3.286 N/A ILE 180.A N LEU 177.A O no hydrogen 2.706 N/A LEU 181.A N LEU 177.A O no hydrogen 2.900 N/A ARG 183.A N SER 179.A O no hydrogen 3.013 N/A ILE 184.A N GLU 178.A O no hydrogen 3.034 N/A THR 186.A N SER 189.A OG no hydrogen 2.788 N/A GLN 188.A N THR 186.A OG1 no hydrogen 3.275 N/A GLN 188.A NE2 ALA 249.A O no hydrogen 3.399 N/A GLN 188.A NE2 PRO 253.A O no hydrogen 3.078 N/A SER 189.A N THR 186.A O no hydrogen 2.882 N/A SER 189.A OG THR 186.A O no hydrogen 2.718 N/A ASP 190.A N THR 186.A O no hydrogen 3.161 N/A VAL 191.A N HIS 187.A O no hydrogen 3.045 N/A TRP 192.A N GLN 188.A O no hydrogen 3.345 N/A SER 193.A N SER 189.A O no hydrogen 3.366 N/A SER 193.A OG TRP 174.A O no hydrogen 2.482 N/A SER 193.A OG SER 189.A O no hydrogen 3.340 N/A TYR 194.A N ASP 190.A O no hydrogen 2.720 N/A TYR 194.A OH CYS 122.A O no hydrogen 2.716 N/A GLY 195.A N VAL 191.A O no hydrogen 2.800 N/A VAL 196.A N TRP 192.A O no hydrogen 3.265 N/A THR 197.A N SER 193.A O no hydrogen 2.736 N/A THR 197.A OG1 SER 193.A O no hydrogen 2.840 N/A VAL 198.A N TYR 194.A O no hydrogen 2.850 N/A TRP 199.A N GLY 195.A O no hydrogen 3.050 N/A TRP 199.A NE1 PRO 228.A O no hydrogen 2.910 N/A GLU 200.A N VAL 196.A O no hydrogen 2.908 N/A LEU 201.A N THR 197.A O no hydrogen 3.137 N/A MET 202.A N VAL 198.A O no hydrogen 2.868 N/A THR 203.A N TRP 199.A O no hydrogen 3.053 N/A THR 203.A OG1 TRP 199.A O no hydrogen 2.832 N/A THR 203.A OG1 GLU 200.A O no hydrogen 3.028 N/A PHE 204.A N LEU 201.A O no hydrogen 2.779 N/A GLY 205.A N GLU 200.A O no hydrogen 2.738 N/A SER 206.A N THR 203.A OG1 no hydrogen 3.084 N/A SER 206.A OG THR 203.A O no hydrogen 3.556 N/A ASP 210.A N LYS 207.A O no hydrogen 3.122 N/A GLU 216.A N PRO 213.A O no hydrogen 2.893 N/A ILE 220.A N GLU 216.A O no hydrogen 3.046 N/A LEU 221.A N ILE 217.A O no hydrogen 2.822 N/A GLU 222.A N SER 219.A O no hydrogen 2.942 N/A LYS 223.A N SER 219.A O no hydrogen 3.160 N/A ARG 226.A NE GLU 225.A O no hydrogen 2.542 N/A GLN 229.A NE2 CYS 233.A O no hydrogen 3.247 N/A CYS 233.A N PRO 230.A O no hydrogen 2.875 N/A THR 234.A N TYR 272.A O no hydrogen 3.118 N/A THR 234.A OG1 TYR 272.A O no hydrogen 2.704 N/A TYR 238.A N THR 234.A O no hydrogen 3.026 N/A TYR 238.A OH LEU 227.A O no hydrogen 2.666 N/A MET 239.A N ILE 235.A O no hydrogen 2.777 N/A ILE 240.A N ASP 236.A O no hydrogen 3.352 N/A ILE 240.A N VAL 237.A O no hydrogen 3.102 N/A MET 241.A N VAL 237.A O no hydrogen 3.208 N/A VAL 242.A N TYR 238.A O no hydrogen 2.876 N/A LYS 243.A N MET 239.A O no hydrogen 3.132 N/A CYS 244.A N ILE 240.A O no hydrogen 3.294 N/A CYS 244.A SG VAL 191.A O no hydrogen 3.807 N/A CYS 244.A SG ILE 240.A O no hydrogen 3.543 N/A TRP 245.A N VAL 242.A O no hydrogen 2.857 N/A MET 246.A N LYS 243.A O no hydrogen 3.408 N/A SER 251.A N ASP 248.A O no hydrogen 2.660 N/A SER 251.A OG ASP 248.A OD2 no hydrogen 3.184 N/A ARG 252.A N ALA 249.A O no hydrogen 3.196 N/A ARG 252.A NE GLN 188.A O no hydrogen 3.462 N/A ARG 252.A NH1 GLU 178.A OE2 no hydrogen 3.501 N/A ARG 252.A NH1 MET 246.A O no hydrogen 2.410 N/A ARG 252.A NH2 GLU 178.A OE1 no hydrogen 3.311 N/A ARG 252.A NH2 GLU 178.A OE2 no hydrogen 3.148 N/A ARG 252.A NH2 GLN 188.A O no hydrogen 3.277 N/A LYS 254.A N GLU 257.A OE2 no hydrogen 3.195 N/A LYS 254.A NZ GLN 188.A OE1 no hydrogen 3.034 N/A LEU 258.A N LYS 254.A O no hydrogen 2.896 N/A ILE 259.A N PHE 255.A O no hydrogen 2.995 N/A ILE 260.A N ARG 256.A O no hydrogen 3.302 N/A GLU 261.A N GLU 257.A O no hydrogen 2.897 N/A PHE 262.A N LEU 258.A O no hydrogen 3.025 N/A SER 263.A N ILE 259.A O no hydrogen 2.934 N/A LYS 264.A N ILE 260.A O no hydrogen 2.840 N/A MET 265.A N GLU 261.A O no hydrogen 3.056 N/A ALA 266.A N PHE 262.A O no hydrogen 2.770 N/A ALA 266.A N SER 263.A O no hydrogen 2.971 N/A ARG 267.A N LYS 264.A O no hydrogen 2.876 N/A ASP 268.A N MET 265.A O no hydrogen 3.295 N/A ARG 271.A N ASP 268.A O no hydrogen 3.138 N/A LEU 273.A N PRO 269.A O no hydrogen 3.182 N/A VAL 274.A N ILE 232.A O no hydrogen 2.815 N/A MET 281.A N GLU 279.A O no hydrogen 2.789 N/A VAL 293.A N MET 290.A O no hydrogen 3.378 N/A VAL 294.A N LYS 43.A O no hydrogen 3.025 N/A ASP 297.A N ASP 295.A OD2 no hydrogen 2.985 N/A GLU 298.A N ASP 295.A O no hydrogen 3.165 N/A TYR 299.A N ALA 296.A O no hydrogen 2.821 N/A TYR 299.A OH GLU 40.A OE1 no hydrogen 3.000 N/A TYR 299.A OH GLU 40.A OE2 no hydrogen 2.830 N/A