Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3dhe_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A NH1 GLN 28.A O no hydrogen 3.068 N/A ARG 2.A NH2 GLY 57.A O no hydrogen 3.314 N/A VAL 4.A N ASP 85.A OD2 no hydrogen 2.830 N/A VAL 5.A N LYS 31.A O no hydrogen 2.946 N/A LEU 6.A N VAL 86.A O no hydrogen 2.960 N/A ILE 7.A N TYR 33.A O no hydrogen 3.016 N/A THR 8.A N VAL 88.A O no hydrogen 3.321 N/A CYS 10.A N THR 35.A O no hydrogen 2.849 N/A CYS 10.A SG ILE 7.A O no hydrogen 3.843 N/A CYS 10.A SG GLY 15.A O no hydrogen 3.599 N/A HIS 17.A N GLY 13.A O no hydrogen 3.190 N/A HIS 17.A ND1 GLY 13.A O no hydrogen 3.297 N/A LEU 18.A N ILE 14.A O no hydrogen 2.785 N/A ALA 19.A N GLY 15.A O no hydrogen 3.025 N/A VAL 20.A N LEU 16.A O no hydrogen 3.278 N/A ARG 21.A N HIS 17.A O no hydrogen 2.995 N/A ARG 21.A NE GLU 238.A OE1 no hydrogen 2.818 N/A ARG 21.A NH1 ARG 21.A O no hydrogen 3.027 N/A ARG 21.A NH1 ASP 25.A OD1 no hydrogen 2.913 N/A ARG 21.A NH2 GLU 238.A OE1 no hydrogen 3.270 N/A ARG 21.A NH2 GLU 238.A OE2 no hydrogen 2.973 N/A LEU 22.A N LEU 18.A O no hydrogen 2.920 N/A ALA 23.A N ALA 19.A O no hydrogen 2.852 N/A SER 24.A N VAL 20.A O no hydrogen 2.795 N/A SER 24.A OG VAL 20.A O no hydrogen 3.128 N/A ASP 25.A N LEU 22.A O no hydrogen 2.940 N/A SER 27.A N ASP 25.A OD2 no hydrogen 3.153 N/A SER 27.A OG ASP 25.A OD2 no hydrogen 2.418 N/A SER 27.A OG SER 29.A OG no hydrogen 2.976 N/A GLN 28.A N ASP 25.A O no hydrogen 2.896 N/A SER 29.A N SER 27.A OG no hydrogen 3.206 N/A SER 29.A OG SER 27.A OG no hydrogen 2.976 N/A LYS 31.A N THR 3.A O no hydrogen 3.052 N/A VAL 32.A N SER 58.A O no hydrogen 2.840 N/A TYR 33.A N VAL 5.A O no hydrogen 2.927 N/A TYR 33.A OH GLU 81.A OE1 no hydrogen 2.630 N/A ALA 34.A N GLU 60.A O no hydrogen 2.827 N/A THR 35.A N ILE 7.A O no hydrogen 2.942 N/A LEU 36.A N LEU 62.A O no hydrogen 2.977 N/A ARG 37.A NH1 ASP 38.A OD1 no hydrogen 3.373 N/A THR 41.A N ASP 38.A O no hydrogen 3.385 N/A THR 41.A OG1 ASP 38.A O no hydrogen 2.950 N/A GLN 42.A N LEU 39.A O no hydrogen 2.743 N/A TRP 46.A N GLN 42.A O no hydrogen 3.105 N/A TRP 46.A NE1 GLN 42.A OE1 no hydrogen 3.073 N/A GLU 47.A N GLY 43.A O no hydrogen 2.834 N/A ALA 48.A N ARG 44.A O no hydrogen 2.941 N/A ALA 49.A N LEU 45.A O no hydrogen 2.889 N/A ARG 50.A N TRP 46.A O no hydrogen 3.011 N/A ALA 51.A N GLU 47.A O no hydrogen 3.160 N/A LEU 52.A N ALA 48.A O no hydrogen 3.275 N/A ALA 53.A N ARG 50.A O no hydrogen 2.904 N/A CYS 54.A N ALA 49.A O no hydrogen 2.920 N/A CYS 54.A SG VAL 20.A O no hydrogen 4.049 N/A CYS 54.A SG ALA 49.A O no hydrogen 3.593 N/A SER 58.A OG PRO 55.A O no hydrogen 2.687 N/A GLU 60.A N VAL 32.A O no hydrogen 2.881 N/A THR 61.A OG1 GLN 42.A OE1 no hydrogen 3.066 N/A LEU 62.A N ALA 34.A O no hydrogen 2.897 N/A LEU 64.A N LEU 36.A O no hydrogen 2.804 N/A ASP 65.A N SER 71.A OG no hydrogen 2.903 N/A ARG 67.A N ASP 65.A OD1 no hydrogen 3.332 N/A ASP 68.A N ASP 65.A O no hydrogen 2.851 N/A LYS 70.A N ASP 68.A OD1 no hydrogen 2.862 N/A VAL 72.A N ASP 68.A O no hydrogen 3.252 N/A ALA 73.A N SER 69.A O no hydrogen 3.076 N/A ALA 74.A N LYS 70.A O no hydrogen 3.043 N/A ALA 75.A N SER 71.A O no hydrogen 3.171 N/A ARG 76.A N VAL 72.A O no hydrogen 3.200 N/A ARG 76.A NH1 GLU 77.A OE2 no hydrogen 3.431 N/A GLU 77.A N ALA 73.A O no hydrogen 3.319 N/A ARG 78.A N ALA 75.A O no hydrogen 2.552 N/A ARG 78.A NE ALA 74.A O no hydrogen 2.611 N/A THR 80.A N ARG 78.A O no hydrogen 2.984 N/A GLU 81.A N GLU 81.A OE1 no hydrogen 2.727 N/A GLY 82.A N VAL 79.A O no hydrogen 2.637 N/A ARG 83.A NH1 ASP 85.A OD1 no hydrogen 3.054 N/A ASP 85.A N VAL 4.A O no hydrogen 2.802 N/A VAL 86.A N VAL 4.A O no hydrogen 3.158 N/A LEU 87.A N ARG 136.A O no hydrogen 2.831 N/A VAL 88.A N LEU 6.A O no hydrogen 2.985 N/A CYS 89.A N LEU 138.A O no hydrogen 2.598 N/A ASN 90.A N THR 8.A OG1 no hydrogen 2.899 N/A ASN 90.A ND2 THR 8.A O no hydrogen 2.623 N/A ALA 91.A N THR 8.A OG1 no hydrogen 2.845 N/A GLY 97.A N PHE 151.A O no hydrogen 3.148 N/A GLU 100.A N GLU 100.A OE1 no hydrogen 2.512 N/A ALA 101.A N PRO 98.A O no hydrogen 2.868 N/A LEU 102.A N LEU 99.A O no hydrogen 2.940 N/A VAL 107.A N GLY 103.A O no hydrogen 3.362 N/A ALA 108.A N GLU 104.A O no hydrogen 3.002 N/A SER 109.A N ASP 105.A O no hydrogen 2.780 N/A SER 109.A OG ASP 105.A O no hydrogen 3.041 N/A VAL 110.A N ALA 106.A O no hydrogen 3.031 N/A LEU 111.A N VAL 107.A O no hydrogen 3.352 N/A ASP 112.A N ALA 108.A O no hydrogen 2.916 N/A VAL 113.A N SER 109.A O no hydrogen 2.923 N/A ASN 114.A N VAL 110.A O no hydrogen 2.943 N/A ASN 114.A ND2 LEU 93.A O no hydrogen 3.024 N/A ASN 114.A ND2 SER 158.A OG no hydrogen 2.949 N/A VAL 115.A N LEU 111.A O no hydrogen 2.839 N/A VAL 116.A N LEU 111.A O no hydrogen 3.010 N/A VAL 119.A N VAL 115.A O no hydrogen 3.231 N/A ARG 120.A N VAL 116.A O no hydrogen 2.889 N/A ARG 120.A NH1 ASP 112.A O no hydrogen 3.510 N/A ARG 120.A NH2 ASP 112.A OD1 no hydrogen 3.522 N/A MET 121.A N GLY 117.A O no hydrogen 3.190 N/A LEU 122.A N THR 118.A O no hydrogen 3.033 N/A GLN 123.A N VAL 119.A O no hydrogen 2.848 N/A ALA 124.A N ARG 120.A O no hydrogen 3.193 N/A PHE 125.A N MET 121.A O no hydrogen 3.138 N/A LEU 126.A N LEU 122.A O no hydrogen 2.869 N/A LYS 130.A N LEU 126.A O no hydrogen 3.100 N/A LYS 130.A N PRO 127.A O no hydrogen 2.873 N/A ARG 131.A N PRO 127.A O no hydrogen 3.003 N/A ARG 132.A N ASP 128.A O no hydrogen 3.077 N/A ARG 132.A NH1 VAL 84.A O no hydrogen 3.009 N/A ARG 132.A NH2 VAL 84.A O no hydrogen 2.928 N/A GLY 133.A N MET 129.A O no hydrogen 3.051 N/A SER 134.A N MET 129.A O no hydrogen 3.257 N/A ARG 136.A N ASP 85.A O no hydrogen 3.007 N/A VAL 137.A N HIS 179.A O no hydrogen 2.857 N/A LEU 138.A N LEU 87.A O no hydrogen 2.647 N/A VAL 139.A N SER 181.A O no hydrogen 2.846 N/A THR 140.A N CYS 89.A O no hydrogen 3.169 N/A GLY 141.A N ILE 183.A O no hydrogen 2.720 N/A VAL 143.A N CYS 185.A O no hydrogen 3.088 N/A GLY 144.A N SER 142.A OG no hydrogen 2.667 N/A GLY 145.A N SER 142.A O no hydrogen 3.152 N/A LEU 146.A N VAL 143.A O no hydrogen 2.998 N/A MET 147.A N VAL 143.A O no hydrogen 3.159 N/A ASN 152.A N LEU 149.A O no hydrogen 2.971 N/A ASN 152.A ND2 PRO 150.A O no hydrogen 2.990 N/A ASN 152.A ND2 TYR 218.A OH no hydrogen 2.998 N/A CYS 156.A N ASN 152.A O no hydrogen 2.786 N/A CYS 156.A SG GLY 144.A O no hydrogen 3.407 N/A CYS 156.A SG ASN 152.A O no hydrogen 3.014 N/A ALA 157.A N ASP 153.A O no hydrogen 2.980 N/A SER 158.A N VAL 154.A O no hydrogen 3.003 N/A SER 158.A OG TYR 155.A O no hydrogen 2.790 N/A LYS 159.A N TYR 155.A O no hydrogen 3.057 N/A PHE 160.A N CYS 156.A O no hydrogen 2.724 N/A ALA 161.A N ALA 157.A O no hydrogen 2.911 N/A LEU 162.A N SER 158.A O no hydrogen 3.234 N/A GLU 163.A N LYS 159.A O no hydrogen 3.362 N/A GLY 164.A N PHE 160.A O no hydrogen 3.235 N/A LEU 165.A N ALA 161.A O no hydrogen 2.889 N/A CYS 166.A N LEU 162.A O no hydrogen 3.001 N/A CYS 166.A SG LEU 162.A O no hydrogen 3.263 N/A GLU 167.A N GLU 163.A O no hydrogen 2.903 N/A SER 168.A N GLY 164.A O no hydrogen 3.109 N/A SER 168.A OG GLY 164.A O no hydrogen 2.664 N/A LEU 169.A N LEU 165.A O no hydrogen 3.219 N/A ALA 170.A N CYS 166.A O no hydrogen 2.990 N/A LEU 172.A N LEU 169.A O no hydrogen 2.762 N/A LEU 173.A N LEU 169.A O no hydrogen 2.900 N/A LEU 174.A N ALA 170.A O no hydrogen 3.246 N/A PHE 176.A N LEU 173.A O no hydrogen 2.580 N/A HIS 179.A N GLY 135.A O no hydrogen 2.928 N/A SER 181.A N VAL 137.A O no hydrogen 2.997 N/A SER 181.A OG THR 250.A O no hydrogen 2.585 N/A LEU 182.A N LEU 251.A O no hydrogen 2.836 N/A ILE 183.A N VAL 139.A O no hydrogen 2.822 N/A GLU 184.A N TYR 253.A O no hydrogen 2.639 N/A CYS 185.A SG GLY 141.A O no hydrogen 4.012 N/A CYS 185.A SG ILE 183.A O no hydrogen 3.653 N/A HIS 189.A N GLN 231.A O no hydrogen 3.061 N/A THR 190.A OG1 VAL 188.A O no hydrogen 2.687 N/A MET 193.A N THR 190.A O no hydrogen 2.824 N/A LYS 195.A N PHE 192.A O no hydrogen 3.123 N/A LYS 195.A NZ GLU 194.A OE2 no hydrogen 3.167 N/A VAL 196.A N PHE 192.A O no hydrogen 3.091 N/A VAL 196.A N MET 193.A O no hydrogen 3.304 N/A LEU 204.A N PRO 200.A O no hydrogen 3.075 N/A ASP 205.A N GLU 201.A O no hydrogen 3.120 N/A ARG 206.A N VAL 203.A O no hydrogen 3.023 N/A THR 207.A OG1 GLU 100.A OE2 no hydrogen 3.136 N/A THR 207.A OG1 ASP 208.A OD1 no hydrogen 3.495 N/A THR 211.A N ASP 208.A OD2 no hydrogen 3.217 N/A THR 211.A OG1 ASP 208.A OD1 no hydrogen 2.899 N/A THR 211.A OG1 ASP 208.A OD2 no hydrogen 3.081 N/A PHE 212.A N ASP 208.A O no hydrogen 3.241 N/A HIS 213.A N ILE 209.A O no hydrogen 3.202 N/A ARG 214.A N HIS 210.A O no hydrogen 3.280 N/A PHE 215.A N THR 211.A O no hydrogen 2.859 N/A TYR 216.A N PHE 212.A O no hydrogen 3.071 N/A GLN 217.A N HIS 213.A O no hydrogen 3.253 N/A TYR 218.A N ARG 214.A O no hydrogen 2.852 N/A LEU 219.A N PHE 215.A O no hydrogen 2.787 N/A ALA 220.A N TYR 216.A O no hydrogen 2.920 N/A HIS 221.A N GLN 217.A O no hydrogen 3.103 N/A SER 222.A N TYR 218.A O no hydrogen 2.775 N/A SER 222.A OG LEU 219.A O no hydrogen 3.200 N/A LYS 223.A N LEU 219.A O no hydrogen 3.086 N/A GLN 224.A N HIS 221.A O no hydrogen 3.219 N/A VAL 225.A N HIS 221.A O no hydrogen 3.200 N/A PHE 226.A N SER 222.A O no hydrogen 2.787 N/A ARG 227.A N LYS 223.A O no hydrogen 3.214 N/A GLU 228.A N GLN 224.A O no hydrogen 3.192 N/A GLU 228.A N VAL 225.A O no hydrogen 3.081 N/A ALA 230.A N PHE 226.A O no hydrogen 3.047 N/A GLN 231.A N PRO 187.A O no hydrogen 3.479 N/A GLN 231.A NE2 THR 255.A O no hydrogen 3.278 N/A GLU 235.A N ASN 232.A O no hydrogen 2.836 N/A VAL 236.A N ASN 232.A O no hydrogen 3.138 N/A ALA 237.A N PRO 233.A O no hydrogen 2.595 N/A GLU 238.A N GLU 234.A O no hydrogen 3.202 N/A VAL 239.A N VAL 236.A O no hydrogen 2.882 N/A THR 242.A N GLU 238.A O no hydrogen 3.072 N/A THR 242.A OG1 GLU 238.A O no hydrogen 3.450 N/A ALA 243.A N VAL 239.A O no hydrogen 2.922 N/A LEU 244.A N PHE 240.A O no hydrogen 2.849 N/A ARG 245.A N LEU 241.A O no hydrogen 3.123 N/A ARG 245.A N THR 242.A O no hydrogen 3.258 N/A ALA 246.A N THR 242.A O no hydrogen 3.136 N/A THR 250.A N TYR 253.A OH no hydrogen 3.295 N/A THR 250.A OG1 ARG 252.A O no hydrogen 3.378 N/A ARG 252.A NE GLU 163.A OE1 no hydrogen 2.699 N/A ARG 252.A NE GLU 184.A OE2 no hydrogen 3.381 N/A ARG 252.A NH1 GLU 167.A OE1 no hydrogen 3.538 N/A ARG 252.A NH2 GLU 163.A OE1 no hydrogen 2.613 N/A ARG 252.A NH2 GLU 167.A OE1 no hydrogen 2.942 N/A TYR 253.A N LEU 182.A O no hydrogen 2.826 N/A THR 255.A N GLU 184.A O no hydrogen 3.171 N/A THR 255.A OG1 GLU 184.A O no hydrogen 3.559 N/A THR 255.A OG1 GLN 231.A OE1 no hydrogen 2.808 N/A ARG 258.A N THR 256.A OG1 no hydrogen 2.970 N/A ARG 258.A NH1 GLU 228.A O no hydrogen 3.181 N/A LEU 260.A N GLU 257.A O no hydrogen 3.177 N/A LEU 263.A N PHE 259.A O no hydrogen 3.236 N/A ARG 264.A N LEU 260.A O no hydrogen 3.028 N/A MET 265.A N PRO 261.A O no hydrogen 3.488 N/A ARG 266.A N LEU 263.A O no hydrogen 3.156 N/A LEU 267.A N ARG 264.A O no hydrogen 2.728 N/A SER 271.A N ASP 269.A OD1 no hydrogen 3.296 N/A SER 271.A OG ASP 269.A OD1 no hydrogen 2.727 N/A SER 271.A OG ASP 269.A OD2 no hydrogen 3.356 N/A SER 271.A OG SER 273.A OG no hydrogen 2.983 N/A GLY 272.A N ASP 269.A O no hydrogen 2.965 N/A SER 273.A OG ASP 269.A OD2 no hydrogen 3.385 N/A SER 273.A OG SER 271.A OG no hydrogen 2.983 N/A ASN 274.A N ASP 269.A OD2 no hydrogen 3.039 N/A TYR 275.A OH GLY 148.A O no hydrogen 2.372 N/A VAL 276.A N GLY 272.A O no hydrogen 3.161 N/A THR 277.A N SER 273.A O no hydrogen 3.073 N/A THR 277.A OG1 SER 273.A O no hydrogen 3.345 N/A THR 277.A OG1 ASN 274.A O no hydrogen 2.974 N/A ALA 278.A N ASN 274.A O no hydrogen 2.913 N/A MET 279.A N TYR 275.A O no hydrogen 2.772 N/A HIS 280.A N VAL 276.A O no hydrogen 3.221 N/A ARG 281.A N THR 277.A O no hydrogen 3.178 N/A ARG 281.A N ALA 278.A O no hydrogen 3.307 N/A GLU 282.A N ALA 278.A O no hydrogen 3.321 N/A PHE 284.A N ARG 281.A O no hydrogen 3.404 N/A