Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ic8_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 4.A N GLN 54.A O no hydrogen 2.733 N/A LEU 5.A N ARG 28.A O no hydrogen 2.941 N/A HIS 6.A N VAL 52.A O no hydrogen 2.977 N/A HIS 6.A NE2 GLN 54.A OE1 no hydrogen 2.848 N/A HIS 7.A N VAL 30.A O no hydrogen 3.086 N/A SER 11.A N TYR 8.A O no hydrogen 3.117 N/A PHE 13.A N SER 11.A OG no hydrogen 3.147 N/A ALA 14.A N SER 11.A O no hydrogen 3.186 N/A GLU 15.A N LEU 12.A O no hydrogen 3.372 N/A LYS 16.A NZ ASP 95.A OD1 no hydrogen 3.216 N/A LYS 16.A NZ ASP 95.A OD2 no hydrogen 3.084 N/A ARG 18.A NE GLU 15.A OE2 no hydrogen 3.349 N/A ARG 18.A NH1 TYR 8.A O no hydrogen 3.287 N/A ARG 18.A NH2 SER 11.A O no hydrogen 2.925 N/A ARG 18.A NH2 GLU 15.A OE2 no hydrogen 3.001 N/A LEU 19.A N GLU 15.A O no hydrogen 3.109 N/A GLY 21.A N ARG 18.A O no hydrogen 3.079 N/A PHE 22.A N LEU 19.A O no hydrogen 2.948 N/A LYS 23.A NZ GLU 70.A OE2 no hydrogen 3.152 N/A LYS 23.A NZ LYS 73.A O no hydrogen 2.763 N/A LYS 23.A NZ PRO 76.A O no hydrogen 2.726 N/A GLY 24.A N GLY 21.A O no hydrogen 3.172 N/A TRP 27.A N SER 185.A O no hydrogen 2.966 N/A TRP 27.A NE1 HIS 183.A O no hydrogen 3.003 N/A ARG 28.A N LEU 3.A O no hydrogen 2.889 N/A ARG 28.A NE SER 187.A O no hydrogen 3.282 N/A ARG 28.A NH1 GLU 2.A OE2 no hydrogen 2.925 N/A ARG 28.A NH2 ASP 188.A O no hydrogen 3.003 N/A SER 29.A N SER 187.A O no hydrogen 2.917 N/A VAL 30.A N LEU 5.A O no hydrogen 2.840 N/A ILE 32.A N HIS 7.A O no hydrogen 3.165 N/A LYS 37.A NZ PRO 33.A O no hydrogen 2.717 N/A THR 41.A N LYS 37.A O no hydrogen 2.918 N/A THR 41.A OG1 LYS 37.A O no hydrogen 3.188 N/A THR 41.A OG1 PRO 38.A O no hydrogen 3.286 N/A ALA 42.A N PRO 38.A O no hydrogen 2.911 N/A LEU 43.A N LEU 40.A O no hydrogen 3.046 N/A THR 44.A N LEU 40.A O no hydrogen 3.016 N/A THR 44.A OG1 LEU 40.A O no hydrogen 3.305 N/A THR 44.A OG1 TYR 47.A O no hydrogen 2.848 N/A GLY 45.A N THR 41.A O no hydrogen 2.920 N/A GLY 46.A N THR 44.A OG1 no hydrogen 3.081 N/A ARG 48.A N GLU 233.A OE1 no hydrogen 2.825 N/A VAL 52.A N HIS 6.A O no hydrogen 3.105 N/A LEU 53.A N TYR 60.A O no hydrogen 3.046 N/A GLN 54.A N ILE 4.A O no hydrogen 2.756 N/A GLN 54.A NE2 GLY 56.A O no hydrogen 3.025 N/A GLN 54.A NE2 ALA 194.A O no hydrogen 3.107 N/A ILE 55.A N ASP 58.A O no hydrogen 3.016 N/A ASP 58.A N ILE 55.A O no hydrogen 2.996 N/A ILE 59.A N HIS 259.A O no hydrogen 2.946 N/A TYR 60.A N LEU 53.A O no hydrogen 2.765 N/A CYS 61.A N HIS 261.A O no hydrogen 3.279 N/A ALA 64.A N ASP 62.A OD2 no hydrogen 3.171 N/A ARG 68.A N LEU 65.A O no hydrogen 3.165 N/A ARG 68.A NE TYR 60.A OH no hydrogen 3.171 N/A ARG 68.A NH1 ARG 68.A O no hydrogen 2.934 N/A ARG 68.A NH1 GLU 72.A OE2 no hydrogen 3.079 N/A ARG 68.A NH2 GLU 72.A OE2 no hydrogen 3.359 N/A GLU 70.A N ALA 66.A O no hydrogen 2.994 N/A GLN 71.A N ARG 67.A O no hydrogen 3.187 N/A GLU 72.A N ARG 68.A O no hydrogen 3.064 N/A LYS 73.A N LEU 69.A O no hydrogen 2.803 N/A LYS 73.A NZ SER 75.A O no hydrogen 3.520 N/A PHE 78.A N GLU 70.A OE2 no hydrogen 2.876 N/A TYR 79.A N GLU 70.A OE1 no hydrogen 3.250 N/A GLY 82.A N GLU 84.A OE1 no hydrogen 2.693 N/A GLN 83.A N PRO 80.A O no hydrogen 3.043 N/A GLN 83.A NE2 PHE 138.A O no hydrogen 3.658 N/A GLU 84.A N GLU 84.A OE1 no hydrogen 2.772 N/A VAL 87.A N GLN 83.A O no hydrogen 3.116 N/A ALA 88.A N GLU 84.A O no hydrogen 3.195 N/A GLY 89.A N PHE 85.A O no hydrogen 3.087 N/A LEU 90.A N ALA 86.A O no hydrogen 3.058 N/A ALA 91.A N VAL 87.A O no hydrogen 3.015 N/A ALA 92.A N ALA 88.A O no hydrogen 2.960 N/A TRP 93.A N GLY 89.A O no hydrogen 3.010 N/A ALA 94.A N LEU 90.A O no hydrogen 2.957 N/A ASP 95.A N ALA 91.A O no hydrogen 2.907 N/A SER 96.A N ALA 92.A O no hydrogen 3.223 N/A SER 96.A OG ALA 92.A O no hydrogen 2.911 N/A SER 96.A OG TRP 93.A O no hydrogen 3.345 N/A LEU 98.A N TRP 93.A O no hydrogen 3.476 N/A PHE 99.A N ALA 94.A O no hydrogen 2.956 N/A LEU 100.A N SER 96.A O no hydrogen 3.089 N/A HIS 101.A N VAL 97.A O no hydrogen 3.309 N/A ALA 102.A N LEU 98.A O no hydrogen 3.103 N/A VAL 103.A N PHE 99.A O no hydrogen 3.147 N/A SER 104.A N LEU 100.A O no hydrogen 3.215 N/A SER 104.A OG LEU 100.A O no hydrogen 3.087 N/A LEU 105.A N HIS 101.A O no hydrogen 3.208 N/A VAL 106.A N ALA 102.A O no hydrogen 3.332 N/A PHE 107.A N VAL 103.A O no hydrogen 3.142 N/A GLN 108.A NE2 SER 104.A O no hydrogen 3.558 N/A GLN 108.A NE2 LEU 105.A O no hydrogen 3.149 N/A SER 111.A N GLN 108.A O no hydrogen 3.111 N/A SER 111.A OG VAL 106.A O no hydrogen 2.776 N/A SER 111.A OG GLN 108.A O no hydrogen 3.337 N/A VAL 116.A N PRO 112.A O no hydrogen 3.195 N/A LYS 117.A N VAL 113.A O no hydrogen 2.899 N/A HIS 118.A N GLU 114.A O no hydrogen 3.069 N/A GLN 119.A N GLN 115.A O no hydrogen 2.899 N/A TRP 120.A N VAL 116.A O no hydrogen 3.031 N/A TRP 120.A NE1 PHE 164.A O no hydrogen 3.389 N/A THR 122.A N GLN 119.A O no hydrogen 3.116 N/A SER 124.A OG PRO 121.A O no hydrogen 3.007 N/A SER 124.A OG THR 122.A O no hydrogen 3.254 N/A ARG 125.A N THR 122.A O no hydrogen 3.390 N/A LEU 126.A N PHE 123.A O no hydrogen 3.188 N/A SER 128.A N SER 124.A O no hydrogen 2.848 N/A SER 128.A OG SER 124.A O no hydrogen 3.446 N/A GLN 129.A N ARG 125.A O no hydrogen 3.139 N/A LEU 130.A N LEU 126.A O no hydrogen 3.149 N/A SER 131.A N GLU 127.A O no hydrogen 3.183 N/A SER 131.A OG SER 128.A O no hydrogen 3.137 N/A GLY 133.A N LEU 130.A O no hydrogen 2.814 N/A LEU 137.A N ASP 145.A OD1 no hydrogen 3.083 N/A GLY 139.A N PHE 136.A O no hydrogen 3.376 N/A SER 142.A N ASP 145.A OD2 no hydrogen 2.738 N/A SER 142.A OG ASP 145.A OD2 no hydrogen 3.373 N/A ILE 143.A N PHE 78.A O no hydrogen 3.130 N/A ASP 145.A N SER 142.A O no hydrogen 3.080 N/A SER 147.A N ILE 143.A O no hydrogen 3.060 N/A SER 147.A OG ALA 91.A O no hydrogen 3.212 N/A SER 147.A OG ASP 95.A OD1 no hydrogen 1.990 N/A VAL 148.A N ALA 144.A O no hydrogen 3.013 N/A ALA 149.A N ASP 145.A O no hydrogen 2.764 N/A HIS 150.A N PHE 146.A O no hydrogen 2.816 N/A THR 151.A OG1 VAL 148.A O no hydrogen 3.204 N/A TRP 153.A N ALA 149.A O no hydrogen 3.140 N/A TRP 153.A N HIS 150.A O no hydrogen 3.238 N/A PHE 154.A N THR 151.A O no hydrogen 3.307 N/A LYS 156.A N LEU 152.A O no hydrogen 3.182 N/A LYS 156.A NZ ASP 166.A OD1 no hydrogen 3.163 N/A GLN 157.A N PHE 154.A O no hydrogen 3.332 N/A THR 158.A N LEU 155.A O no hydrogen 3.502 N/A THR 161.A OG1 LEU 155.A O no hydrogen 2.467 N/A THR 161.A OG1 THR 158.A O no hydrogen 3.488 N/A ALA 162.A N THR 158.A O no hydrogen 2.961 N/A PHE 164.A N THR 161.A O no hydrogen 3.143 N/A VAL 165.A N ALA 162.A O no hydrogen 2.962 N/A ASP 166.A N ALA 162.A O no hydrogen 2.730 N/A ASP 167.A N PRO 163.A O no hydrogen 3.203 N/A TYR 168.A N VAL 165.A O no hydrogen 3.080 N/A SER 170.A N GLU 127.A OE2 no hydrogen 3.441 N/A SER 170.A OG GLU 127.A OE2 no hydrogen 3.356 N/A VAL 171.A N GLU 127.A OE1 no hydrogen 3.337 N/A SER 172.A N TYR 168.A O no hydrogen 3.280 N/A SER 172.A OG ASP 166.A OD1 no hydrogen 3.268 N/A VAL 173.A N PRO 169.A O no hydrogen 3.273 N/A TRP 174.A N SER 170.A O no hydrogen 3.256 N/A TRP 174.A NE1 ASP 145.A OD1 no hydrogen 3.240 N/A LEU 175.A N VAL 171.A O no hydrogen 2.798 N/A ASP 176.A N SER 172.A O no hydrogen 3.211 N/A ARG 177.A N VAL 173.A O no hydrogen 3.262 N/A VAL 178.A N TRP 174.A O no hydrogen 3.103 N/A LEU 179.A N LEU 175.A O no hydrogen 3.052 N/A GLY 180.A N ARG 177.A O no hydrogen 3.273 N/A GLY 182.A N LEU 179.A O no hydrogen 3.229 N/A HIS 183.A NE2 GLU 15.A OE1 no hydrogen 2.801 N/A SER 187.A N TRP 27.A O no hydrogen 3.226 N/A LEU 189.A N SER 29.A O no hydrogen 2.864 N/A SER 191.A OG ASP 39.A OD2 no hydrogen 2.492 N/A ALA 193.A N SER 190.A OG no hydrogen 3.021 N/A ALA 194.A N SER 190.A O no hydrogen 3.188 N/A ILE 195.A N SER 191.A O no hydrogen 3.208 N/A GLU 196.A N ALA 192.A O no hydrogen 3.176 N/A ILE 197.A N ALA 193.A O no hydrogen 3.047 N/A ALA 198.A N ALA 194.A O no hydrogen 3.263 N/A SER 199.A N ILE 195.A O no hydrogen 3.026 N/A ASN 200.A N GLU 196.A O no hydrogen 2.951 N/A ALA 201.A N ILE 197.A O no hydrogen 3.012 N/A ALA 204.A N ASP 58.A OD2 no hydrogen 2.956 N/A ASN 215.A N ASP 213.A OD1 no hydrogen 2.420 N/A GLY 216.A N ASP 213.A O no hydrogen 3.321 N/A LYS 218.A N ASP 221.A OD2 no hydrogen 2.209 N/A GLY 220.A N LEU 239.A O no hydrogen 2.923 N/A ASP 221.A N LYS 218.A O no hydrogen 3.095 N/A VAL 223.A N GLY 237.A O no hydrogen 3.017 N/A ALA 224.A N GLU 270.A O no hydrogen 2.997 N/A ILE 225.A N VAL 235.A O no hydrogen 2.827 N/A ALA 226.A N ARG 268.A O no hydrogen 3.155 N/A VAL 228.A N GLY 266.A O no hydrogen 2.899 N/A TYR 230.A N ALA 227.A O no hydrogen 3.242 N/A VAL 235.A N ILE 225.A O no hydrogen 2.694 N/A GLY 237.A N VAL 223.A O no hydrogen 2.995 N/A GLU 238.A N ARG 249.A O no hydrogen 2.917 N/A LEU 239.A N ASP 221.A O no hydrogen 3.172 N/A THR 241.A OG1 ASP 213.A OD2 no hydrogen 2.965 N/A GLY 242.A N GLU 245.A O no hydrogen 2.746 N/A ARG 243.A N GLU 209.A OE1 no hydrogen 3.217 N/A ARG 243.A NH1 GLU 209.A OE1 no hydrogen 2.092 N/A ARG 243.A NH1 THR 210.A O no hydrogen 3.433 N/A LEU 246.A N PHE 262.A O no hydrogen 2.732 N/A ILE 247.A N PHE 240.A O no hydrogen 2.878 N/A LEU 248.A N VAL 260.A O no hydrogen 2.892 N/A ARG 249.A N GLU 238.A O no hydrogen 2.865 N/A ARG 250.A N VAL 258.A O no hydrogen 2.980 N/A ARG 250.A NH1 ALA 42.A O no hydrogen 3.037 N/A ARG 250.A NH2 ALA 42.A O no hydrogen 3.472 N/A ARG 250.A NH2 ASP 252.A OD1 no hydrogen 3.130 N/A ASP 252.A N GLY 256.A O no hydrogen 2.749 N/A ARG 254.A NH1 ASP 39.A OD1 no hydrogen 3.372 N/A ARG 254.A NH2 ASP 39.A OD1 no hydrogen 2.839 N/A ALA 255.A N ASP 252.A OD2 no hydrogen 3.105 N/A GLY 256.A N ASP 252.A O no hydrogen 2.878 N/A VAL 258.A N ARG 250.A O no hydrogen 2.880 N/A HIS 259.A N ALA 57.A O no hydrogen 2.940 N/A VAL 260.A N LEU 248.A O no hydrogen 2.724 N/A HIS 261.A N ILE 59.A O no hydrogen 2.858 N/A HIS 261.A ND1 GLU 245.A OE2 no hydrogen 2.793 N/A HIS 261.A NE2 ASP 58.A OD1 no hydrogen 2.774 N/A PHE 262.A N LEU 246.A O no hydrogen 2.908 N/A ARG 264.A NE GLY 242.A O no hydrogen 3.017 N/A ARG 264.A NH2 ASP 213.A OD2 no hydrogen 2.657 N/A PHE 267.A N ARG 264.A O no hydrogen 3.453 N/A ARG 268.A N ALA 226.A O no hydrogen 2.790 N/A GLU 270.A N ALA 224.A O no hydrogen 3.062 N/A ARG 272.A N LYS 222.A O no hydrogen 2.534 N/A