Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2qro_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 3.A N PRO 90.A O no hydrogen 3.378 N/A LYS 4.A N ASP 141.A OD2 no hydrogen 3.065 N/A LYS 4.A NZ SER 137.A O no hydrogen 2.660 N/A LYS 4.A NZ GLU 139.A O no hydrogen 2.805 N/A ILE 5.A N LEU 92.A O no hydrogen 3.103 N/A SER 6.A N GLY 142.A O no hydrogen 2.964 N/A SER 6.A OG GLU 8.A OE1 no hydrogen 3.045 N/A ILE 7.A N PHE 94.A O no hydrogen 2.764 N/A GLU 8.A N ILE 144.A O no hydrogen 2.938 N/A ASN 10.A ND2 LEU 173.A O no hydrogen 3.126 N/A ILE 11.A N ASN 10.A OD1 no hydrogen 2.676 N/A SER 16.A OG GLU 95.A OE1 no hydrogen 3.065 N/A SER 16.A OG GLU 95.A OE2 no hydrogen 3.221 N/A PHE 18.A N GLY 14.A O no hydrogen 2.853 N/A VAL 19.A N LYS 15.A O no hydrogen 2.628 N/A ASN 20.A N SER 16.A O no hydrogen 2.839 N/A ILE 21.A N PHE 18.A O no hydrogen 2.972 N/A LEU 22.A N PHE 18.A O no hydrogen 3.228 N/A LYS 23.A N VAL 19.A O no hydrogen 2.614 N/A GLU 30.A N VAL 91.A O no hydrogen 3.066 N/A VAL 32.A N PHE 93.A O no hydrogen 2.858 N/A VAL 36.A N GLU 34.A O no hydrogen 2.588 N/A ARG 38.A N PRO 35.A O no hydrogen 3.004 N/A TRP 39.A N PRO 35.A O no hydrogen 3.292 N/A TRP 39.A N VAL 36.A O no hydrogen 2.845 N/A TRP 39.A NE1 SER 71.A OG no hydrogen 2.661 N/A CYS 40.A N VAL 36.A O no hydrogen 3.145 N/A CYS 40.A N ALA 37.A O no hydrogen 3.265 N/A CYS 40.A SG VAL 36.A O no hydrogen 3.828 N/A CYS 40.A SG ASN 48.A OD1 no hydrogen 3.239 N/A ASN 41.A N ARG 38.A O no hydrogen 3.233 N/A VAL 42.A N GLY 47.A O no hydrogen 2.952 N/A LEU 50.A N TRP 39.A O no hydrogen 3.199 N/A MET 52.A N ASN 48.A O no hydrogen 3.218 N/A MET 53.A N VAL 49.A O no hydrogen 3.221 N/A TYR 54.A N LEU 50.A O no hydrogen 3.321 N/A GLU 55.A N GLN 51.A O no hydrogen 2.859 N/A LYS 56.A N MET 52.A O no hydrogen 2.972 N/A GLU 58.A N GLU 58.A OE1 no hydrogen 2.439 N/A ARG 59.A N LYS 56.A O no hydrogen 3.006 N/A ARG 59.A NH1 ARG 59.A O no hydrogen 3.224 N/A TRP 60.A N LYS 56.A O no hydrogen 3.064 N/A SER 61.A N PRO 57.A O no hydrogen 3.106 N/A SER 61.A OG PRO 57.A O no hydrogen 2.529 N/A PHE 64.A N TRP 60.A O no hydrogen 2.793 N/A GLN 65.A N SER 61.A O no hydrogen 2.757 N/A THR 66.A N PHE 62.A O no hydrogen 2.888 N/A THR 66.A OG1 PHE 62.A O no hydrogen 2.534 N/A TYR 67.A N THR 63.A O no hydrogen 2.953 N/A ALA 68.A N PHE 64.A O no hydrogen 2.661 N/A CYS 69.A N GLN 65.A O no hydrogen 3.336 N/A CYS 69.A SG ASP 101.A OD2 no hydrogen 3.902 N/A LEU 70.A N THR 66.A O no hydrogen 3.092 N/A SER 71.A N TYR 67.A O no hydrogen 2.928 N/A SER 71.A OG TYR 67.A O no hydrogen 3.056 N/A SER 71.A OG ALA 68.A O no hydrogen 2.655 N/A ARG 72.A N ALA 68.A O no hydrogen 3.295 N/A ARG 72.A N CYS 69.A O no hydrogen 3.158 N/A ARG 72.A NE ASP 101.A OD2 no hydrogen 2.329 N/A ARG 72.A NH2 GLU 34.A OE1 no hydrogen 2.815 N/A ARG 72.A NH2 ASP 101.A OD1 no hydrogen 2.929 N/A ILE 73.A N CYS 69.A O no hydrogen 2.948 N/A ARG 74.A N LEU 70.A O no hydrogen 2.922 N/A ALA 75.A N SER 71.A O no hydrogen 3.109 N/A GLN 76.A N ARG 72.A O no hydrogen 2.822 N/A GLN 76.A NE2 ARG 96.A O no hydrogen 3.343 N/A LEU 77.A N ILE 73.A O no hydrogen 2.884 N/A ALA 78.A N ARG 74.A O no hydrogen 2.747 N/A SER 79.A N ALA 75.A O no hydrogen 3.195 N/A SER 79.A OG ALA 75.A O no hydrogen 3.565 N/A LEU 80.A N GLN 76.A O no hydrogen 3.134 N/A LEU 80.A N LEU 77.A O no hydrogen 3.147 N/A ASN 81.A N ALA 78.A O no hydrogen 2.942 N/A GLY 82.A N SER 79.A O no hydrogen 3.071 N/A LYS 85.A N GLY 82.A O no hydrogen 2.900 N/A LYS 85.A NZ ASN 81.A O no hydrogen 3.529 N/A LYS 85.A NZ GLY 82.A O no hydrogen 3.495 N/A ASP 86.A N LYS 83.A O no hydrogen 3.315 N/A VAL 91.A N ASP 28.A O no hydrogen 2.804 N/A LEU 92.A N LYS 3.A O no hydrogen 2.863 N/A PHE 93.A N GLU 30.A O no hydrogen 3.022 N/A PHE 94.A N ILE 5.A O no hydrogen 2.859 N/A GLU 95.A N VAL 32.A O no hydrogen 3.309 N/A ARG 96.A N ILE 7.A O no hydrogen 3.260 N/A SER 97.A N GLU 8.A OE1 no hydrogen 2.983 N/A SER 97.A OG GLU 8.A OE1 no hydrogen 2.806 N/A TYR 99.A OH TYR 195.A OH no hydrogen 2.885 N/A SER 100.A OG GLU 8.A OE1 no hydrogen 3.433 N/A SER 100.A OG GLU 8.A OE2 no hydrogen 3.166 N/A SER 100.A OG SER 97.A O no hydrogen 2.972 N/A ASP 101.A N SER 97.A O no hydrogen 3.164 N/A ARG 102.A N VAL 98.A O no hydrogen 3.386 N/A ARG 102.A NH1 HIS 127.A ND1 no hydrogen 3.365 N/A ARG 102.A NH1 ASP 128.A OD1 no hydrogen 3.037 N/A TYR 103.A N TYR 99.A O no hydrogen 2.810 N/A ILE 104.A N SER 100.A O no hydrogen 2.971 N/A PHE 105.A N SER 100.A O no hydrogen 3.228 N/A ALA 106.A N ASP 101.A O no hydrogen 2.845 N/A SER 107.A N ARG 102.A O no hydrogen 2.837 N/A ASN 108.A N ILE 104.A O no hydrogen 3.186 N/A LEU 109.A N PHE 105.A O no hydrogen 2.783 N/A TYR 110.A N ALA 106.A O no hydrogen 2.918 N/A TYR 110.A OH GLU 117.A OE1 no hydrogen 3.273 N/A TYR 110.A OH GLU 117.A OE2 no hydrogen 2.954 N/A GLU 111.A N SER 107.A O no hydrogen 3.007 N/A SER 112.A N ASN 108.A O no hydrogen 2.890 N/A SER 112.A OG ASN 108.A O no hydrogen 2.692 N/A GLU 113.A N TYR 110.A O no hydrogen 2.844 N/A CYS 114.A N LEU 109.A O no hydrogen 2.882 N/A CYS 114.A SG SER 112.A O no hydrogen 3.707 N/A ASN 116.A N GLU 119.A OE1 no hydrogen 3.179 N/A ASN 116.A ND2 THR 118.A OG1 no hydrogen 3.141 N/A GLU 119.A N ASN 116.A OD1 no hydrogen 3.077 N/A TRP 120.A N ASN 116.A O no hydrogen 3.088 N/A THR 121.A N GLU 117.A O no hydrogen 2.783 N/A THR 121.A OG1 GLU 117.A O no hydrogen 2.828 N/A ILE 122.A N THR 118.A O no hydrogen 2.865 N/A TYR 123.A N GLU 119.A O no hydrogen 2.760 N/A GLN 124.A N TRP 120.A O no hydrogen 3.044 N/A ASP 125.A N THR 121.A O no hydrogen 2.955 N/A TRP 126.A N ILE 122.A O no hydrogen 2.903 N/A HIS 127.A N TYR 123.A O no hydrogen 2.917 N/A HIS 127.A NE2 VAL 98.A O no hydrogen 2.914 N/A ASP 128.A N GLN 124.A O no hydrogen 2.725 N/A TRP 129.A N ASP 125.A O no hydrogen 3.162 N/A MET 130.A N TRP 126.A O no hydrogen 2.810 N/A ASN 131.A N HIS 127.A O no hydrogen 3.236 N/A ASN 132.A N TRP 129.A O no hydrogen 3.099 N/A GLN 133.A N MET 130.A O no hydrogen 3.342 N/A PHE 134.A N MET 130.A O no hydrogen 3.332 N/A LEU 138.A N GLY 135.A O no hydrogen 2.710 N/A GLU 139.A N GLN 136.A O no hydrogen 3.414 N/A LEU 140.A N TYR 195.A OH no hydrogen 2.753 N/A ASP 141.A N LYS 4.A O no hydrogen 2.870 N/A ILE 143.A N PRO 200.A O no hydrogen 3.080 N/A ILE 144.A N SER 6.A O no hydrogen 2.683 N/A TYR 145.A N LEU 202.A O no hydrogen 2.792 N/A TYR 145.A OH GLU 181.A OE2 no hydrogen 2.883 N/A LEU 146.A N GLU 8.A O no hydrogen 2.803 N/A GLN 147.A N LEU 204.A O no hydrogen 2.966 N/A GLN 147.A NE2 GLU 181.A OE2 no hydrogen 2.827 N/A THR 149.A N ASN 207.A OD1 no hydrogen 3.095 N/A THR 149.A OG1 THR 152.A OG1 no hydrogen 2.873 N/A THR 149.A OG1 ASN 207.A OD1 no hydrogen 3.272 N/A THR 152.A N THR 149.A OG1 no hydrogen 2.859 N/A THR 152.A OG1 THR 149.A OG1 no hydrogen 2.873 N/A THR 152.A OG1 ASN 207.A OD1 no hydrogen 2.508 N/A CYS 153.A N THR 149.A O no hydrogen 3.054 N/A CYS 153.A SG ALA 148.A O no hydrogen 4.001 N/A CYS 153.A SG THR 149.A O no hydrogen 3.606 N/A LEU 154.A N PRO 150.A O no hydrogen 2.847 N/A HIS 155.A N GLU 151.A O no hydrogen 2.868 N/A ARG 156.A N THR 152.A O no hydrogen 2.779 N/A ARG 156.A NH1 ALA 13.A O no hydrogen 2.696 N/A ARG 156.A NH1 VAL 206.A O no hydrogen 3.085 N/A ARG 156.A NH2 VAL 206.A O no hydrogen 3.059 N/A ILE 157.A N CYS 153.A O no hydrogen 2.718 N/A TYR 158.A N HIS 155.A O no hydrogen 2.812 N/A LEU 159.A N HIS 155.A O no hydrogen 3.036 N/A ARG 160.A N ARG 156.A O no hydrogen 2.873 N/A ARG 160.A NH1 GLU 165.A OE1 no hydrogen 2.365 N/A GLY 161.A N ILE 157.A O no hydrogen 3.212 N/A ARG 162.A NH1 GLU 165.A OE2 no hydrogen 3.424 N/A GLU 165.A N ARG 162.A O no hydrogen 3.143 N/A GLN 166.A NE2 ILE 157.A O no hydrogen 3.156 N/A GLN 166.A NE2 ARG 162.A O no hydrogen 3.209 N/A LEU 173.A N PRO 169.A O no hydrogen 3.381 N/A GLU 174.A N LEU 170.A O no hydrogen 2.708 N/A LYS 175.A N GLU 171.A O no hydrogen 2.924 N/A LEU 176.A N TYR 172.A O no hydrogen 3.105 N/A HIS 177.A N LEU 173.A O no hydrogen 2.978 N/A TYR 178.A N GLU 174.A O no hydrogen 3.068 N/A LYS 179.A N LYS 175.A O no hydrogen 3.274 N/A LYS 179.A NZ SER 107.A OG no hydrogen 3.237 N/A LYS 179.A NZ GLU 111.A OE1 no hydrogen 3.403 N/A LYS 179.A NZ GLU 111.A OE2 no hydrogen 3.291 N/A HIS 180.A N LEU 176.A O no hydrogen 3.151 N/A HIS 180.A N HIS 177.A O no hydrogen 2.850 N/A HIS 180.A ND1 LEU 176.A O no hydrogen 2.804 N/A GLU 181.A N HIS 177.A O no hydrogen 2.924 N/A SER 182.A N TYR 178.A O no hydrogen 2.702 N/A SER 182.A OG THR 188.A OG1 no hydrogen 3.103 N/A TRP 183.A N LYS 179.A O no hydrogen 3.279 N/A LEU 184.A N HIS 180.A O no hydrogen 2.835 N/A LEU 185.A N GLU 181.A O no hydrogen 2.946 N/A HIS 186.A N GLU 181.A O no hydrogen 2.825 N/A ARG 187.A NH1 VAL 199.A O no hydrogen 3.459 N/A THR 188.A N SER 182.A O no hydrogen 2.893 N/A THR 188.A OG1 SER 182.A O no hydrogen 3.499 N/A THR 188.A OG1 SER 182.A OG no hydrogen 3.103 N/A LEU 189.A N SER 182.A O no hydrogen 3.141 N/A PHE 193.A N THR 191.A OG1 no hydrogen 3.122 N/A TYR 195.A OH TYR 99.A OH no hydrogen 2.885 N/A LEU 196.A N PHE 193.A O no hydrogen 2.745 N/A GLN 197.A N ASP 194.A O no hydrogen 3.258 N/A GLU 198.A N TYR 195.A O no hydrogen 3.179 N/A LEU 202.A N ILE 143.A O no hydrogen 2.992 N/A LEU 204.A N TYR 145.A O no hydrogen 3.006 N/A VAL 206.A N GLN 147.A O no hydrogen 3.095 N/A ASN 207.A N ASP 205.A OD2 no hydrogen 2.909 N/A ASN 207.A ND2 ASP 205.A OD2 no hydrogen 3.340 N/A LYS 211.A NZ ASP 212.A OD2 no hydrogen 2.500 N/A VAL 218.A N TYR 214.A O no hydrogen 3.100 N/A GLU 219.A N GLU 215.A O no hydrogen 3.226 N/A LYS 220.A N SER 216.A O no hydrogen 3.256 N/A VAL 221.A N LEU 217.A O no hydrogen 3.179 N/A VAL 221.A N VAL 218.A O no hydrogen 2.907 N/A LYS 222.A N VAL 218.A O no hydrogen 3.031 N/A GLU 223.A N GLU 219.A O no hydrogen 2.864 N/A PHE 224.A N LYS 220.A O no hydrogen 2.959 N/A LEU 225.A N VAL 221.A O no hydrogen 2.732 N/A SER 226.A N LYS 222.A O no hydrogen 3.037 N/A SER 226.A N GLU 223.A O no hydrogen 3.088 N/A SER 226.A OG LYS 222.A O no hydrogen 2.758 N/A THR 227.A N GLU 223.A O no hydrogen 3.480 N/A THR 227.A OG1 PHE 224.A O no hydrogen 2.558 N/A LEU 228.A N LEU 225.A O no hydrogen 3.265 N/A