Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3otc_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 7.A N GLU 4.A O no hydrogen 3.205 N/A ASP 8.A N TYR 5.A O no hydrogen 3.321 N/A PHE 9.A N VAL 6.A O no hydrogen 3.487 N/A GLU 10.A N ARG 7.A O no hydrogen 3.257 N/A THR 14.A OG1 ASP 12.A OD1 no hydrogen 3.042 N/A THR 14.A OG1 ASP 12.A OD2 no hydrogen 3.198 N/A CYS 15.A N ARG 88.A O no hydrogen 2.833 N/A CYS 15.A SG ARG 88.A O no hydrogen 3.573 N/A CYS 19.A SG LEU 16.A O no hydrogen 3.419 N/A CYS 19.A SG ALA 17.A O no hydrogen 3.375 N/A TRP 20.A N TYR 131.A O no hydrogen 2.722 N/A TRP 20.A NE1 ASN 134.A OD1 no hydrogen 2.732 N/A VAL 22.A N VAL 129.A O no hydrogen 2.951 N/A VAL 23.A N PHE 77.A O no hydrogen 2.979 N/A ARG 24.A N ARG 127.A O no hydrogen 3.075 N/A ARG 24.A NE ASP 26.A OD2 no hydrogen 3.189 N/A ARG 24.A NH1 TYR 140.A OH no hydrogen 2.980 N/A LEU 25.A N TYR 75.A O no hydrogen 2.973 N/A ASP 26.A N ASP 125.A O no hydrogen 2.781 N/A GLY 27.A N ASP 73.A O no hydrogen 2.952 N/A ARG 28.A N GLY 123.A O no hydrogen 2.977 N/A PHE 33.A N ASN 29.A O no hydrogen 3.304 N/A ALA 34.A N PHE 30.A O no hydrogen 2.828 N/A GLU 35.A N HIS 31.A O no hydrogen 3.326 N/A LYS 36.A N ARG 32.A O no hydrogen 2.994 N/A HIS 37.A N PHE 33.A O no hydrogen 3.219 N/A HIS 37.A ND1 PHE 33.A O no hydrogen 2.993 N/A ASN 38.A N GLU 35.A O no hydrogen 3.110 N/A PHE 39.A N ALA 34.A O no hydrogen 2.963 N/A ALA 40.A N ASP 44.A OD2 no hydrogen 2.845 N/A ASN 43.A ND2 ASN 152.A OD1 no hydrogen 2.739 N/A ARG 46.A NE ASP 44.A OD1 no hydrogen 3.224 N/A ARG 46.A NE ASP 44.A OD2 no hydrogen 3.433 N/A ARG 46.A NH2 ASN 38.A O no hydrogen 3.091 N/A ARG 46.A NH2 ASP 44.A OD2 no hydrogen 2.963 N/A ALA 47.A N ASP 44.A OD1 no hydrogen 3.175 N/A LEU 48.A N ASP 44.A O no hydrogen 3.152 N/A GLN 49.A N SER 45.A O no hydrogen 2.869 N/A LEU 50.A N ARG 46.A O no hydrogen 3.239 N/A MET 51.A N ALA 47.A O no hydrogen 3.086 N/A THR 52.A N LEU 48.A O no hydrogen 3.183 N/A THR 52.A OG1 LEU 48.A O no hydrogen 3.030 N/A THR 52.A OG1 TYR 75.A OH no hydrogen 2.852 N/A LYS 53.A N GLN 49.A O no hydrogen 3.036 N/A CYS 54.A N LEU 50.A O no hydrogen 2.984 N/A CYS 54.A SG LEU 50.A O no hydrogen 3.399 N/A CYS 54.A SG PHE 101.A O no hydrogen 3.707 N/A ALA 55.A N MET 51.A O no hydrogen 2.975 N/A GLN 56.A N THR 52.A O no hydrogen 2.795 N/A GLN 56.A NE2 PRO 242.A O no hydrogen 2.746 N/A THR 57.A N LYS 53.A O no hydrogen 3.021 N/A THR 57.A OG1 LYS 53.A O no hydrogen 2.862 N/A VAL 58.A N CYS 54.A O no hydrogen 2.955 N/A MET 59.A N ALA 55.A O no hydrogen 3.048 N/A GLU 60.A N GLN 56.A O no hydrogen 3.115 N/A GLU 61.A N THR 57.A O no hydrogen 3.050 N/A LEU 62.A N VAL 58.A O no hydrogen 3.076 N/A VAL 66.A N VAL 78.A O no hydrogen 2.930 N/A ALA 68.A N LEU 209.A O no hydrogen 3.131 N/A TYR 69.A N SER 76.A O no hydrogen 3.061 N/A TYR 69.A OH LYS 205.A O no hydrogen 2.598 N/A GLY 70.A N THR 207.A O no hydrogen 3.161 N/A GLU 74.A N GLN 71.A O no hydrogen 3.069 N/A TYR 75.A N LEU 25.A O no hydrogen 3.139 N/A TYR 75.A OH THR 52.A OG1 no hydrogen 2.852 N/A SER 76.A N TYR 69.A O no hydrogen 2.663 N/A PHE 77.A N VAL 23.A O no hydrogen 2.920 N/A VAL 78.A N ILE 67.A O no hydrogen 2.956 N/A PHE 79.A N VAL 21.A O no hydrogen 2.851 N/A LYS 80.A N ASP 64.A O no hydrogen 2.775 N/A ARG 81.A NE HIS 18.A O no hydrogen 3.125 N/A THR 83.A N LYS 80.A O no hydrogen 3.238 N/A THR 83.A OG1 ASP 64.A OD2 no hydrogen 2.789 N/A TRP 85.A N THR 83.A OG1 no hydrogen 3.173 N/A ARG 88.A NE CYS 15.A O no hydrogen 3.023 N/A ARG 88.A NH1 ARG 81.A O no hydrogen 2.924 N/A ARG 88.A NH1 THR 83.A O no hydrogen 3.490 N/A ARG 88.A NH2 CYS 19.A O no hydrogen 2.806 N/A ARG 89.A N PHE 86.A O no hydrogen 2.856 N/A ARG 89.A NH1 ASP 13.A OD1 no hydrogen 2.634 N/A ALA 90.A N ASP 13.A O no hydrogen 2.848 N/A SER 91.A N ASP 13.A OD2 no hydrogen 3.126 N/A SER 91.A OG ASP 13.A OD2 no hydrogen 3.191 N/A LYS 92.A N ARG 89.A O no hydrogen 3.134 N/A PHE 93.A N ARG 89.A O no hydrogen 3.345 N/A MET 94.A N ALA 90.A O no hydrogen 3.085 N/A THR 95.A N SER 91.A O no hydrogen 3.156 N/A THR 95.A OG1 SER 91.A O no hydrogen 2.707 N/A HIS 96.A N LYS 92.A O no hydrogen 3.217 N/A ALA 98.A N MET 94.A O no hydrogen 2.905 N/A SER 99.A N THR 95.A O no hydrogen 2.923 N/A SER 99.A OG THR 95.A O no hydrogen 2.789 N/A SER 99.A OG HIS 96.A O no hydrogen 3.475 N/A GLN 100.A N HIS 96.A O no hydrogen 3.159 N/A PHE 101.A N VAL 97.A O no hydrogen 2.987 N/A ALA 102.A N ALA 98.A O no hydrogen 3.197 N/A SER 103.A N SER 99.A O no hydrogen 2.793 N/A SER 104.A N GLN 100.A O no hydrogen 2.987 N/A SER 104.A OG GLN 100.A O no hydrogen 3.158 N/A TYR 105.A N PHE 101.A O no hydrogen 2.840 N/A PHE 107.A N SER 103.A O no hydrogen 3.088 N/A TYR 108.A N SER 104.A O no hydrogen 2.893 N/A TRP 109.A N VAL 106.A O no hydrogen 3.455 N/A TRP 109.A NE1 GLN 116.A O no hydrogen 2.975 N/A ASP 111.A N TYR 108.A O no hydrogen 3.149 N/A TYR 112.A N TRP 109.A O no hydrogen 3.326 N/A PHE 113.A N TRP 109.A O no hydrogen 2.878 N/A LEU 119.A N HIS 37.A NE2 no hydrogen 2.959 N/A ASP 125.A N ASP 26.A O no hydrogen 2.685 N/A ARG 127.A N ARG 24.A O no hydrogen 3.103 N/A VAL 129.A N VAL 22.A O no hydrogen 2.941 N/A TYR 131.A N TRP 20.A O no hydrogen 2.970 N/A SER 133.A N THR 136.A OG1 no hydrogen 3.290 N/A SER 133.A OG THR 136.A OG1 no hydrogen 3.077 N/A GLN 135.A NE2 ASP 139.A OD1 no hydrogen 2.625 N/A THR 136.A OG1 SER 133.A O no hydrogen 2.910 N/A THR 136.A OG1 SER 133.A OG no hydrogen 3.077 N/A LEU 137.A N SER 133.A O no hydrogen 3.392 N/A LYS 138.A N ASN 134.A O no hydrogen 2.911 N/A ASP 139.A N GLN 135.A O no hydrogen 2.879 N/A TYR 140.A N THR 136.A O no hydrogen 3.133 N/A TYR 140.A N LEU 137.A O no hydrogen 3.236 N/A LEU 141.A N LEU 137.A O no hydrogen 3.166 N/A SER 142.A N LYS 138.A O no hydrogen 2.909 N/A SER 142.A OG LYS 138.A O no hydrogen 2.512 N/A TRP 143.A N ASP 139.A O no hydrogen 3.065 N/A ARG 144.A N TYR 140.A O no hydrogen 3.078 N/A GLN 145.A N LEU 141.A O no hydrogen 3.126 N/A GLN 145.A NE2 LYS 205.A O no hydrogen 2.800 N/A GLN 145.A NE2 CYS 247.A O no hydrogen 2.844 N/A ALA 146.A N SER 142.A O no hydrogen 2.632 N/A ASP 147.A N TRP 143.A O no hydrogen 3.040 N/A CYS 148.A N ARG 144.A O no hydrogen 3.106 N/A CYS 148.A SG TYR 203.A O no hydrogen 3.674 N/A CYS 148.A SG ARG 204.A O no hydrogen 3.895 N/A HIS 149.A N GLN 145.A O no hydrogen 2.824 N/A ILE 150.A N ALA 146.A O no hydrogen 2.922 N/A ASN 151.A N ASP 147.A O no hydrogen 3.126 N/A ASN 152.A N CYS 148.A O no hydrogen 2.996 N/A ASN 152.A ND2 TYR 196.A OH no hydrogen 3.399 N/A LEU 153.A N HIS 149.A O no hydrogen 2.974 N/A TYR 154.A N ILE 150.A O no hydrogen 3.139 N/A ASN 155.A N ASN 151.A O no hydrogen 2.852 N/A THR 156.A N ASN 152.A O no hydrogen 2.862 N/A THR 156.A OG1 ASN 152.A O no hydrogen 2.638 N/A PHE 158.A N TYR 154.A O no hydrogen 2.883 N/A TRP 159.A N ASN 155.A O no hydrogen 2.980 N/A LEU 161.A N VAL 157.A O no hydrogen 3.242 N/A GLN 163.A N TRP 159.A O no hydrogen 2.915 N/A GLN 164.A N ALA 160.A O no hydrogen 2.910 N/A SER 165.A N ALA 160.A O no hydrogen 3.435 N/A LEU 167.A N LEU 161.A O no hydrogen 2.839 N/A THR 168.A N GLN 171.A OE1 no hydrogen 3.295 N/A GLN 171.A N THR 168.A OG1 no hydrogen 3.385 N/A ALA 172.A N THR 168.A O no hydrogen 2.868 N/A GLN 173.A N PRO 169.A O no hydrogen 3.025 N/A GLY 174.A N VAL 170.A O no hydrogen 3.289 N/A ARG 175.A N GLN 171.A O no hydrogen 3.038 N/A ARG 175.A NH1 ARG 175.A O no hydrogen 3.339 N/A LEU 176.A N ALA 172.A O no hydrogen 3.300 N/A GLN 177.A N GLY 174.A O no hydrogen 3.263 N/A THR 179.A N LEU 176.A O no hydrogen 3.349 N/A THR 179.A OG1 LEU 176.A O no hydrogen 2.739 N/A LEU 180.A N ASP 183.A OD2 no hydrogen 2.928 N/A LYS 184.A N LEU 180.A O no hydrogen 3.052 N/A ASN 185.A N ALA 181.A O no hydrogen 3.140 N/A GLU 186.A N ALA 182.A O no hydrogen 3.026 N/A ILE 187.A N ASP 183.A O no hydrogen 2.965 N/A LEU 188.A N LYS 184.A O no hydrogen 3.406 N/A PHE 189.A N ASN 185.A O no hydrogen 3.286 N/A SER 190.A N GLU 186.A O no hydrogen 2.858 N/A SER 190.A OG GLU 186.A O no hydrogen 2.509 N/A SER 190.A OG GLU 186.A OE1 no hydrogen 2.992 N/A SER 190.A OG GLU 186.A OE2 no hydrogen 2.946 N/A GLU 191.A N ILE 187.A O no hydrogen 3.013 N/A ILE 194.A N LEU 188.A O no hydrogen 2.780 N/A ASN 198.A N ASN 195.A O no hydrogen 3.176 N/A GLU 199.A N TYR 196.A O no hydrogen 2.908 N/A TYR 203.A N LEU 200.A O no hydrogen 3.251 N/A ARG 204.A N LEU 200.A O no hydrogen 3.266 N/A ARG 204.A NE GLU 199.A O no hydrogen 2.935 N/A ARG 204.A NH2 GLU 199.A O no hydrogen 3.557 N/A LYS 205.A N PRO 201.A O no hydrogen 2.768 N/A LYS 205.A NZ ASP 248.A OD1 no hydrogen 3.053 N/A GLY 206.A N MET 202.A O no hydrogen 3.087 N/A THR 207.A N GLY 70.A O no hydrogen 3.242 N/A THR 207.A OG1 HIS 246.A NE2 no hydrogen 3.423 N/A VAL 208.A N LEU 245.A O no hydrogen 2.908 N/A LEU 209.A N ALA 68.A O no hydrogen 2.851 N/A TRP 211.A NE1 ILE 65.A O no hydrogen 2.640 N/A GLN 212.A N LYS 241.A O no hydrogen 2.870 N/A GLU 216.A N ARG 237.A O no hydrogen 3.120 N/A MET 218.A N VAL 235.A O no hydrogen 3.314 N/A LYS 220.A N MET 233.A O no hydrogen 3.028 N/A LYS 232.A NZ GLU 221.A OE2 no hydrogen 3.542 N/A MET 233.A N LYS 220.A O no hydrogen 3.296 N/A VAL 235.A N MET 218.A O no hydrogen 3.165 N/A ARG 237.A N GLU 216.A O no hydrogen 2.788 N/A ARG 239.A N VAL 214.A O no hydrogen 2.976 N/A LYS 241.A N GLN 212.A O no hydrogen 3.114 N/A VAL 243.A N ILE 210.A O no hydrogen 2.860 N/A LEU 245.A N VAL 208.A O no hydrogen 2.914 N/A ILE 249.A N GLN 145.A OE1 no hydrogen 2.913 N/A GLY 251.A N ASP 248.A OD2 no hydrogen 2.690 N/A TRP 255.A NE1 ILE 249.A O no hydrogen 3.186 N/A LYS 256.A N ASP 252.A O no hydrogen 3.023 N/A GLU 257.A N ALA 253.A O no hydrogen 3.276 N/A HIS 258.A N PHE 254.A O no hydrogen 3.082 N/A ASP 263.A N PRO 259.A O no hydrogen 3.316 N/A