Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3u2t_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 3.A OG PHE 1.A O no hydrogen 3.444 N/A MET 4.A N THR 35.A O no hydrogen 2.946 N/A GLN 7.A N MET 4.A O no hydrogen 3.439 N/A ALA 8.A N LYS 100.A O no hydrogen 3.433 N/A PHE 9.A N ARG 37.A O no hydrogen 2.848 N/A VAL 10.A N VAL 102.A O no hydrogen 2.896 N/A THR 11.A N VAL 39.A O no hydrogen 2.891 N/A THR 11.A OG1 MET 104.A O no hydrogen 2.641 N/A LEU 12.A N THR 11.A OG1 no hydrogen 2.819 N/A THR 13.A N LEU 41.A O no hydrogen 2.969 N/A THR 13.A OG1 LEU 41.A O no hydrogen 3.524 N/A TYR 18.A N ASN 15.A OD1 no hydrogen 2.887 N/A ALA 19.A N ASN 15.A O no hydrogen 3.060 N/A LYS 20.A N ASP 16.A O no hydrogen 3.373 N/A LYS 20.A N ALA 17.A O no hydrogen 3.112 N/A ALA 22.A N TYR 18.A O no hydrogen 2.993 N/A LEU 23.A N ALA 19.A O no hydrogen 2.843 N/A VAL 24.A N LYS 20.A O no hydrogen 2.997 N/A LEU 25.A N GLY 21.A O no hydrogen 2.701 N/A GLY 26.A N ALA 22.A O no hydrogen 2.831 N/A SER 27.A N LEU 23.A O no hydrogen 3.006 N/A SER 27.A OG LEU 23.A O no hydrogen 2.769 N/A SER 28.A N VAL 24.A O no hydrogen 2.869 N/A SER 28.A OG VAL 24.A O no hydrogen 3.412 N/A SER 28.A OG LEU 25.A O no hydrogen 2.692 N/A LEU 29.A N LEU 25.A O no hydrogen 3.025 N/A LYS 30.A N GLY 26.A O no hydrogen 3.105 N/A LYS 30.A NZ VAL 57.A O no hydrogen 3.246 N/A GLN 31.A N SER 27.A O no hydrogen 2.820 N/A HIS 32.A N SER 28.A O no hydrogen 3.140 N/A ARG 33.A N LYS 30.A O no hydrogen 3.030 N/A THR 34.A N LEU 29.A O no hydrogen 3.212 N/A THR 34.A OG1 ASP 115.A OD1 no hydrogen 2.675 N/A THR 34.A OG1 ASP 115.A OD2 no hydrogen 3.531 N/A THR 35.A N ASP 115.A OD2 no hydrogen 3.051 N/A THR 35.A OG1 ASP 115.A OD2 no hydrogen 3.333 N/A ARG 36.A N THR 34.A OG1 no hydrogen 3.157 N/A ARG 36.A NE GLN 7.A OE1 no hydrogen 2.808 N/A ARG 36.A NH1 ASP 115.A OD2 no hydrogen 3.343 N/A ARG 36.A NH2 GLN 7.A OE1 no hydrogen 3.062 N/A ARG 37.A N GLN 7.A O no hydrogen 3.146 N/A LEU 38.A N ASP 59.A OD2 no hydrogen 2.957 N/A VAL 39.A N PHE 9.A O no hydrogen 2.867 N/A VAL 40.A N GLU 60.A O no hydrogen 3.048 N/A LEU 41.A N THR 11.A O no hydrogen 2.871 N/A ALA 42.A N ILE 62.A O no hydrogen 2.851 N/A THR 43.A N THR 13.A O no hydrogen 3.279 N/A THR 43.A OG1 THR 14.A O no hydrogen 3.052 N/A GLN 45.A N THR 43.A OG1 no hydrogen 3.310 N/A VAL 46.A N THR 43.A O no hydrogen 3.072 N/A SER 47.A N ASP 16.A OD1 no hydrogen 3.008 N/A SER 47.A OG ASP 16.A OD1 no hydrogen 3.507 N/A SER 47.A OG ASP 16.A OD2 no hydrogen 2.897 N/A MET 50.A N SER 47.A OG no hydrogen 3.403 N/A ARG 51.A N SER 47.A O no hydrogen 2.923 N/A ARG 51.A NE VAL 46.A O no hydrogen 2.820 N/A ARG 51.A NH1 PRO 44.A O no hydrogen 3.103 N/A ARG 51.A NH1 VAL 46.A O no hydrogen 2.758 N/A LYS 52.A N ASP 48.A O no hydrogen 3.177 N/A VAL 53.A N SER 49.A O no hydrogen 3.297 N/A LEU 54.A N MET 50.A O no hydrogen 2.899 N/A GLU 55.A N ARG 51.A O no hydrogen 3.172 N/A THR 56.A N VAL 53.A O no hydrogen 3.048 N/A THR 56.A OG1 VAL 53.A O no hydrogen 2.591 N/A VAL 57.A N LEU 54.A O no hydrogen 3.161 N/A PHE 58.A N LEU 54.A O no hydrogen 2.863 N/A ASP 59.A N LEU 38.A O no hydrogen 2.827 N/A GLU 60.A N LEU 38.A O no hydrogen 3.237 N/A ILE 62.A N VAL 40.A O no hydrogen 2.967 N/A VAL 64.A N ALA 42.A O no hydrogen 2.719 N/A LEU 67.A N ASP 65.A OD1 no hydrogen 3.160 N/A ASP 68.A N ASP 65.A O no hydrogen 3.037 N/A GLY 70.A N ASP 68.A OD1 no hydrogen 2.841 N/A ASP 71.A N ASP 68.A O no hydrogen 2.930 N/A SER 72.A OG TYR 149.A OH no hydrogen 2.955 N/A ALA 73.A N ASP 71.A OD2 no hydrogen 2.934 N/A HIS 74.A N ASP 71.A O no hydrogen 3.122 N/A HIS 74.A ND1 VAL 66.A O no hydrogen 2.662 N/A LEU 77.A N ALA 73.A O no hydrogen 2.973 N/A MET 78.A N HIS 74.A O no hydrogen 3.088 N/A LYS 79.A N LEU 75.A O no hydrogen 3.393 N/A LYS 79.A NZ SER 157.A O no hydrogen 3.302 N/A ARG 80.A N THR 76.A O no hydrogen 2.782 N/A ARG 80.A NE ALA 156.A O no hydrogen 3.114 N/A ARG 80.A NE SER 157.A O no hydrogen 2.918 N/A ARG 80.A NH2 SER 157.A O no hydrogen 2.802 N/A GLU 82.A N GLU 82.A OE1 no hydrogen 2.684 N/A LEU 83.A N ARG 80.A O no hydrogen 3.132 N/A LEU 87.A N LEU 83.A O no hydrogen 2.821 N/A THR 88.A N GLY 84.A O no hydrogen 2.982 N/A THR 88.A OG1 GLY 84.A O no hydrogen 2.809 N/A LYS 89.A N VAL 85.A O no hydrogen 2.919 N/A LYS 89.A NZ ASP 105.A OD1 no hydrogen 3.076 N/A LYS 89.A NZ SER 137.A O no hydrogen 2.859 N/A LYS 89.A NZ ASP 166.A OD1 no hydrogen 2.632 N/A LEU 90.A N THR 86.A O no hydrogen 2.924 N/A HIS 91.A N THR 88.A O no hydrogen 3.066 N/A HIS 91.A ND1 LEU 87.A O no hydrogen 2.830 N/A HIS 91.A NE2 ASP 71.A OD1 no hydrogen 2.827 N/A HIS 91.A NE2 ASP 71.A OD2 no hydrogen 3.073 N/A CYS 92.A N LYS 89.A O no hydrogen 2.972 N/A CYS 92.A SG LYS 89.A O no hydrogen 3.294 N/A TRP 93.A N LEU 90.A O no hydrogen 3.061 N/A TRP 93.A NE1 GLU 122.A OE1 no hydrogen 2.767 N/A SER 94.A N HIS 91.A O no hydrogen 2.845 N/A LEU 95.A N CYS 92.A O no hydrogen 3.386 N/A THR 96.A N SER 94.A O no hydrogen 2.849 N/A GLN 97.A N GLN 97.A OE1 no hydrogen 2.754 N/A GLN 97.A NE2 GLU 60.A OE1 no hydrogen 3.188 N/A GLN 97.A NE2 GLU 60.A OE2 no hydrogen 3.391 N/A TYR 98.A N LEU 95.A O no hydrogen 3.107 N/A TYR 98.A OH GLU 60.A OE1 no hydrogen 2.127 N/A SER 99.A N ASP 6.A O no hydrogen 2.898 N/A SER 99.A OG ASP 6.A O no hydrogen 3.524 N/A SER 99.A OG ASP 6.A OD2 no hydrogen 2.510 N/A LYS 100.A NZ PHE 118.A O no hydrogen 2.684 N/A LYS 100.A NZ ARG 120.A O no hydrogen 2.750 N/A CYS 101.A N TYR 142.A O no hydrogen 2.900 N/A VAL 102.A N ALA 8.A O no hydrogen 3.029 N/A PHE 103.A N PHE 140.A O no hydrogen 2.833 N/A MET 104.A N VAL 10.A O no hydrogen 2.795 N/A ASP 105.A N GLY 138.A O no hydrogen 2.814 N/A THR 108.A N ASP 105.A O no hydrogen 3.124 N/A THR 108.A OG1 ASP 105.A O no hydrogen 2.703 N/A LEU 109.A N VAL 211.A O no hydrogen 2.954 N/A VAL 110.A N SER 28.A OG no hydrogen 3.133 N/A LEU 111.A N LYS 209.A O no hydrogen 2.745 N/A ASN 113.A ND2 HIS 32.A O no hydrogen 2.920 N/A ASP 115.A N ASN 113.A OD1 no hydrogen 2.868 N/A LEU 117.A N ILE 114.A O no hydrogen 3.139 N/A PHE 118.A N ASP 115.A O no hydrogen 3.079 N/A ASP 119.A N ASP 116.A O no hydrogen 3.064 N/A ARG 120.A N LEU 117.A O no hydrogen 2.990 N/A ARG 120.A NH1.A ARG 183.A O no hydrogen 2.860 N/A SER 124.A N VAL 141.A O no hydrogen 3.271 N/A SER 124.A OG GLU 121.A O no hydrogen 2.579 N/A ALA 125.A N LYS 184.A O no hydrogen 3.074 N/A ASP 128.A N CYS 134.A O no hydrogen 2.896 N/A CYS 134.A N TRP 131.A O no hydrogen 2.907 N/A PHE 135.A N ASN 171.A OD1 no hydrogen 2.979 N/A ASN 136.A N ALA 126.A O no hydrogen 2.825 N/A ASN 136.A ND2 ASP 128.A OD1 no hydrogen 2.823 N/A SER 137.A N GLN 167.A OE1 no hydrogen 2.919 N/A SER 137.A OG ASP 166.A OD1 no hydrogen 2.615 N/A SER 137.A OG GLN 167.A OE1 no hydrogen 3.485 N/A GLY 138.A N ASN 136.A OD1 no hydrogen 2.859 N/A PHE 140.A N PHE 103.A O no hydrogen 2.970 N/A VAL 141.A N SER 124.A O no hydrogen 2.862 N/A TYR 142.A N CYS 101.A O no hydrogen 2.961 N/A TYR 142.A OH CYS 92.A O no hydrogen 2.697 N/A GLN 143.A N GLU 122.A OE1 no hydrogen 2.825 N/A GLN 143.A NE2 SER 99.A O no hydrogen 3.297 N/A SER 145.A N TRP 93.A O no hydrogen 2.868 N/A SER 145.A OG THR 148.A OG1 no hydrogen 3.302 N/A THR 148.A N SER 145.A OG no hydrogen 3.021 N/A THR 148.A OG1 SER 145.A OG no hydrogen 3.302 N/A TYR 149.A N SER 145.A O no hydrogen 2.950 N/A TYR 149.A OH SER 72.A OG no hydrogen 2.955 N/A ASN 150.A N VAL 146.A O no hydrogen 2.953 N/A GLN 151.A N GLU 147.A O no hydrogen 2.980 N/A LEU 152.A N THR 148.A O no hydrogen 2.934 N/A LEU 153.A N TYR 149.A O no hydrogen 3.051 N/A HIS 154.A N ASN 150.A O no hydrogen 2.956 N/A LEU 155.A N GLN 151.A O no hydrogen 3.034 N/A ALA 156.A N LEU 152.A O no hydrogen 3.026 N/A SER 157.A N LEU 153.A O no hydrogen 2.804 N/A SER 157.A OG GLU 158.A OE1 no hydrogen 3.235 N/A GLU 158.A N HIS 154.A O no hydrogen 2.979 N/A GLN 159.A N LEU 155.A O no hydrogen 2.867 N/A GLY 160.A N ALA 156.A O no hydrogen 2.916 N/A SER 161.A OG ASP 163.A OD1 no hydrogen 2.963 N/A SER 161.A OG GLY 165.A O no hydrogen 2.375 N/A GLY 164.A N SER 161.A O no hydrogen 3.099 N/A GLY 165.A N ASP 163.A OD1 no hydrogen 3.167 N/A GLY 168.A N ASP 163.A OD1 no hydrogen 2.940 N/A LEU 170.A N ASP 166.A O no hydrogen 2.875 N/A ASN 171.A N GLN 167.A O no hydrogen 2.943 N/A ASN 171.A ND2 PHE 135.A O no hydrogen 2.832 N/A ASN 171.A ND2 GLN 167.A O no hydrogen 3.155 N/A THR 172.A N GLY 168.A O no hydrogen 2.950 N/A THR 172.A OG1 GLY 168.A O no hydrogen 2.900 N/A PHE 173.A N ILE 169.A O no hydrogen 2.987 N/A PHE 174.A N LEU 170.A O no hydrogen 2.847 N/A TRP 177.A N PHE 174.A O no hydrogen 3.375 N/A TRP 177.A NE1 ALA 125.A O no hydrogen 3.148 N/A TRP 177.A NE1 LYS 184.A O no hydrogen 2.844 N/A THR 179.A N SER 176.A O no hydrogen 3.206 N/A THR 179.A OG1 SER 176.A O no hydrogen 3.425 N/A THR 180.A N SER 176.A O no hydrogen 2.961 N/A THR 180.A OG1 SER 176.A O no hydrogen 3.517 N/A ARG 183.A N ASP 181.A OD1 no hydrogen 3.262 N/A ARG 183.A NE ASP 181.A OD1 no hydrogen 3.068 N/A ARG 183.A NH2 ASP 181.A OD1 no hydrogen 3.512 N/A ARG 183.A NH2 ASP 181.A OD2 no hydrogen 3.298 N/A LYS 184.A N ASP 181.A O no hydrogen 2.916 N/A LYS 184.A NZ GLU 122.A O no hydrogen 3.044 N/A HIS 185.A N ILE 182.A O no hydrogen 2.909 N/A HIS 185.A NE2 TRP 177.A O no hydrogen 2.777 N/A LEU 186.A N ALA 125.A O no hydrogen 2.961 N/A TYR 190.A N PRO 187.A O no hydrogen 2.918 N/A TYR 190.A OH ASP 116.A OD1 no hydrogen 2.946 N/A TYR 190.A OH ASP 116.A OD2 no hydrogen 2.772 N/A ASN 191.A N PHE 188.A O no hydrogen 2.940 N/A ASN 191.A ND2 ASN 136.A OD1 no hydrogen 2.945 N/A LEU 192.A N VAL 210.A O no hydrogen 3.016 N/A SER 194.A N HIS 212.A O no hydrogen 3.028 N/A SER 194.A OG HIS 212.A O no hydrogen 3.284 N/A ILE 195.A N SER 193.A OG no hydrogen 3.117 N/A ALA 200.A N TYR 197.A O no hydrogen 3.199 N/A PHE 201.A N TYR 197.A O no hydrogen 3.315 N/A LYS 202.A N LEU 198.A O no hydrogen 2.960 N/A VAL 203.A N ALA 200.A O no hydrogen 3.311 N/A PHE 204.A N ALA 200.A O no hydrogen 2.935 N/A GLY 205.A N PHE 201.A O no hydrogen 2.664 N/A SER 207.A N PHE 204.A O no hydrogen 3.191 N/A SER 207.A OG PHE 204.A O no hydrogen 2.584 N/A ALA 208.A N GLY 205.A O no hydrogen 2.924 N/A LYS 209.A N ILE 189.A O no hydrogen 2.877 N/A LYS 209.A NZ TYR 190.A OH no hydrogen 3.187 N/A VAL 210.A N ILE 189.A O no hydrogen 3.156 N/A VAL 211.A N LEU 109.A O no hydrogen 2.944 N/A HIS 212.A N LEU 192.A O no hydrogen 2.888 N/A PHE 213.A N ASP 107.A O no hydrogen 2.861 N/A LEU 214.A N HIS 212.A O no hydrogen 3.023 N/A LYS 218.A N ASN 221.A OD1 no hydrogen 2.821 N/A LYS 218.A NZ ASP 107.A OD2 no hydrogen 2.632 N/A LYS 218.A NZ PHE 213.A O no hydrogen 2.882 N/A LYS 218.A NZ GLY 215.A O no hydrogen 2.965 N/A ASN 221.A N LYS 218.A O no hydrogen 3.013 N/A TYR 222.A N PRO 219.A O no hydrogen 3.270 N/A ASP 225.A N SER 230.A O no hydrogen 3.054 N/A THR 228.A OG1 ASP 225.A O no hydrogen 3.549 N/A THR 228.A OG1 ASP 225.A OD2 no hydrogen 3.069 N/A THR 228.A OG1 SER 230.A OG no hydrogen 2.690 N/A LYS 229.A N PRO 226.A O no hydrogen 3.310 N/A SER 230.A OG THR 228.A OG1 no hydrogen 2.690 N/A LYS 232.A N THR 223.A O no hydrogen 3.278 N/A GLU 238.A N GLU 238.A OE2.A no hydrogen 2.736 N/A ILE 241.A N PRO 237.A O no hydrogen 3.137 N/A LEU 242.A N GLU 238.A O no hydrogen 2.830 N/A TRP 243.A N PHE 239.A O no hydrogen 2.908 N/A TRP 244.A N LEU 240.A O no hydrogen 3.089 N/A TRP 244.A NE1 PRO 219.A O no hydrogen 2.851 N/A ASN 245.A N ILE 241.A O no hydrogen 2.863 N/A ILE 246.A N LEU 242.A O no hydrogen 2.941 N/A PHE 247.A N TRP 243.A O no hydrogen 3.099 N/A THR 248.A N TRP 244.A O no hydrogen 2.962 N/A THR 248.A OG1 TRP 244.A O no hydrogen 2.833 N/A THR 249.A N ASN 245.A O no hydrogen 2.909 N/A THR 249.A OG1 ASN 245.A O no hydrogen 2.901 N/A ASN 250.A N ILE 246.A O no hydrogen 2.822 N/A VAL 251.A N ILE 246.A O no hydrogen 3.054 N/A VAL 251.A N PHE 247.A O no hydrogen 3.241 N/A LEU 252.A N PHE 247.A O no hydrogen 3.003 N/A LEU 254.A N VAL 251.A O no hydrogen 3.043 N/A GLN 256.A NE2 PRO 253.A O no hydrogen 2.630 N/A