Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1ssm_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 1.A OG1 ASP 72.A OD1 no hydrogen 2.366 N/A TRP 5.A N THR 1.A O no hydrogen 2.907 N/A GLN 6.A N LEU 2.A O no hydrogen 2.930 N/A HIS 7.A N ASP 3.A O no hydrogen 2.949 N/A ILE 8.A N VAL 4.A O no hydrogen 2.915 N/A ARG 9.A N TRP 5.A O no hydrogen 2.884 N/A ARG 9.A NH1 LEU 30.A O no hydrogen 2.767 N/A GLN 10.A N GLN 6.A O no hydrogen 2.990 N/A GLU 11.A N HIS 7.A O no hydrogen 2.971 N/A ALA 12.A N ILE 8.A O no hydrogen 2.817 N/A LYS 13.A N ARG 9.A O no hydrogen 2.895 N/A LYS 13.A N GLN 10.A O no hydrogen 3.197 N/A GLU 14.A N GLN 10.A O no hydrogen 3.405 N/A LEU 15.A N GLU 11.A O no hydrogen 2.698 N/A ALA 16.A N ALA 12.A O no hydrogen 2.930 N/A GLU 17.A N LYS 13.A O no hydrogen 3.322 N/A ASN 18.A N GLU 14.A O no hydrogen 2.988 N/A GLU 19.A N LEU 15.A O no hydrogen 3.030 N/A GLU 19.A N ALA 16.A O no hydrogen 3.300 N/A ALA 22.A N PRO 20.A O no hydrogen 3.452 N/A PHE 25.A N LEU 21.A O no hydrogen 3.009 N/A HIS 26.A N ALA 22.A O no hydrogen 3.001 N/A SER 27.A N SER 23.A O no hydrogen 2.857 N/A SER 27.A OG SER 23.A O no hydrogen 3.360 N/A THR 28.A N PHE 24.A O no hydrogen 2.949 N/A THR 28.A OG1 PHE 24.A O no hydrogen 2.792 N/A ILE 29.A N PHE 25.A O no hydrogen 2.832 N/A LEU 30.A N PHE 25.A O no hydrogen 3.152 N/A LYS 31.A N HIS 26.A O no hydrogen 3.067 N/A HIS 32.A N ILE 29.A O no hydrogen 2.967 N/A HIS 32.A NE2 SER 27.A O no hydrogen 2.798 N/A GLY 37.A N ASN 34.A OD1 no hydrogen 2.688 N/A ALA 38.A N ASN 34.A O no hydrogen 3.321 N/A LEU 39.A N LEU 35.A O no hydrogen 2.826 N/A SER 40.A N GLY 36.A O no hydrogen 2.929 N/A SER 40.A OG GLY 36.A O no hydrogen 3.283 N/A SER 40.A OG GLY 37.A O no hydrogen 3.132 N/A TYR 41.A N GLY 37.A O no hydrogen 2.999 N/A LEU 42.A N ALA 38.A O no hydrogen 2.804 N/A LEU 43.A N LEU 39.A O no hydrogen 2.851 N/A ALA 44.A N SER 40.A O no hydrogen 2.856 N/A ASN 45.A N TYR 41.A O no hydrogen 3.141 N/A ASN 45.A ND2 TYR 41.A O no hydrogen 2.886 N/A LYS 46.A N LEU 42.A O no hydrogen 3.037 N/A LEU 47.A N LEU 43.A O no hydrogen 2.892 N/A ASN 49.A ND2 TYR 124.A OH no hydrogen 2.520 N/A ILE 51.A N ASN 49.A OD1 no hydrogen 2.620 N/A LEU 56.A N PRO 52.A O no hydrogen 2.907 N/A ARG 57.A N ALA 53.A O no hydrogen 2.993 N/A ARG 57.A NE SER 40.A OG no hydrogen 2.808 N/A ARG 57.A NH2 GLY 37.A O no hydrogen 3.036 N/A ILE 60.A N LEU 56.A O no hydrogen 3.069 N/A GLU 61.A N ARG 57.A O no hydrogen 2.759 N/A GLU 62.A N GLU 58.A O no hydrogen 3.174 N/A ALA 63.A N ILE 59.A O no hydrogen 3.140 N/A TYR 64.A N ILE 60.A O no hydrogen 2.823 N/A GLN 65.A N GLU 61.A O no hydrogen 3.013 N/A SER 66.A N GLU 62.A O no hydrogen 3.075 N/A SER 66.A OG GLU 62.A O no hydrogen 3.490 N/A SER 66.A OG GLU 62.A OE2 no hydrogen 2.701 N/A SER 66.A OG TYR 112.A OH no hydrogen 3.258 N/A ASN 67.A N ALA 63.A O no hydrogen 3.090 N/A SER 69.A OG ASN 67.A OD1 no hydrogen 2.689 N/A ILE 70.A N ASN 67.A O no hydrogen 3.225 N/A ILE 71.A N PRO 68.A O no hydrogen 3.156 N/A CYS 73.A N SER 69.A O no hydrogen 2.999 N/A CYS 73.A SG SER 69.A O no hydrogen 3.835 N/A ALA 74.A N ILE 70.A O no hydrogen 3.122 N/A ALA 75.A N ILE 71.A O no hydrogen 3.063 N/A CYS 76.A N ASP 72.A O no hydrogen 3.117 N/A CYS 76.A SG ASP 72.A O no hydrogen 3.611 N/A ASP 77.A N CYS 73.A O no hydrogen 2.969 N/A ILE 78.A N ALA 74.A O no hydrogen 2.978 N/A GLN 79.A N ALA 75.A O no hydrogen 3.147 N/A ALA 80.A N CYS 76.A O no hydrogen 3.139 N/A VAL 81.A N ASP 77.A O no hydrogen 3.024 N/A ARG 82.A N ILE 78.A O no hydrogen 2.846 N/A ARG 82.A NE GLU 89.A O no hydrogen 3.000 N/A ARG 82.A NH2 GLU 89.A O no hydrogen 3.524 N/A HIS 83.A N GLN 79.A O no hydrogen 3.016 N/A ARG 84.A N ALA 80.A O no hydrogen 3.025 N/A ARG 84.A NE SER 167.A OG no hydrogen 3.202 N/A ARG 84.A NH1 GLY 146.A O no hydrogen 3.221 N/A ARG 84.A NH2 GLY 146.A O no hydrogen 2.607 N/A ARG 84.A NH2 VAL 166.A O no hydrogen 3.012 N/A ASP 85.A N VAL 81.A O no hydrogen 3.058 N/A ALA 87.A N ASP 85.A OD1 no hydrogen 2.994 N/A VAL 88.A N ASP 85.A O no hydrogen 2.376 N/A TRP 91.A N GLU 11.A OE1 no hydrogen 2.587 N/A SER 92.A N GLU 11.A OE2 no hydrogen 2.657 N/A SER 92.A OG GLU 11.A OE2 no hydrogen 2.629 N/A THR 93.A N LEU 90.A O no hydrogen 3.221 N/A LEU 96.A N SER 92.A O no hydrogen 2.927 N/A TYR 97.A N THR 93.A O no hydrogen 2.847 N/A LEU 98.A N PRO 94.A O no hydrogen 3.275 N/A LYS 99.A NZ THR 152.A OG1 no hydrogen 3.418 N/A HIS 102.A N LEU 98.A O no hydrogen 2.937 N/A HIS 102.A NE2 LEU 95.A O no hydrogen 2.843 N/A ALA 103.A N LYS 99.A O no hydrogen 2.703 N/A ILE 104.A N GLY 100.A O no hydrogen 2.918 N/A GLN 105.A N PHE 101.A O no hydrogen 2.907 N/A SER 106.A N HIS 102.A O no hydrogen 3.039 N/A SER 106.A OG HIS 102.A O no hydrogen 2.706 N/A TYR 107.A N ALA 103.A O no hydrogen 2.769 N/A TYR 107.A OH ALA 141.A O no hydrogen 2.553 N/A ARG 108.A N ILE 104.A O no hydrogen 3.069 N/A ARG 108.A NH1 ILE 143.A O no hydrogen 3.336 N/A ARG 108.A NH1 GLY 144.A O no hydrogen 2.784 N/A ARG 108.A NH2 ASP 77.A OD2 no hydrogen 2.708 N/A ARG 108.A NH2 GLY 144.A O no hydrogen 2.824 N/A ILE 109.A N GLN 105.A O no hydrogen 3.426 N/A THR 110.A N SER 106.A O no hydrogen 3.331 N/A THR 110.A OG1 TYR 107.A O no hydrogen 2.544 N/A HIS 111.A N TYR 107.A O no hydrogen 2.885 N/A HIS 111.A ND1 PRO 139.A O no hydrogen 2.842 N/A TYR 112.A N ARG 108.A O no hydrogen 3.114 N/A TYR 112.A OH GLU 62.A OE1 no hydrogen 2.434 N/A TYR 112.A OH SER 66.A OG no hydrogen 3.258 N/A LEU 113.A N ILE 109.A O no hydrogen 3.161 N/A TRP 114.A N THR 110.A O no hydrogen 2.825 N/A ASN 115.A N HIS 111.A O no hydrogen 3.008 N/A ASN 115.A ND2 HIS 111.A NE2 no hydrogen 3.304 N/A GLN 116.A N LEU 113.A O no hydrogen 3.072 N/A ASN 117.A N TRP 114.A O no hydrogen 2.855 N/A ARG 118.A N LEU 113.A O no hydrogen 2.941 N/A ALA 122.A N ARG 118.A O no hydrogen 3.068 N/A LEU 123.A N LYS 119.A O no hydrogen 2.732 N/A TYR 124.A N SER 120.A O no hydrogen 2.905 N/A LEU 125.A N LEU 121.A O no hydrogen 3.172 N/A GLN 126.A N ALA 122.A O no hydrogen 2.962 N/A GLN 126.A NE2 ASP 136.A OD2 no hydrogen 2.664 N/A ASN 127.A N LEU 123.A O no hydrogen 3.257 N/A ASN 127.A ND2 LEU 123.A O no hydrogen 2.914 N/A ASN 127.A ND2 GLN 126.A OE1 no hydrogen 3.670 N/A GLN 128.A N TYR 124.A O no hydrogen 3.051 N/A GLN 128.A NE2 LEU 47.A O no hydrogen 3.276 N/A ILE 129.A N LEU 125.A O no hydrogen 2.656 N/A SER 130.A N GLN 126.A O no hydrogen 2.989 N/A VAL 131.A N ASN 127.A O no hydrogen 2.998 N/A ALA 132.A N GLN 128.A O no hydrogen 2.968 N/A PHE 133.A N ILE 129.A O no hydrogen 2.885 N/A ASP 134.A N SER 130.A O no hydrogen 2.890 N/A ASP 136.A N ILE 154.A O no hydrogen 2.920 N/A HIS 138.A N VAL 156.A O no hydrogen 3.155 N/A ALA 141.A N HIS 138.A O no hydrogen 3.042 N/A LYS 142.A N SER 160.A O no hydrogen 3.013 N/A ILE 143.A N TYR 107.A OH no hydrogen 3.315 N/A GLY 144.A N ILE 162.A O no hydrogen 2.784 N/A HIS 145.A N ASN 164.A OD1 no hydrogen 2.790 N/A GLY 146.A N ASP 77.A OD1 no hydrogen 2.785 N/A ILE 147.A N ASP 77.A OD1 no hydrogen 2.909 N/A ASP 149.A N ILE 168.A O no hydrogen 2.988 N/A THR 152.A N HIS 150.A O no hydrogen 2.979 N/A GLY 153.A N ASP 134.A O no hydrogen 2.767 N/A ILE 154.A N ALA 151.A O no hydrogen 3.103 N/A VAL 155.A N VAL 172.A O no hydrogen 3.136 N/A VAL 156.A N ASP 136.A O no hydrogen 2.826 N/A GLY 157.A N LEU 174.A O no hydrogen 2.854 N/A THR 159.A N HIS 185.A ND1 no hydrogen 2.844 N/A THR 159.A OG1 HIS 185.A ND1 no hydrogen 2.829 N/A SER 160.A N GLY 157.A O no hydrogen 3.195 N/A SER 160.A OG GLY 157.A O no hydrogen 3.015 N/A VAL 161.A N PRO 186.A O no hydrogen 3.138 N/A ILE 162.A N LYS 142.A O no hydrogen 2.838 N/A GLU 163.A N VAL 188.A O no hydrogen 2.874 N/A ASP 165.A N HIS 145.A O no hydrogen 2.988 N/A SER 167.A N VAL 192.A O no hydrogen 2.936 N/A LEU 169.A N ILE 193.A O no hydrogen 3.157 N/A GLN 170.A N GLN 170.A OE1 no hydrogen 2.807 N/A GLY 171.A N THR 152.A O no hydrogen 2.841 N/A THR 173.A N ALA 197.A O no hydrogen 3.023 N/A LEU 174.A N VAL 155.A O no hydrogen 2.854 N/A GLY 175.A N ILE 199.A O no hydrogen 2.925 N/A ARG 184.A N THR 159.A OG1 no hydrogen 3.011 N/A ARG 184.A NH1 GLY 182.A O no hydrogen 3.162 N/A LYS 187.A N ILE 203.A O no hydrogen 2.952 N/A LYS 187.A NZ THR 159.A O no hydrogen 3.026 N/A LYS 187.A NZ ASP 183.A OD1 no hydrogen 2.251 N/A LYS 187.A NZ HIS 185.A O no hydrogen 2.990 N/A LYS 187.A NZ ASN 202.A OD1 no hydrogen 3.190 N/A VAL 188.A N VAL 161.A O no hydrogen 2.711 N/A ARG 189.A N VAL 205.A O no hydrogen 2.929 N/A ARG 189.A NE GLU 204.A OE1 no hydrogen 2.629 N/A ARG 189.A NH1 GLU 163.A OE2 no hydrogen 3.114 N/A ARG 189.A NH2 GLU 204.A OE1 no hydrogen 3.325 N/A ARG 189.A NH2 GLU 204.A OE2 no hydrogen 2.464 N/A GLU 190.A N GLU 163.A OE1 no hydrogen 3.008 N/A GLY 191.A N ASN 164.A O no hydrogen 3.175 N/A GLY 194.A N ILE 211.A O no hydrogen 2.586 N/A GLY 196.A N GLN 170.A O no hydrogen 2.696 N/A ALA 197.A N GLY 194.A O no hydrogen 3.323 N/A LYS 198.A N SER 215.A O no hydrogen 2.691 N/A LYS 198.A NZ GLY 171.A O no hydrogen 3.103 N/A LYS 198.A NZ GLY 196.A O no hydrogen 2.681 N/A ILE 199.A N THR 173.A O no hydrogen 2.960 N/A LEU 200.A N VAL 217.A O no hydrogen 3.001 N/A GLY 201.A N GLY 175.A O no hydrogen 2.700 N/A VAL 205.A N LYS 187.A O no hydrogen 2.891 N/A GLY 206.A N VAL 221.A O no hydrogen 2.811 N/A TYR 208.A N GLU 190.A O no hydrogen 2.661 N/A TYR 208.A OH GLU 190.A OE2 no hydrogen 3.005 N/A ALA 209.A N GLY 206.A O no hydrogen 3.006 N/A LYS 210.A N ALA 225.A O no hydrogen 2.766 N/A GLY 212.A N ALA 227.A O no hydrogen 2.970 N/A ASN 214.A N ALA 195.A O no hydrogen 2.862 N/A SER 215.A N GLY 212.A O no hydrogen 3.018 N/A SER 215.A OG GLY 212.A O no hydrogen 2.603 N/A VAL 216.A N GLY 229.A O no hydrogen 3.096 N/A VAL 217.A N LYS 198.A O no hydrogen 2.818 N/A VAL 221.A N GLU 204.A O no hydrogen 2.792 N/A TYR 224.A N LYS 207.A O no hydrogen 2.822 N/A ALA 225.A N PRO 222.A O no hydrogen 3.211 N/A ALA 227.A N LYS 210.A O no hydrogen 3.061 N/A ALA 228.A N ARG 233.A O no hydrogen 3.100 N/A GLY 229.A N SER 215.A OG no hydrogen 3.287 N/A ALA 232.A N VAL 216.A O no hydrogen 2.918 N/A ARG 233.A N ALA 228.A O no hydrogen 2.899 N/A VAL 235.A N THR 226.A O no hydrogen 2.837 N/A