Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3r6h_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 4.A N ARG 15.A O no hydrogen 2.968 N/A TYR 5.A OH ASP 42.A OD2 no hydrogen 2.663 N/A THR 6.A N VAL 13.A O no hydrogen 2.858 N/A ASP 8.A N ILE 11.A O no hydrogen 2.782 N/A ILE 11.A N ASP 8.A O no hydrogen 3.019 N/A GLY 12.A N ALA 46.A O no hydrogen 2.927 N/A VAL 13.A N THR 6.A O no hydrogen 2.710 N/A ILE 14.A N VAL 48.A O no hydrogen 2.754 N/A ARG 15.A N THR 4.A O no hydrogen 2.817 N/A MET 16.A N ALA 50.A O no hydrogen 2.877 N/A ASP 17.A N PRO 2.A O no hydrogen 2.703 N/A ASP 18.A N ASN 22.A OD1 no hydrogen 3.033 N/A GLY 19.A N ASP 17.A OD1 no hydrogen 2.936 N/A LYS 20.A N ASP 18.A OD1 no hydrogen 2.868 N/A ASN 22.A N ASP 18.A OD1 no hydrogen 2.924 N/A ASN 22.A ND2 MET 16.A O no hydrogen 3.104 N/A ASN 22.A ND2 PHE 56.A O no hydrogen 2.979 N/A LEU 24.A N GLY 59.A O no hydrogen 2.733 N/A GLN 29.A N GLY 25.A O no hydrogen 2.922 N/A GLN 29.A NE2 LEU 24.A O no hydrogen 2.787 N/A GLN 29.A NE2 MET 73.A O no hydrogen 2.968 N/A GLN 30.A N PRO 26.A O no hydrogen 3.002 N/A ALA 31.A N THR 27.A O no hydrogen 3.043 N/A LEU 32.A N MET 28.A O no hydrogen 2.816 N/A ASN 33.A N GLN 29.A O no hydrogen 2.938 N/A ASN 33.A ND2 GLN 29.A O no hydrogen 3.185 N/A GLU 34.A N GLN 30.A O no hydrogen 2.941 N/A ALA 35.A N ALA 31.A O no hydrogen 3.019 N/A ILE 36.A N LEU 32.A O no hydrogen 2.935 N/A ASP 37.A N ASN 33.A O no hydrogen 2.923 N/A ALA 38.A N GLU 34.A O no hydrogen 3.042 N/A ALA 39.A N ALA 35.A O no hydrogen 2.996 N/A ASP 40.A N ILE 36.A O no hydrogen 2.855 N/A ARG 41.A N ASP 37.A O no hydrogen 2.912 N/A ASP 42.A N ALA 38.A O no hydrogen 2.992 N/A ASN 43.A N ASP 40.A O no hydrogen 2.977 N/A VAL 44.A N ALA 39.A O no hydrogen 3.295 N/A GLY 45.A N ALA 10.A O no hydrogen 2.893 N/A LEU 47.A N PRO 90.A O no hydrogen 2.944 N/A VAL 48.A N GLY 12.A O no hydrogen 2.884 N/A ILE 49.A N VAL 92.A O no hydrogen 2.891 N/A ALA 50.A N ILE 14.A O no hydrogen 2.784 N/A ASN 52.A N VAL 55.A O no hydrogen 2.998 N/A ASN 52.A ND2 ASP 17.A OD1 no hydrogen 3.106 N/A ASN 52.A ND2 LYS 20.A O no hydrogen 3.204 N/A ARG 54.A N ASN 52.A OD1 no hydrogen 2.983 N/A ARG 54.A NH1 LYS 20.A O no hydrogen 3.104 N/A ARG 54.A NH2 LYS 20.A O no hydrogen 2.861 N/A VAL 55.A N ASN 52.A OD1 no hydrogen 2.944 N/A PHE 56.A N HIS 98.A O no hydrogen 2.910 N/A SER 57.A N HIS 98.A O no hydrogen 3.296 N/A SER 57.A OG ASN 22.A O no hydrogen 2.726 N/A GLY 58.A N VAL 21.A O no hydrogen 2.887 N/A GLY 59.A N SER 57.A OG no hydrogen 3.234 N/A VAL 64.A N ASP 61.A O no hydrogen 3.184 N/A LEU 65.A N ASP 61.A O no hydrogen 3.298 N/A THR 66.A N LEU 62.A O no hydrogen 2.743 N/A LYS 68.A NZ ASP 72.A OD2 no hydrogen 2.983 N/A ILE 71.A N ALA 67.A O no hydrogen 2.889 N/A ASP 72.A N LYS 68.A O no hydrogen 2.817 N/A MET 73.A N PRO 69.A O no hydrogen 3.079 N/A LEU 74.A N ALA 70.A O no hydrogen 2.921 N/A ARG 75.A N ILE 71.A O no hydrogen 2.855 N/A ARG 75.A NH1 ASP 72.A OD1 no hydrogen 2.740 N/A GLY 76.A N ASP 72.A O no hydrogen 2.971 N/A GLY 77.A N MET 73.A O no hydrogen 2.959 N/A PHE 78.A N LEU 74.A O no hydrogen 3.131 N/A GLU 79.A N ARG 75.A O no hydrogen 2.763 N/A LEU 80.A N GLY 76.A O no hydrogen 3.050 N/A SER 81.A N GLY 77.A O no hydrogen 3.175 N/A SER 81.A OG SER 109.A OG no hydrogen 2.841 N/A TYR 82.A N PHE 78.A O no hydrogen 3.001 N/A ARG 83.A N GLU 79.A O no hydrogen 2.801 N/A ARG 83.A NH1 ASN 33.A O no hydrogen 3.220 N/A ARG 83.A NH1 ASN 33.A OD1 no hydrogen 2.930 N/A ARG 83.A NH1 ASP 37.A OD1 no hydrogen 3.255 N/A ARG 83.A NH2 ASP 37.A OD1 no hydrogen 2.701 N/A ARG 83.A NH2 ASP 40.A OD2 no hydrogen 2.995 N/A LEU 84.A N LEU 80.A O no hydrogen 2.979 N/A LEU 85.A N SER 81.A O no hydrogen 2.847 N/A SER 86.A N TYR 82.A O no hydrogen 3.001 N/A SER 86.A OG TYR 82.A O no hydrogen 2.710 N/A SER 86.A OG ARG 83.A O no hydrogen 3.552 N/A TYR 87.A N LEU 84.A O no hydrogen 3.224 N/A TYR 87.A OH ASP 40.A OD1 no hydrogen 2.701 N/A LYS 89.A NZ ASN 43.A OD1 no hydrogen 2.596 N/A LYS 89.A NZ VAL 44.A O no hydrogen 2.666 N/A VAL 91.A N ASP 111.A OD2 no hydrogen 2.816 N/A VAL 92.A N LEU 47.A O no hydrogen 2.778 N/A ILE 93.A N HIS 112.A O no hydrogen 2.772 N/A ALA 94.A N ILE 49.A O no hydrogen 2.827 N/A CYS 95.A N VAL 114.A O no hydrogen 2.776 N/A CYS 95.A SG GLY 97.A O no hydrogen 3.350 N/A THR 96.A OG1 ASN 52.A O no hydrogen 2.809 N/A THR 96.A OG1 VAL 55.A O no hydrogen 3.466 N/A ALA 99.A N ASN 120.A O no hydrogen 2.891 N/A ILE 100.A N SER 57.A O no hydrogen 3.040 N/A ALA 101.A N GLN 122.A O no hydrogen 2.761 N/A GLY 103.A N ILE 100.A O no hydrogen 2.747 N/A PHE 105.A N ALA 101.A O no hydrogen 3.013 N/A LEU 106.A N MET 102.A O no hydrogen 2.855 N/A LEU 107.A N GLY 103.A O no hydrogen 2.955 N/A CYS 108.A N ALA 104.A O no hydrogen 2.996 N/A CYS 108.A SG ALA 104.A O no hydrogen 3.457 N/A SER 109.A N LEU 106.A O no hydrogen 2.917 N/A SER 109.A OG SER 81.A OG no hydrogen 2.841 N/A SER 109.A OG PHE 105.A O no hydrogen 2.686 N/A ASP 111.A N VAL 91.A O no hydrogen 2.747 N/A HIS 112.A N VAL 91.A O no hydrogen 3.217 N/A HIS 112.A NE2 GLU 172.A OE1 no hydrogen 2.740 N/A ARG 113.A N ASP 171.A OD2 no hydrogen 2.794 N/A ARG 113.A NE ASP 171.A OD2 no hydrogen 2.792 N/A ARG 113.A NH1 GLY 168.A O no hydrogen 2.831 N/A ARG 113.A NH2 GLY 168.A O no hydrogen 3.076 N/A ARG 113.A NH2 ASP 171.A OD1 no hydrogen 2.898 N/A ARG 113.A NH2 ASP 171.A OD2 no hydrogen 3.513 N/A VAL 114.A N ILE 93.A O no hydrogen 2.933 N/A ALA 115.A N GLU 172.A O no hydrogen 3.034 N/A TYR 119.A N ALA 116.A O no hydrogen 3.167 N/A VAL 121.A N PHE 159.A O no hydrogen 2.767 N/A GLN 122.A N ALA 99.A O no hydrogen 3.096 N/A GLN 122.A NE2 ALA 156.A O no hydrogen 2.869 N/A GLU 125.A N GLU 125.A OE1 no hydrogen 2.769 N/A ALA 127.A N ASN 124.A O no hydrogen 3.000 N/A ILE 128.A N ASN 124.A O no hydrogen 3.356 N/A ILE 128.A N GLU 125.A O no hydrogen 3.041 N/A GLY 129.A N VAL 126.A O no hydrogen 3.410 N/A MET 130.A N GLU 125.A O no hydrogen 2.917 N/A MET 137.A N PRO 133.A O no hydrogen 2.957 N/A GLU 138.A N TYR 134.A O no hydrogen 3.090 N/A VAL 139.A N ALA 135.A O no hydrogen 3.157 N/A LEU 140.A N ALA 136.A O no hydrogen 2.962 N/A LYS 141.A N MET 137.A O no hydrogen 2.831 N/A LEU 142.A N GLU 138.A O no hydrogen 3.024 N/A ARG 143.A N LEU 140.A O no hydrogen 3.069 N/A ARG 143.A NH1 GLY 110.A O no hydrogen 2.942 N/A ARG 143.A NH2 CYS 108.A O no hydrogen 2.827 N/A ARG 143.A NH2 GLY 110.A O no hydrogen 2.724 N/A LEU 144.A N LEU 140.A O no hydrogen 2.878 N/A THR 145.A N ALA 167.A O no hydrogen 2.856 N/A ALA 148.A N THR 145.A OG1 no hydrogen 3.074 N/A TYR 149.A N THR 145.A O no hydrogen 2.840 N/A GLN 150.A N PRO 146.A O no hydrogen 3.284 N/A GLN 151.A N SER 147.A O no hydrogen 3.252 N/A ALA 152.A N ALA 148.A O no hydrogen 2.754 N/A ALA 153.A N TYR 149.A O no hydrogen 3.117 N/A GLY 154.A N GLN 150.A O no hydrogen 2.922 N/A LEU 155.A N GLN 151.A O no hydrogen 3.007 N/A LYS 157.A N GLN 151.A O no hydrogen 3.298 N/A LYS 157.A NZ GLN 151.A OE1 no hydrogen 3.471 N/A PHE 159.A N VAL 121.A O no hydrogen 2.951 N/A PHE 160.A N THR 163.A OG1 no hydrogen 3.153 N/A THR 163.A N PHE 160.A O no hydrogen 3.079 N/A THR 163.A OG1 PHE 160.A O no hydrogen 3.027 N/A ALA 164.A N PHE 160.A O no hydrogen 3.320 N/A LEU 165.A N GLY 161.A O no hydrogen 2.952 N/A ALA 166.A N GLU 162.A O no hydrogen 2.901 N/A ALA 167.A N THR 163.A O no hydrogen 2.894 N/A GLY 168.A N ALA 164.A O no hydrogen 3.162 N/A GLY 168.A N LEU 165.A O no hydrogen 3.252 N/A PHE 169.A N ALA 164.A O no hydrogen 2.884 N/A ILE 170.A N ALA 164.A O no hydrogen 3.409 N/A ASP 171.A N ARG 113.A O no hydrogen 2.861 N/A GLU 172.A N ARG 113.A O no hydrogen 3.039 N/A SER 174.A N ALA 115.A O no hydrogen 2.835 N/A GLU 177.A N GLU 177.A OE1 no hydrogen 2.769 N/A VAL 178.A N LEU 175.A O no hydrogen 2.960 N/A VAL 179.A N PRO 176.A O no hydrogen 3.400 N/A SER 181.A OG VAL 178.A O no hydrogen 3.391 N/A ARG 182.A N VAL 178.A O no hydrogen 2.732 N/A ARG 182.A NE GLU 172.A OE1 no hydrogen 3.231 N/A ARG 182.A NE GLU 172.A OE2 no hydrogen 2.808 N/A ARG 182.A NH1 GLU 185.A OE1 no hydrogen 2.840 N/A ARG 182.A NH1 GLU 189.A OE1 no hydrogen 3.218 N/A ARG 182.A NH1 GLU 189.A OE2 no hydrogen 3.448 N/A ARG 182.A NH2 GLU 172.A OE1 no hydrogen 3.044 N/A ALA 183.A N VAL 179.A O no hydrogen 2.879 N/A GLU 184.A N LEU 180.A O no hydrogen 2.927 N/A GLU 185.A N SER 181.A O no hydrogen 2.918 N/A ALA 186.A N ARG 182.A O no hydrogen 2.811 N/A ALA 187.A N ALA 183.A O no hydrogen 2.944 N/A ARG 188.A N GLU 184.A O no hydrogen 2.977 N/A ARG 188.A NH2 ASP 8.A O no hydrogen 3.155 N/A GLU 189.A N GLU 185.A O no hydrogen 3.029 N/A PHE 190.A N ALA 186.A O no hydrogen 2.868 N/A ALA 191.A N ALA 187.A O no hydrogen 2.878 N/A GLY 192.A N GLU 189.A O no hydrogen 3.047 N/A LEU 193.A N PHE 190.A O no hydrogen 3.012 N/A GLN 195.A NE2 PRO 88.A O no hydrogen 3.030 N/A ALA 197.A N ASN 194.A OD1 no hydrogen 2.840 N/A HIS 198.A N ASN 194.A O no hydrogen 2.896 N/A ASN 199.A N GLN 195.A O no hydrogen 2.897 N/A ALA 200.A N GLN 196.A O no hydrogen 2.928 N/A THR 201.A N ALA 197.A O no hydrogen 2.930 N/A THR 201.A OG1 ALA 197.A O no hydrogen 2.723 N/A LYS 202.A N HIS 198.A O no hydrogen 2.848 N/A LYS 202.A NZ TYR 87.A O no hydrogen 2.797 N/A LYS 202.A NZ ASP 111.A OD1 no hydrogen 3.379 N/A LYS 202.A NZ ASP 111.A OD2 no hydrogen 2.916 N/A LYS 202.A NZ HIS 198.A NE2 no hydrogen 2.844 N/A LEU 203.A N ASN 199.A O no hydrogen 3.103 N/A ARG 204.A N ALA 200.A O no hydrogen 3.226 N/A ALA 205.A N THR 201.A O no hydrogen 2.941 N/A ARG 206.A N LEU 203.A O no hydrogen 3.124 N/A ARG 206.A NH1 LEU 85.A O no hydrogen 2.810 N/A ARG 206.A NH2 ASP 111.A OD1 no hydrogen 2.782 N/A LEU 210.A N ARG 206.A O no hydrogen 2.801 N/A LYS 211.A N ALA 207.A O no hydrogen 3.097 N/A ALA 212.A N GLU 208.A O no hydrogen 2.956 N/A ILE 213.A N ALA 209.A O no hydrogen 2.805 N/A ARG 214.A N LEU 210.A O no hydrogen 2.981 N/A ARG 214.A NH1 GLU 79.A OE1 no hydrogen 2.854 N/A ARG 214.A NH2 GLU 79.A OE1 no hydrogen 3.466 N/A ARG 214.A NH2 GLU 79.A OE2 no hydrogen 2.819 N/A ALA 215.A N LYS 211.A O no hydrogen 2.903 N/A GLY 216.A N ALA 212.A O no hydrogen 2.825 N/A ILE 217.A N ILE 213.A O no hydrogen 2.762 N/A ASP 218.A N ARG 214.A O no hydrogen 2.941 N/A GLY 219.A N ALA 215.A O no hydrogen 2.958 N/A ILE 220.A N ILE 217.A O no hydrogen 3.302 N/A GLU 223.A N ILE 220.A O no hydrogen 2.824 N/A PHE 224.A N ILE 220.A O no hydrogen 2.903 N/A