Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6nw2_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 3.A N LEU 61.A O no hydrogen 3.204 N/A MET 5.A N VAL 63.A O no hydrogen 2.954 N/A SER 7.A N GLU 66.A OE2 no hydrogen 2.883 N/A SER 7.A OG GLU 66.A OE1 no hydrogen 2.592 N/A SER 7.A OG GLU 66.A OE2 no hydrogen 3.526 N/A ASP 9.A N LYS 6.A O no hydrogen 3.015 N/A PHE 10.A N SER 7.A O no hydrogen 2.650 N/A SER 14.A N MET 26.A O no hydrogen 2.851 N/A ALA 16.A N MET 24.A O no hydrogen 2.605 N/A HIS 18.A N GLY 22.A O no hydrogen 2.743 N/A ARG 19.A N ASP 9.A O no hydrogen 2.686 N/A ARG 19.A NE ASP 9.A OD1 no hydrogen 3.253 N/A THR 20.A N HIS 18.A ND1 no hydrogen 3.013 N/A GLN 21.A N HIS 18.A ND1 no hydrogen 2.936 N/A GLY 22.A N HIS 18.A O no hydrogen 2.940 N/A MET 24.A N ALA 16.A O no hydrogen 2.799 N/A ILE 25.A N MET 74.A O no hydrogen 2.888 N/A MET 26.A N SER 14.A O no hydrogen 2.831 N/A LYS 27.A N LEU 72.A O no hydrogen 2.939 N/A THR 28.A N LYS 12.A O no hydrogen 3.168 N/A THR 28.A OG1 SER 71.A OG no hydrogen 3.046 N/A VAL 29.A N TYR 70.A O no hydrogen 2.702 N/A TYR 30.A N TYR 70.A O no hydrogen 3.350 N/A TYR 30.A OH PRO 33.A O no hydrogen 3.136 N/A TYR 30.A OH HIS 155.A O no hydrogen 2.660 N/A LYS 31.A N ASN 156.A OD1 no hydrogen 3.333 N/A GLY 32.A N GLY 68.A O no hydrogen 2.989 N/A ASN 34.A N ASN 34.A OD1 no hydrogen 2.208 N/A CYS 35.A SG GLU 153.A OE1 no hydrogen 3.376 N/A CYS 35.A SG GLU 153.A OE2 no hydrogen 3.199 N/A CYS 35.A SG HIS 155.A ND1 no hydrogen 2.365 N/A LEU 42.A N HIS 38.A O no hydrogen 2.753 N/A LEU 43.A N ASN 39.A O no hydrogen 2.982 N/A GLU 44.A N GLU 40.A O no hydrogen 2.896 N/A GLU 45.A N ALA 41.A O no hydrogen 2.993 N/A ALA 46.A N LEU 42.A O no hydrogen 3.189 N/A LYS 47.A N LEU 43.A O no hydrogen 2.922 N/A LYS 47.A NZ GLU 44.A OE1.A no hydrogen 2.670 N/A LYS 47.A NZ GLU 44.A OE2.B no hydrogen 3.258 N/A MET 48.A N GLU 44.A O no hydrogen 2.776 N/A MET 49.A N GLU 45.A O no hydrogen 2.881 N/A ASN 50.A N ALA 46.A O no hydrogen 2.838 N/A ASN 50.A ND2 LEU 60.A O no hydrogen 2.948 N/A ARG 51.A N LYS 47.A O no hydrogen 2.917 N/A ARG 51.A N MET 48.A O no hydrogen 3.140 N/A ARG 51.A NH2 GLU 44.A OE2.B no hydrogen 3.047 N/A LEU 52.A N MET 49.A O no hydrogen 3.220 N/A ARG 53.A N TYR 110.A OH no hydrogen 2.882 N/A ARG 53.A NE ASN 50.A O no hydrogen 3.138 N/A ARG 53.A NH2 ASN 1.A OD1 no hydrogen 3.136 N/A ARG 53.A NH2 ASN 50.A OD1 no hydrogen 3.201 N/A ARG 56.A N HIS 54.A ND1 no hydrogen 3.093 N/A VAL 57.A N HIS 54.A O no hydrogen 3.142 N/A VAL 58.A N ILE 136.A O no hydrogen 2.941 N/A LYS 59.A N GLU 75.A OE2 no hydrogen 2.824 N/A LEU 61.A N VAL 73.A O no hydrogen 2.793 N/A GLY 62.A N VAL 73.A O no hydrogen 3.099 N/A VAL 63.A N ILE 3.A O no hydrogen 3.044 N/A ILE 64.A N SER 71.A O no hydrogen 2.718 N/A GLU 66.A N LYS 69.A O no hydrogen 2.991 N/A LYS 69.A N GLU 66.A O no hydrogen 3.474 N/A LYS 69.A NZ SER 7.A OG no hydrogen 2.658 N/A TYR 70.A N TYR 30.A O no hydrogen 2.990 N/A TYR 70.A OH ASN 39.A OD1 no hydrogen 2.754 N/A SER 71.A N ILE 64.A O no hydrogen 2.793 N/A SER 71.A OG THR 28.A OG1 no hydrogen 3.046 N/A LEU 72.A N LYS 27.A O no hydrogen 2.798 N/A VAL 73.A N GLY 62.A O no hydrogen 2.811 N/A MET 74.A N ILE 25.A O no hydrogen 2.915 N/A GLU 75.A N LYS 59.A O no hydrogen 3.457 N/A GLU 78.A N GLU 78.A OE1 no hydrogen 2.428 N/A LYS 79.A N VAL 128.A O no hydrogen 3.084 N/A GLY 80.A N MET 77.A O no hydrogen 3.046 N/A LEU 82.A N PRO 123.A O no hydrogen 3.330 N/A HIS 84.A N ASN 81.A OD1 no hydrogen 2.942 N/A VAL 85.A N ASN 81.A O no hydrogen 3.191 N/A LEU 86.A N LEU 82.A O no hydrogen 2.906 N/A LYS 87.A N MET 83.A O no hydrogen 3.100 N/A ALA 88.A N VAL 85.A O no hydrogen 3.005 N/A LYS 97.A N PRO 93.A O no hydrogen 2.979 N/A LYS 97.A NZ ILE 187.A O no hydrogen 2.727 N/A LYS 97.A NZ ASN 190.A OD1 no hydrogen 2.750 N/A LYS 97.A NZ GLU 220.A OE1 no hydrogen 3.227 N/A LYS 97.A NZ GLU 220.A OE2 no hydrogen 2.743 N/A GLY 98.A N LEU 94.A O no hydrogen 2.913 N/A ARG 99.A N SER 95.A O no hydrogen 3.175 N/A ARG 99.A NH1 ASP 131.A O no hydrogen 2.818 N/A ARG 99.A NH1 PHE 132.A O no hydrogen 3.111 N/A ILE 100.A N VAL 96.A O no hydrogen 2.846 N/A ILE 101.A N LYS 97.A O no hydrogen 2.995 N/A LEU 102.A N GLY 98.A O no hydrogen 3.082 N/A GLU 103.A N ARG 99.A O no hydrogen 2.895 N/A ILE 104.A N ILE 100.A O no hydrogen 2.891 N/A ILE 105.A N ILE 101.A O no hydrogen 2.913 N/A GLU 106.A N LEU 102.A O no hydrogen 2.939 N/A GLY 107.A N GLU 103.A O no hydrogen 2.884 N/A MET 108.A N ILE 104.A O no hydrogen 2.902 N/A ALA 109.A N ILE 105.A O no hydrogen 2.791 N/A TYR 110.A N GLU 106.A O no hydrogen 2.931 N/A LEU 111.A N GLY 107.A O no hydrogen 3.020 N/A HIS 112.A N MET 108.A O no hydrogen 2.930 N/A HIS 112.A NE2 ASP 176.A OD2 no hydrogen 2.666 N/A GLY 113.A N ALA 109.A O no hydrogen 2.863 N/A LYS 114.A N TYR 110.A O no hydrogen 3.073 N/A LYS 114.A N LEU 111.A O no hydrogen 2.994 N/A GLY 115.A N HIS 112.A O no hydrogen 2.894 N/A VAL 116.A N LEU 111.A O no hydrogen 3.006 N/A HIS 118.A N ASP 176.A OD2 no hydrogen 2.755 N/A HIS 118.A NE2 ALA 137.A O no hydrogen 2.667 N/A LYS 119.A N ASP 176.A OD1 no hydrogen 2.905 N/A LYS 119.A NZ ILE 117.A O no hydrogen 3.175 N/A LYS 119.A NZ ALA 142.A O no hydrogen 3.426 N/A ASP 120.A N HIS 118.A ND1 no hydrogen 3.014 N/A LYS 122.A NZ ASP 120.A OD1 no hydrogen 3.490 N/A LYS 122.A NZ ASP 120.A OD2 no hydrogen 3.185 N/A LYS 122.A NZ THR 159.A OG1 no hydrogen 3.390 N/A ASN 125.A N LYS 122.A O no hydrogen 2.859 N/A ASN 125.A ND2 ASP 120.A O no hydrogen 2.845 N/A ILE 126.A N PRO 123.A O no hydrogen 3.059 N/A LEU 127.A N LYS 135.A O no hydrogen 2.809 N/A VAL 128.A N GLY 80.A O no hydrogen 2.881 N/A ASP 129.A N HIS 133.A O no hydrogen 2.849 N/A PHE 132.A N ASP 129.A O no hydrogen 3.053 N/A HIS 133.A N ASP 129.A OD1 no hydrogen 2.943 N/A HIS 133.A ND1 GLU 103.A OE2 no hydrogen 2.667 N/A ILE 134.A N GLU 103.A OE1 no hydrogen 2.954 N/A LYS 135.A N LEU 127.A O no hydrogen 2.812 N/A LYS 135.A NZ SER 55.A O no hydrogen 2.734 N/A ILE 136.A N ARG 56.A O no hydrogen 2.804 N/A ALA 137.A N ASN 125.A O no hydrogen 2.787 N/A LEU 139.A N ASN 125.A OD1 no hydrogen 2.843 N/A LEU 141.A N ASP 138.A O no hydrogen 3.038 N/A ALA 142.A N ASP 138.A OD1 no hydrogen 2.990 N/A SER 143.A N ASP 138.A OD2 no hydrogen 2.659 N/A PHE 144.A N LEU 141.A O no hydrogen 3.213 N/A MET 146.A N GLU 45.A OE2 no hydrogen 2.574 N/A TRP 147.A N GLU 45.A OE1 no hydrogen 2.991 N/A TRP 147.A NE1 LEU 42.A O no hydrogen 2.748 N/A SER 148.A N PHE 144.A O no hydrogen 2.673 N/A LYS 149.A N LYS 145.A O no hydrogen 2.952 N/A LEU 150.A N MET 146.A O no hydrogen 2.915 N/A ASN 151.A N TRP 147.A O no hydrogen 3.005 N/A ASN 151.A N SER 148.A O no hydrogen 3.083 N/A ASN 151.A ND2 ASN 152.A OD1 no hydrogen 3.613 N/A ASN 152.A N LYS 149.A O no hydrogen 3.229 N/A ASN 152.A ND2 SER 148.A O no hydrogen 3.131 N/A GLU 153.A N LEU 150.A O no hydrogen 3.303 N/A HIS 155.A N GLU 153.A OE1 no hydrogen 3.122 N/A ASN 156.A ND2 VAL 29.A O no hydrogen 3.193 N/A ASN 156.A ND2 LEU 150.A O no hydrogen 3.657 N/A ASN 156.A ND2 ASN 151.A O no hydrogen 2.924 N/A GLU 157.A N LYS 31.A O no hydrogen 3.191 N/A LEU 158.A N ASN 156.A OD1 no hydrogen 3.000 N/A TYR 162.A N THR 159.A O no hydrogen 3.382 N/A TYR 162.A OH GLU 192.A OE1 no hydrogen 2.243 N/A MET 163.A N LEU 160.A O no hydrogen 3.252 N/A GLU 166.A N GLU 166.A OE2 no hydrogen 2.799 N/A HIS 167.A N ALA 164.A O no hydrogen 2.947 N/A HIS 167.A NE2 SER 175.A OG no hydrogen 2.578 N/A LEU 168.A N PRO 165.A O no hydrogen 3.176 N/A THR 172.A N SER 175.A OG no hydrogen 3.016 N/A LYS 174.A N THR 172.A OG1 no hydrogen 2.984 N/A LYS 174.A NZ ARG 241.A O no hydrogen 2.741 N/A SER 175.A N THR 172.A O no hydrogen 2.946 N/A SER 175.A OG HIS 167.A NE2 no hydrogen 2.578 N/A SER 175.A OG THR 172.A O no hydrogen 3.348 N/A VAL 177.A N GLU 173.A O no hydrogen 3.113 N/A TYR 178.A N LYS 174.A O no hydrogen 3.114 N/A SER 179.A N SER 175.A O no hydrogen 3.190 N/A SER 179.A OG TYR 162.A O no hydrogen 2.679 N/A SER 179.A OG SER 175.A O no hydrogen 3.191 N/A PHE 180.A N ASP 176.A O no hydrogen 2.934 N/A ALA 181.A N VAL 177.A O no hydrogen 3.029 N/A VAL 182.A N TYR 178.A O no hydrogen 3.276 N/A VAL 183.A N SER 179.A O no hydrogen 3.028 N/A LEU 184.A N PHE 180.A O no hydrogen 2.841 N/A TRP 185.A N ALA 181.A O no hydrogen 3.210 N/A TRP 185.A NE1 ASP 214.A O no hydrogen 2.868 N/A ALA 186.A N VAL 182.A O no hydrogen 2.968 N/A ILE 187.A N VAL 183.A O no hydrogen 2.880 N/A PHE 188.A N LEU 184.A O no hydrogen 3.352 N/A PHE 188.A N TRP 185.A O no hydrogen 3.043 N/A ALA 189.A N TRP 185.A O no hydrogen 2.760 N/A ASN 190.A N ALA 186.A O no hydrogen 2.749 N/A ASN 190.A ND2 GLU 220.A OE1 no hydrogen 3.071 N/A LYS 191.A NZ GLU 195.A OE1 no hydrogen 2.778 N/A LYS 191.A NZ ASP 217.A OD2 no hydrogen 2.547 N/A ALA 197.A N TYR 194.A O no hydrogen 3.041 N/A ILE 198.A N GLN 202.A OE1 no hydrogen 2.674 N/A ALA 199.A N GLN 202.A OE1 no hydrogen 3.194 N/A LEU 203.A N ALA 199.A O no hydrogen 3.022 N/A ILE 204.A N GLU 200.A O no hydrogen 2.912 N/A MET 205.A N GLN 201.A O no hydrogen 3.106 N/A ALA 206.A N GLN 202.A O no hydrogen 2.972 N/A ILE 207.A N LEU 203.A O no hydrogen 2.884 N/A LYS 208.A N ILE 204.A O no hydrogen 2.928 N/A LYS 208.A NZ PRO 165.A O no hydrogen 3.495 N/A LYS 208.A NZ LEU 168.A O no hydrogen 2.928 N/A SER 209.A N MET 205.A O no hydrogen 3.006 N/A SER 209.A N ALA 206.A O no hydrogen 2.967 N/A SER 209.A OG ALA 206.A O no hydrogen 2.785 N/A GLY 210.A N ILE 207.A O no hydrogen 3.024 N/A ASN 211.A N ALA 206.A O no hydrogen 2.931 N/A ARG 212.A NE TRP 234.A O no hydrogen 2.858 N/A ARG 212.A NH1 ILE 207.A O no hydrogen 3.159 N/A ARG 212.A NH1 ASN 211.A O no hydrogen 2.861 N/A ARG 212.A NH2 TRP 234.A O no hydrogen 3.002 N/A ASP 216.A N ASP 214.A OD1 no hydrogen 2.993 N/A ASP 217.A N ASP 214.A O no hydrogen 2.977 N/A ILE 218.A N VAL 215.A O no hydrogen 3.185 N/A CYS 222.A SG PRO 223.A O no hydrogen 3.874 N/A GLU 225.A N GLU 225.A OE1 no hydrogen 2.747 N/A ILE 226.A N PRO 223.A O no hydrogen 2.882 N/A ILE 227.A N PRO 223.A O no hydrogen 3.064 N/A SER 228.A N ARG 224.A O no hydrogen 2.849 N/A SER 228.A OG ARG 224.A O no hydrogen 2.968 N/A LEU 229.A N GLU 225.A O no hydrogen 2.884 N/A MET 230.A N ILE 226.A O no hydrogen 2.955 N/A LYS 231.A N ILE 227.A O no hydrogen 3.179 N/A LEU 232.A N SER 228.A O no hydrogen 3.016 N/A CYS 233.A N LEU 229.A O no hydrogen 2.934 N/A CYS 233.A SG LEU 229.A O no hydrogen 3.300 N/A TRP 234.A N MET 230.A O no hydrogen 2.980 N/A GLU 235.A N LEU 232.A O no hydrogen 3.405 N/A GLU 239.A N ASN 237.A OD1 no hydrogen 3.026 N/A ALA 240.A N ASN 237.A O no hydrogen 2.903 N/A ARG 241.A N PRO 238.A O no hydrogen 3.077 N/A ARG 241.A NE GLU 235.A O no hydrogen 2.946 N/A ARG 241.A NH1 GLU 166.A OE1 no hydrogen 3.079 N/A ARG 241.A NH1 GLU 166.A OE2 no hydrogen 3.566 N/A ARG 241.A NH1 LYS 174.A O no hydrogen 2.954 N/A ARG 241.A NH2 GLU 166.A OE2 no hydrogen 2.654 N/A ARG 241.A NH2 GLU 235.A O no hydrogen 3.205 N/A GLY 246.A N THR 243.A OG1 no hydrogen 2.998 N/A ILE 247.A N THR 243.A O no hydrogen 2.801 N/A GLU 248.A N PHE 244.A O no hydrogen 2.819 N/A GLU 249.A N PRO 245.A O no hydrogen 3.143 N/A LYS 250.A N GLY 246.A O no hydrogen 3.310 N/A PHE 251.A N ILE 247.A O no hydrogen 2.776 N/A ARG 252.A N GLU 248.A O no hydrogen 2.801 N/A ARG 252.A NH2 GLU 106.A OE2 no hydrogen 2.793 N/A ARG 252.A NH2 GLU 248.A OE1 no hydrogen 2.842 N/A TYR 255.A N PHE 251.A O no hydrogen 2.783 N/A LEU 256.A N ARG 252.A O no hydrogen 2.992 N/A SER 257.A N PRO 253.A O no hydrogen 2.832 N/A GLN 258.A N PHE 254.A O no hydrogen 2.917 N/A LEU 259.A N TYR 255.A O no hydrogen 2.979 N/A GLU 260.A N TYR 255.A O no hydrogen 2.821 N/A