Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6dgq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 4.A N GLU 1.A O no hydrogen 3.328 N/A ARG 6.A N SER 2.A O no hydrogen 3.072 N/A ALA 7.A N ALA 3.A O no hydrogen 3.305 N/A LEU 8.A N ASP 4.A O no hydrogen 2.964 N/A ALA 9.A N LEU 5.A O no hydrogen 2.812 N/A LYS 10.A N ARG 6.A O no hydrogen 2.882 N/A HIS 11.A N ALA 7.A O no hydrogen 2.945 N/A HIS 11.A NE2 SER 84.A O no hydrogen 2.757 N/A LEU 12.A N LEU 8.A O no hydrogen 3.006 N/A TYR 13.A N ALA 9.A O no hydrogen 3.017 N/A ASP 14.A N LYS 10.A O no hydrogen 3.131 N/A SER 15.A N HIS 11.A O no hydrogen 3.075 N/A SER 15.A OG HIS 11.A O no hydrogen 3.387 N/A SER 15.A OG LEU 12.A O no hydrogen 3.293 N/A SER 15.A OG SER 84.A OG no hydrogen 2.830 N/A TYR 16.A N LEU 12.A O no hydrogen 2.864 N/A TYR 16.A OH ASP 162.A OD1 no hydrogen 2.473 N/A ILE 17.A N TYR 13.A O no hydrogen 2.941 N/A LYS 18.A N ASP 14.A O no hydrogen 3.135 N/A LYS 18.A NZ ASP 14.A OD1 no hydrogen 3.402 N/A LYS 18.A NZ ASP 14.A OD2 no hydrogen 2.538 N/A SER 19.A N SER 15.A O no hydrogen 2.750 N/A SER 19.A N TYR 16.A O no hydrogen 3.085 N/A SER 19.A OG SER 15.A O no hydrogen 2.570 N/A PHE 20.A N TYR 16.A O no hydrogen 2.874 N/A LYS 24.A N ASP 162.A OD1 no hydrogen 2.953 N/A LYS 24.A NZ LEU 160.A O no hydrogen 2.709 N/A ALA 25.A N ASP 162.A OD2 no hydrogen 2.983 N/A LYS 26.A N THR 23.A OG1 no hydrogen 3.151 N/A ALA 27.A N THR 23.A O no hydrogen 2.879 N/A ARG 28.A N LYS 24.A O no hydrogen 2.750 N/A ARG 28.A NH1 SER 114.A O no hydrogen 3.259 N/A ARG 28.A NH1 MET 116.A O no hydrogen 2.734 N/A ARG 28.A NH2 MET 116.A O no hydrogen 3.487 N/A ALA 29.A N ALA 25.A O no hydrogen 3.114 N/A ILE 30.A N LYS 26.A O no hydrogen 2.910 N/A LEU 31.A N ALA 27.A O no hydrogen 2.967 N/A THR 32.A N ARG 28.A O no hydrogen 3.166 N/A THR 32.A OG1 ARG 28.A O no hydrogen 2.906 N/A LYS 34.A N ALA 29.A O no hydrogen 3.201 N/A THR 36.A OG1 ASP 37.A OD2 no hydrogen 3.005 N/A PHE 41.A N GLN 127.A O no hydrogen 3.142 N/A ILE 43.A N PHE 129.A O no hydrogen 2.673 N/A TYR 44.A N SER 48.A OG no hydrogen 2.957 N/A ASP 45.A N SER 48.A OG no hydrogen 2.763 N/A SER 48.A N ASP 45.A OD1 no hydrogen 2.816 N/A SER 48.A OG ASP 45.A O no hydrogen 2.583 N/A SER 48.A OG ASP 45.A OD1 no hydrogen 2.652 N/A LEU 49.A N ASP 45.A O no hydrogen 2.788 N/A MET 50.A N MET 46.A O no hydrogen 3.036 N/A MET 50.A N ASN 47.A O no hydrogen 2.985 N/A MET 51.A N ASN 47.A O no hydrogen 2.993 N/A GLY 52.A N SER 48.A O no hydrogen 3.120 N/A GLU 53.A N MET 50.A O no hydrogen 3.437 N/A ASP 54.A N MET 51.A O no hydrogen 3.110 N/A LYS 55.A NZ MET 51.A O no hydrogen 2.938 N/A ARG 62.A N GLU 58.A O no hydrogen 3.254 N/A ILE 63.A N VAL 59.A O no hydrogen 2.939 N/A PHE 64.A N ALA 60.A O no hydrogen 3.010 N/A GLN 65.A N ILE 61.A O no hydrogen 2.994 N/A GLY 66.A N ARG 62.A O no hydrogen 2.897 N/A CYS 67.A N ILE 63.A O no hydrogen 2.988 N/A CYS 67.A SG ILE 63.A O no hydrogen 3.413 N/A GLN 68.A N PHE 64.A O no hydrogen 3.036 N/A GLN 68.A NE2 SER 245.A O no hydrogen 3.303 N/A PHE 69.A N GLN 65.A O no hydrogen 2.780 N/A ARG 70.A N GLY 66.A O no hydrogen 2.931 N/A ARG 70.A NH1 GLU 77.A OE1 no hydrogen 3.080 N/A SER 71.A N CYS 67.A O no hydrogen 3.078 N/A VAL 72.A N GLN 68.A O no hydrogen 2.808 N/A GLU 73.A N PHE 69.A O no hydrogen 2.896 N/A ALA 74.A N ARG 70.A O no hydrogen 2.733 N/A VAL 75.A N SER 71.A O no hydrogen 2.734 N/A GLN 76.A N VAL 72.A O no hydrogen 3.425 N/A GLN 76.A NE2 GLU 73.A O no hydrogen 3.567 N/A GLU 77.A N GLU 73.A O no hydrogen 3.109 N/A ILE 78.A N ALA 74.A O no hydrogen 2.642 N/A THR 79.A N VAL 75.A O no hydrogen 2.814 N/A THR 79.A OG1 VAL 75.A O no hydrogen 2.683 N/A GLU 80.A N GLN 76.A O no hydrogen 2.941 N/A TYR 81.A N GLU 77.A O no hydrogen 2.944 N/A TYR 81.A OH ALA 166.A O no hydrogen 2.550 N/A ALA 82.A N ILE 78.A O no hydrogen 2.733 N/A LYS 83.A N THR 79.A O no hydrogen 3.219 N/A SER 84.A N TYR 81.A O no hydrogen 2.950 N/A SER 84.A OG SER 15.A OG no hydrogen 2.830 N/A SER 84.A OG TYR 81.A O no hydrogen 2.791 N/A ILE 85.A N ALA 82.A O no hydrogen 2.747 N/A PHE 88.A N ILE 85.A O no hydrogen 2.968 N/A ASN 90.A N GLY 87.A O no hydrogen 2.980 N/A LEU 91.A N PHE 88.A O no hydrogen 3.159 N/A ASN 94.A N ASP 92.A OD2 no hydrogen 2.967 N/A GLN 96.A N ASP 92.A O no hydrogen 2.970 N/A GLN 96.A NE2 VAL 89.A O no hydrogen 2.914 N/A GLN 96.A NE2 LEU 91.A O no hydrogen 2.795 N/A VAL 97.A N LEU 93.A O no hydrogen 2.865 N/A THR 98.A N ASN 94.A O no hydrogen 2.720 N/A THR 98.A OG1 ASN 94.A O no hydrogen 3.337 N/A LEU 99.A N ASP 95.A O no hydrogen 2.715 N/A LEU 100.A N GLN 96.A O no hydrogen 3.155 N/A LYS 101.A N VAL 97.A O no hydrogen 2.952 N/A LYS 101.A NZ GLU 252.A O no hydrogen 3.093 N/A LYS 101.A NZ ILE 253.A O no hydrogen 2.938 N/A TYR 102.A N THR 98.A O no hydrogen 3.186 N/A GLY 103.A N LEU 99.A O no hydrogen 2.819 N/A GLY 103.A N LEU 100.A O no hydrogen 3.148 N/A VAL 104.A N LEU 100.A O no hydrogen 2.919 N/A ILE 107.A N GLY 103.A O no hydrogen 3.021 N/A ILE 108.A N VAL 104.A O no hydrogen 2.899 N/A TYR 109.A N HIS 105.A O no hydrogen 2.930 N/A THR 110.A N GLU 106.A O no hydrogen 3.043 N/A THR 110.A OG1 GLU 106.A O no hydrogen 2.955 N/A MET 111.A N ILE 107.A O no hydrogen 2.886 N/A LEU 112.A N ILE 108.A O no hydrogen 2.767 N/A ALA 113.A N TYR 109.A O no hydrogen 3.326 N/A LEU 115.A N LEU 112.A O no hydrogen 2.789 N/A MET 116.A N ALA 113.A O no hydrogen 2.925 N/A ASN 117.A N GLY 120.A O no hydrogen 3.017 N/A LYS 118.A NZ ASP 119.A OD1 no hydrogen 2.626 N/A ASP 119.A N ASN 117.A OD1 no hydrogen 2.751 N/A GLY 120.A N ASN 117.A O no hydrogen 3.423 N/A GLY 120.A N ASN 117.A OD1 no hydrogen 2.915 N/A VAL 121.A N MET 130.A O no hydrogen 3.158 N/A LEU 122.A N LEU 115.A O no hydrogen 3.000 N/A ILE 123.A N GLY 128.A O no hydrogen 3.050 N/A GLY 126.A N ILE 123.A O no hydrogen 2.928 N/A GLN 127.A N SER 124.A O no hydrogen 3.082 N/A GLN 127.A NE2 SER 124.A O no hydrogen 3.286 N/A GLY 128.A N ILE 123.A O no hydrogen 3.275 N/A PHE 129.A N PHE 41.A O no hydrogen 2.876 N/A MET 130.A N VAL 121.A O no hydrogen 2.970 N/A THR 131.A N ILE 43.A O no hydrogen 3.069 N/A ARG 132.A N ASP 119.A O no hydrogen 2.697 N/A ARG 132.A NE GLU 146.A OE1 no hydrogen 2.935 N/A ARG 132.A NE GLU 146.A OE2 no hydrogen 3.552 N/A ARG 132.A NH1 LYS 118.A O no hydrogen 3.312 N/A ARG 132.A NH2 GLU 146.A OE1 no hydrogen 2.625 N/A PHE 134.A N THR 131.A OG1 no hydrogen 3.127 N/A LEU 135.A N THR 131.A O no hydrogen 3.198 N/A LYS 136.A N ARG 132.A O no hydrogen 2.959 N/A LYS 136.A N GLU 133.A O no hydrogen 3.031 N/A LYS 136.A NZ GLU 133.A OE2 no hydrogen 3.064 N/A SER 137.A N GLU 133.A O no hydrogen 3.011 N/A SER 137.A N PHE 134.A O no hydrogen 3.150 N/A SER 137.A OG PHE 134.A O no hydrogen 2.790 N/A PHE 144.A N PHE 141.A O no hydrogen 3.380 N/A GLU 146.A N ASP 143.A O no hydrogen 3.374 N/A LYS 148.A NZ PHE 144.A O no hydrogen 2.959 N/A LYS 148.A NZ HIS 230.A ND1 no hydrogen 2.903 N/A PHE 149.A N MET 145.A O no hydrogen 3.141 N/A GLU 150.A N GLU 146.A O no hydrogen 2.960 N/A PHE 151.A N PRO 147.A O no hydrogen 3.026 N/A ALA 152.A N LYS 148.A O no hydrogen 2.813 N/A VAL 153.A N PHE 149.A O no hydrogen 3.066 N/A PHE 155.A N PHE 151.A O no hydrogen 2.748 N/A ASN 156.A N ALA 152.A O no hydrogen 2.746 N/A ASN 156.A ND2 ALA 113.A O no hydrogen 3.239 N/A ASN 156.A ND2 MET 116.A O no hydrogen 2.857 N/A ALA 157.A N LYS 154.A O no hydrogen 3.200 N/A LEU 158.A N PHE 155.A O no hydrogen 2.926 N/A GLU 159.A N ASN 156.A O no hydrogen 2.891 N/A ASP 161.A N ASP 164.A OD2 no hydrogen 3.011 N/A SER 163.A OG ASP 161.A OD1 no hydrogen 2.710 N/A SER 163.A OG GLN 201.A OE1 no hydrogen 3.514 N/A ASP 164.A N ASP 161.A OD1 no hydrogen 3.085 N/A LEU 165.A N ASP 161.A O no hydrogen 2.928 N/A ALA 166.A N ASP 162.A O no hydrogen 2.884 N/A ILE 167.A N ASP 164.A O no hydrogen 3.265 N/A PHE 168.A N ASP 164.A O no hydrogen 3.223 N/A ILE 169.A N LEU 165.A O no hydrogen 2.811 N/A ALA 170.A N ALA 166.A O no hydrogen 3.262 N/A VAL 171.A N ILE 167.A O no hydrogen 2.840 N/A ILE 172.A N PHE 168.A O no hydrogen 2.965 N/A ILE 173.A N ILE 169.A O no hydrogen 3.282 N/A LEU 174.A N ALA 170.A O no hydrogen 3.154 N/A SER 175.A N ILE 173.A O no hydrogen 2.838 N/A SER 175.A OG ILE 172.A O no hydrogen 2.953 N/A ARG 178.A NH1 GLU 106.A OE1 no hydrogen 3.557 N/A ARG 178.A NH1 GLU 106.A OE2 no hydrogen 3.049 N/A ARG 178.A NH2 GLU 106.A OE1 no hydrogen 2.758 N/A ARG 178.A NH2 ILE 172.A O no hydrogen 3.108 N/A LEU 182.A N ASP 95.A OD2 no hydrogen 2.645 N/A ASN 183.A N ASP 95.A OD1 no hydrogen 2.831 N/A GLU 188.A N VAL 184.A O no hydrogen 2.935 N/A ASP 189.A N LYS 185.A O no hydrogen 2.965 N/A ILE 190.A N PRO 186.A O no hydrogen 3.391 N/A GLN 191.A N ILE 187.A O no hydrogen 3.077 N/A ASP 192.A N GLU 188.A O no hydrogen 2.888 N/A ASN 193.A N ASP 189.A O no hydrogen 3.475 N/A LEU 194.A N ILE 190.A O no hydrogen 2.967 N/A LEU 195.A N GLN 191.A O no hydrogen 2.611 N/A GLN 196.A N ASP 192.A O no hydrogen 2.969 N/A ALA 197.A N ASN 193.A O no hydrogen 2.900 N/A LEU 198.A N LEU 194.A O no hydrogen 2.862 N/A GLU 199.A N LEU 195.A O no hydrogen 2.831 N/A LEU 200.A N GLN 196.A O no hydrogen 2.949 N/A GLN 201.A N ALA 197.A O no hydrogen 2.869 N/A LEU 202.A N LEU 198.A O no hydrogen 2.965 N/A LYS 203.A N GLU 199.A O no hydrogen 3.102 N/A LEU 204.A N LEU 200.A O no hydrogen 2.886 N/A ASN 205.A N GLN 201.A O no hydrogen 2.664 N/A ASN 205.A ND2 ASP 161.A OD2 no hydrogen 2.965 N/A ASN 205.A ND2 ASP 164.A OD1 no hydrogen 3.079 N/A ASN 205.A ND2 ASP 164.A OD2 no hydrogen 3.086 N/A HIS 206.A N LEU 202.A O no hydrogen 2.795 N/A HIS 206.A NE2 ASP 164.A OD2 no hydrogen 2.788 N/A SER 209.A N HIS 206.A O no hydrogen 2.874 N/A LEU 212.A N SER 209.A O no hydrogen 3.313 N/A LYS 215.A N GLN 211.A O no hydrogen 3.024 N/A LEU 216.A N LEU 212.A O no hydrogen 2.807 N/A LEU 217.A N PHE 213.A O no hydrogen 2.992 N/A GLN 218.A N ALA 214.A O no hydrogen 2.847 N/A LYS 219.A N LYS 215.A O no hydrogen 3.260 N/A MET 220.A N LEU 217.A O no hydrogen 3.124 N/A THR 221.A N GLN 218.A O no hydrogen 3.059 N/A LEU 223.A N LYS 219.A O no hydrogen 3.257 N/A ARG 224.A N MET 220.A O no hydrogen 3.161 N/A ARG 224.A NE GLU 106.A OE2 no hydrogen 2.980 N/A GLN 225.A N THR 221.A O no hydrogen 3.005 N/A ILE 226.A N ASP 222.A O no hydrogen 2.872 N/A VAL 227.A N LEU 223.A O no hydrogen 3.048 N/A THR 228.A N ARG 224.A O no hydrogen 3.000 N/A THR 228.A OG1 ARG 224.A O no hydrogen 3.435 N/A THR 228.A OG1 GLN 225.A O no hydrogen 3.399 N/A GLU 229.A N GLN 225.A O no hydrogen 2.928 N/A HIS 230.A N ILE 226.A O no hydrogen 2.753 N/A VAL 231.A N VAL 227.A O no hydrogen 2.880 N/A GLN 232.A N THR 228.A O no hydrogen 3.283 N/A LEU 233.A N GLU 229.A O no hydrogen 2.937 N/A LEU 234.A N HIS 230.A O no hydrogen 2.690 N/A GLN 235.A N VAL 231.A O no hydrogen 2.998 N/A VAL 236.A N GLN 232.A O no hydrogen 3.198 N/A ILE 237.A N LEU 233.A O no hydrogen 3.032 N/A LYS 238.A N LEU 234.A O no hydrogen 3.104 N/A LYS 239.A N GLN 235.A O no hydrogen 3.208 N/A THR 240.A N VAL 236.A O no hydrogen 3.038 N/A THR 240.A OG1 ILE 237.A O no hydrogen 3.521 N/A THR 240.A OG1 GLU 241.A OE2 no hydrogen 2.423 N/A GLU 241.A N ILE 237.A O no hydrogen 3.030 N/A ASP 243.A N ASP 243.A OD1 no hydrogen 2.599 N/A MET 244.A N GLU 241.A O no hydrogen 3.379 N/A HIS 247.A N GLN 68.A OE1 no hydrogen 2.980 N/A LEU 249.A N HIS 247.A ND1 no hydrogen 2.969 N/A GLN 251.A N HIS 247.A O no hydrogen 2.890 N/A GLU 252.A N PRO 248.A O no hydrogen 2.970 N/A ILE 253.A N LEU 249.A O no hydrogen 3.092 N/A TYR 254.A N LEU 250.A O no hydrogen 2.831 N/A LYS 255.A N ILE 253.A O no hydrogen 2.839 N/A