Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3c1u_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 2.A N ASP 65.A OD1 no hydrogen 2.956 N/A VAL 3.A N THR 34.A O no hydrogen 2.746 N/A TYR 4.A N TYR 66.A O no hydrogen 2.878 N/A LEU 5.A N VAL 36.A O no hydrogen 2.927 N/A ALA 6.A N ILE 68.A O no hydrogen 2.902 N/A SER 9.A OG HIS 193.A ND1 no hydrogen 2.728 N/A THR 10.A N ASP 8.A OD1 no hydrogen 2.882 N/A THR 10.A OG1 ASP 8.A OD1 no hydrogen 2.624 N/A MET 11.A N ASP 8.A O no hydrogen 2.971 N/A ALA 12.A N ASP 8.A O no hydrogen 2.920 N/A LYS 13.A NZ GLU 25.A OE1 no hydrogen 3.434 N/A ASN 14.A N ASN 21.A OD1 no hydrogen 2.802 N/A GLY 15.A N ALA 12.A O no hydrogen 2.937 N/A GLY 16.A N THR 20.A OG1 no hydrogen 2.837 N/A GLY 17.A N ASN 14.A O no hydrogen 2.951 N/A THR 20.A N GLY 17.A O no hydrogen 3.141 N/A THR 20.A OG1 GLY 17.A O no hydrogen 2.709 N/A ASN 21.A N THR 194.A O no hydrogen 2.946 N/A ASN 21.A ND2 TYR 26.A OH no hydrogen 2.975 N/A TRP 23.A N THR 10.A O no hydrogen 2.857 N/A TRP 23.A NE1 GLU 70.A OE2 no hydrogen 2.837 N/A GLY 24.A N MET 11.A O no hydrogen 2.975 N/A GLU 25.A N GLY 22.A O no hydrogen 3.172 N/A TYR 26.A N TRP 23.A O no hydrogen 3.094 N/A TYR 30.A N LEU 27.A O no hydrogen 2.927 N/A LEU 31.A N ALA 28.A O no hydrogen 3.277 N/A SER 32.A N.A VAL 220.A O no hydrogen 2.803 N/A SER 32.A N.B VAL 220.A O no hydrogen 2.739 N/A SER 32.A OG.A VAL 220.A O no hydrogen 3.398 N/A SER 32.A OG.B VAL 220.A O no hydrogen 3.499 N/A THR 34.A N THR 1.A O no hydrogen 2.988 N/A VAL 36.A N VAL 3.A O no hydrogen 2.903 N/A ASN 37.A ND2 MET 11.A O no hydrogen 2.982 N/A ASN 37.A ND2 GLU 25.A OE2 no hydrogen 2.965 N/A ASP 38.A N LEU 5.A O no hydrogen 2.861 N/A ALA 39.A N ASN 37.A OD1 no hydrogen 3.066 N/A VAL 40.A N GLY 7.A O no hydrogen 2.988 N/A ARG 43.A N VAL 40.A O no hydrogen 3.377 N/A ARG 43.A NE GLU 51.A OE1 no hydrogen 2.779 N/A ARG 43.A NH1 ALA 41.A O no hydrogen 2.873 N/A ARG 43.A NH2 GLU 51.A OE1 no hydrogen 3.465 N/A SER 44.A N SER 47.A OG no hydrogen 3.043 N/A SER 44.A OG ARG 83.A O no hydrogen 2.689 N/A ALA 45.A N ASP 75.A OD2 no hydrogen 2.835 N/A ARG 46.A N ASP 85.A OD1 no hydrogen 3.216 N/A ARG 46.A NE GLU 103.A OE2 no hydrogen 2.871 N/A ARG 46.A NH1 ASP 80.A OD1 no hydrogen 2.797 N/A ARG 46.A NH1 THR 84.A O no hydrogen 2.976 N/A ARG 46.A NH2 ASP 80.A OD1 no hydrogen 3.441 N/A ARG 46.A NH2 ASP 80.A OD2 no hydrogen 2.954 N/A ARG 46.A NH2 GLU 103.A OE1 no hydrogen 2.906 N/A SER 47.A N SER 44.A OG no hydrogen 3.010 N/A TYR 48.A N SER 44.A O no hydrogen 2.852 N/A TYR 48.A OH ASP 38.A O no hydrogen 2.763 N/A THR 49.A N ALA 45.A O no hydrogen 3.161 N/A THR 49.A OG1 ALA 45.A O no hydrogen 2.726 N/A ARG 50.A N ARG 46.A O no hydrogen 2.919 N/A ARG 50.A NH1 GLY 82.A O no hydrogen 2.865 N/A ARG 50.A NH1 GLU 103.A OE1 no hydrogen 3.137 N/A ARG 50.A NH1 GLU 103.A OE2 no hydrogen 3.266 N/A ARG 50.A NH2 GLY 82.A O no hydrogen 3.145 N/A GLU 51.A N SER 47.A O no hydrogen 2.923 N/A GLY 52.A N THR 49.A O no hydrogen 2.937 N/A ARG 53.A N TYR 48.A O no hydrogen 3.048 N/A ARG 53.A NE GLU 51.A OE1 no hydrogen 2.754 N/A ARG 53.A NH2 GLU 51.A OE1 no hydrogen 3.530 N/A ASN 56.A N GLY 52.A O no hydrogen 2.851 N/A ILE 57.A N ARG 53.A O no hydrogen 3.358 N/A ALA 58.A N PHE 54.A O no hydrogen 2.906 N/A ASP 59.A N GLU 55.A O no hydrogen 2.972 N/A VAL 60.A N ILE 57.A O no hydrogen 3.057 N/A VAL 61.A N ILE 57.A O no hydrogen 2.954 N/A THR 62.A N ASP 65.A OD2 no hydrogen 2.856 N/A GLY 64.A N GLY 123.A O no hydrogen 2.955 N/A ASP 65.A N THR 62.A O no hydrogen 2.937 N/A TYR 66.A N THR 2.A O no hydrogen 2.996 N/A VAL 67.A N LYS 125.A O no hydrogen 2.916 N/A ILE 68.A N TYR 4.A O no hydrogen 2.863 N/A VAL 69.A N ILE 127.A O no hydrogen 2.940 N/A GLU 70.A N ALA 6.A O no hydrogen 2.961 N/A HIS 73.A NE2 THR 132.A OG1 no hydrogen 2.846 N/A ASN 74.A ND2 ARG 43.A O no hydrogen 2.920 N/A ASP 75.A N GLY 72.A O no hydrogen 3.163 N/A ASP 80.A N THR 79.A OG1 no hydrogen 2.687 N/A GLY 82.A N ASP 80.A OD1 no hydrogen 2.835 N/A ARG 83.A N ASN 81.A OD1 no hydrogen 2.804 N/A ARG 83.A NE ASN 81.A O no hydrogen 2.901 N/A ARG 83.A NH1 GLY 42.A O no hydrogen 2.957 N/A ARG 83.A NH2 ASN 81.A O no hydrogen 3.220 N/A THR 84.A N ASN 81.A OD1 no hydrogen 3.036 N/A THR 84.A OG1 GLY 76.A O no hydrogen 2.624 N/A THR 84.A OG1 ASN 81.A OD1 no hydrogen 3.244 N/A ASP 85.A N ASP 75.A O no hydrogen 3.231 N/A CYS 86.A N LEU 106.A O no hydrogen 2.897 N/A CYS 86.A SG SER 87.A O no hydrogen 3.850 N/A GLY 90.A N GLU 92.A OE1 no hydrogen 2.978 N/A GLU 92.A N GLU 92.A OE1 no hydrogen 2.910 N/A CYS 94.A N ILE 105.A O no hydrogen 2.884 N/A SER 96.A N GLU 103.A O no hydrogen 3.168 N/A SER 96.A OG ASP 80.A OD2 no hydrogen 2.632 N/A TYR 98.A N VAL 101.A O no hydrogen 2.873 N/A VAL 101.A N TYR 98.A O no hydrogen 3.150 N/A GLU 103.A N SER 96.A O no hydrogen 2.822 N/A ILE 105.A N CYS 94.A O no hydrogen 2.800 N/A LEU 106.A N TYR 111.A OH no hydrogen 2.991 N/A THR 107.A OG1 GLY 90.A O no hydrogen 2.801 N/A ALA 110.A N THR 107.A OG1 no hydrogen 3.153 N/A TYR 111.A N THR 107.A O no hydrogen 3.018 N/A LEU 112.A N PHE 108.A O no hydrogen 3.162 N/A GLU 113.A N PRO 109.A O no hydrogen 2.782 N/A ASN 114.A N ALA 110.A O no hydrogen 2.882 N/A ALA 115.A N TYR 111.A O no hydrogen 3.075 N/A ALA 116.A N LEU 112.A O no hydrogen 2.895 N/A LYS 117.A N GLU 113.A O no hydrogen 2.952 N/A LEU 118.A N ASN 114.A O no hydrogen 3.098 N/A PHE 119.A N ALA 115.A O no hydrogen 3.017 N/A THR 120.A N ALA 116.A O no hydrogen 2.859 N/A THR 120.A OG1 ALA 116.A O no hydrogen 2.969 N/A ALA 121.A N LYS 117.A O no hydrogen 3.011 N/A LYS 122.A N PHE 119.A O no hydrogen 2.993 N/A GLY 123.A N THR 120.A O no hydrogen 2.973 N/A ALA 124.A N PHE 119.A O no hydrogen 3.079 N/A LYS 125.A N ASP 65.A O no hydrogen 2.850 N/A ILE 127.A N VAL 67.A O no hydrogen 2.906 N/A LEU 128.A N GLU 163.A O no hydrogen 2.873 N/A SER 129.A N VAL 69.A O no hydrogen 2.909 N/A SER 129.A OG GLU 70.A OE1 no hydrogen 2.740 N/A SER 130.A N VAL 165.A O no hydrogen 3.092 N/A SER 130.A OG TYR 164.A OH no hydrogen 3.254 N/A SER 130.A OG ASP 166.A OD1 no hydrogen 2.922 N/A GLN 131.A NE2 THR 132.A O no hydrogen 2.962 N/A THR 132.A OG1 HIS 73.A NE2 no hydrogen 2.846 N/A ASN 135.A N HIS 191.A O no hydrogen 2.902 N/A ASN 135.A ND2 ASN 184.A OD1 no hydrogen 2.879 N/A TRP 137.A N ASN 135.A OD1 no hydrogen 2.914 N/A TRP 137.A NE1 TYR 175.A O no hydrogen 2.960 N/A THR 139.A OG1 THR 141.A O no hydrogen 3.137 N/A GLY 140.A N TRP 137.A O no hydrogen 2.951 N/A THR 141.A N THR 139.A OG1 no hydrogen 3.267 N/A VAL 143.A N PRO 136.A O no hydrogen 2.968 N/A THR 147.A OG1 GLN 131.A OE1 no hydrogen 2.758 N/A PHE 149.A N THR 147.A OG1 no hydrogen 3.178 N/A VAL 150.A N THR 147.A O no hydrogen 3.183 N/A TYR 152.A N ARG 148.A O no hydrogen 3.132 N/A ALA 153.A N PHE 149.A O no hydrogen 3.107 N/A ALA 153.A N VAL 150.A O no hydrogen 3.169 N/A LEU 155.A N GLU 151.A O no hydrogen 2.961 N/A ALA 156.A N TYR 152.A O no hydrogen 2.937 N/A ALA 157.A N ALA 153.A O no hydrogen 2.998 N/A GLU 158.A N GLU 154.A O no hydrogen 3.028 N/A VAL 159.A N LEU 155.A O no hydrogen 2.924 N/A ALA 160.A N ALA 156.A O no hydrogen 2.942 N/A GLY 161.A N GLU 158.A O no hydrogen 3.419 N/A VAL 162.A N ALA 157.A O no hydrogen 2.978 N/A GLU 163.A N VAL 126.A O no hydrogen 3.283 N/A VAL 165.A N LEU 128.A O no hydrogen 2.989 N/A HIS 167.A N VAL 165.A O no hydrogen 2.995 N/A HIS 167.A ND1 GLU 70.A OE1 no hydrogen 2.622 N/A HIS 167.A NE2 VAL 202.A O no hydrogen 2.732 N/A TRP 168.A N SER 130.A OG no hydrogen 2.977 N/A TRP 168.A NE1 ASN 144.A OD1 no hydrogen 2.963 N/A SER 169.A N ASP 166.A OD1 no hydrogen 3.069 N/A SER 169.A OG ASP 166.A OD1 no hydrogen 3.363 N/A SER 169.A OG ASP 166.A OD2 no hydrogen 2.690 N/A TYR 170.A N ASP 166.A O no hydrogen 3.360 N/A VAL 171.A N HIS 167.A O no hydrogen 2.975 N/A ASP 172.A N TRP 168.A O no hydrogen 2.912 N/A SER 173.A N SER 169.A O no hydrogen 2.905 N/A ILE 174.A N TYR 170.A O no hydrogen 3.228 N/A TYR 175.A N VAL 171.A O no hydrogen 2.860 N/A GLU 176.A N ASP 172.A O no hydrogen 2.926 N/A THR 177.A N SER 173.A O no hydrogen 3.229 N/A THR 177.A OG1 SER 173.A O no hydrogen 3.318 N/A LEU 178.A N ILE 174.A O no hydrogen 2.805 N/A GLY 179.A N TYR 175.A O no hydrogen 3.045 N/A VAL 183.A N GLY 179.A O no hydrogen 2.968 N/A ASN 184.A N ASN 180.A O no hydrogen 3.034 N/A ASN 184.A ND2 TRP 137.A O no hydrogen 3.071 N/A ASN 184.A ND2 ASN 180.A O no hydrogen 3.012 N/A SER 185.A N ALA 181.A O no hydrogen 3.159 N/A SER 185.A OG THR 182.A O no hydrogen 2.645 N/A TYR 186.A N VAL 183.A O no hydrogen 2.926 N/A PHE 187.A N ASN 184.A O no hydrogen 3.073 N/A HIS 191.A ND1 GLU 138.A OE1 no hydrogen 2.880 N/A THR 192.A N ASN 190.A OD1 no hydrogen 2.859 N/A THR 192.A OG1 ASN 134.A OD1 no hydrogen 2.747 N/A HIS 193.A N ASN 190.A OD1 no hydrogen 2.921 N/A HIS 193.A ND1 SER 9.A OG no hydrogen 2.728 N/A THR 194.A OG1 ASN 21.A O no hydrogen 3.026 N/A SER 195.A N TYR 186.A O no hydrogen 2.793 N/A GLY 198.A N SER 195.A OG no hydrogen 3.124 N/A ALA 199.A N SER 195.A O no hydrogen 2.794 N/A GLU 200.A N PRO 196.A O no hydrogen 3.013 N/A VAL 201.A N ALA 197.A O no hydrogen 3.049 N/A VAL 202.A N GLY 198.A O no hydrogen 2.864 N/A ALA 203.A N ALA 199.A O no hydrogen 2.891 N/A GLU 204.A N GLU 200.A O no hydrogen 2.824 N/A ALA 205.A N VAL 201.A O no hydrogen 2.901 N/A PHE 206.A N VAL 202.A O no hydrogen 3.086 N/A LEU 207.A N ALA 203.A O no hydrogen 2.977 N/A LYS 208.A N GLU 204.A O no hydrogen 2.882 N/A LYS 208.A NZ PHE 226.A O no hydrogen 3.067 N/A LYS 208.A NZ GLY 228.A O no hydrogen 3.169 N/A ALA 209.A N ALA 205.A O no hydrogen 2.966 N/A VAL 210.A N PHE 206.A O no hydrogen 2.931 N/A VAL 211.A N LEU 207.A O no hydrogen 3.025 N/A CYS 212.A N LYS 208.A O no hydrogen 2.901 N/A CYS 212.A SG LYS 208.A O no hydrogen 3.221 N/A THR 213.A N ALA 209.A O no hydrogen 2.842 N/A THR 213.A OG1.A ALA 209.A O no hydrogen 2.655 N/A GLY 214.A N VAL 210.A O no hydrogen 2.962 N/A THR 215.A N VAL 210.A O no hydrogen 3.353 N/A SER 216.A N GLU 163.A OE2 no hydrogen 2.831 N/A SER 216.A OG GLU 163.A OE1 no hydrogen 2.556 N/A LYS 218.A N THR 215.A O no hydrogen 2.876 N/A LYS 218.A NZ VAL 211.A O no hydrogen 2.739 N/A SER 219.A N SER 216.A O no hydrogen 3.043 N/A SER 219.A OG.A SER 216.A O no hydrogen 3.108 N/A SER 219.A OG.B SER 216.A O no hydrogen 2.849 N/A VAL 220.A N LEU 217.A O no hydrogen 2.887 N/A LEU 221.A N LYS 218.A O no hydrogen 3.088 N/A THR 222.A N TYR 30.A O no hydrogen 3.010 N/A THR 222.A OG1 TYR 30.A O no hydrogen 3.398 N/A SER 225.A N THR 223.A OG1 no hydrogen 3.162 N/A LEU 231.A N TYR 170.A OH no hydrogen 2.955 N/A