Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3axj_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 5.A OG ASP 3.A OD2 no hydrogen 2.637 N/A ASN 6.A N PRO 4.A O no hydrogen 3.168 N/A PHE 7.A N PRO 4.A O no hydrogen 3.308 N/A ASP 11.A N ASN 9.A OD1 no hydrogen 3.117 N/A ILE 12.A N ASN 9.A O no hydrogen 3.003 N/A SER 14.A N LEU 10.A O no hydrogen 3.062 N/A SER 14.A OG ASP 11.A O no hydrogen 3.359 N/A ASN 15.A N ASP 11.A O no hydrogen 2.851 N/A TYR 16.A N ILE 12.A O no hydrogen 3.091 N/A GLN 17.A N PHE 13.A O no hydrogen 2.978 N/A GLN 17.A NE2 GLN 17.A O no hydrogen 3.528 N/A GLN 17.A NE2 ASP 21.A OD1 no hydrogen 3.021 N/A LYS 18.A N SER 14.A O no hydrogen 3.079 N/A TYR 19.A N ASN 15.A O no hydrogen 2.944 N/A ILE 20.A N TYR 16.A O no hydrogen 2.898 N/A ASP 21.A N GLN 17.A O no hydrogen 2.861 N/A ASN 22.A N LYS 18.A O no hydrogen 2.924 N/A GLU 23.A N TYR 19.A O no hydrogen 3.060 N/A GLN 24.A N ILE 20.A O no hydrogen 2.826 N/A GLU 25.A N ASP 21.A O no hydrogen 3.011 N/A VAL 26.A N ASN 22.A O no hydrogen 3.234 N/A ARG 27.A N GLU 23.A O no hydrogen 2.930 N/A ARG 27.A NE GLU 23.A OE2 no hydrogen 3.104 N/A ARG 27.A NH1 HIS 94.A NE2 no hydrogen 2.703 N/A ARG 27.A NH2 GLU 23.A OE2 no hydrogen 3.225 N/A ARG 27.A NH2 ARG 90.A O no hydrogen 3.329 N/A GLU 28.A N GLN 24.A O no hydrogen 2.960 N/A ASN 29.A N GLU 25.A O no hydrogen 3.109 N/A ILE 30.A N VAL 26.A O no hydrogen 2.812 N/A ARG 31.A N ARG 27.A O no hydrogen 2.859 N/A ILE 32.A N GLU 28.A O no hydrogen 3.175 N/A VAL 33.A N ASN 29.A O no hydrogen 3.387 N/A VAL 34.A N ILE 30.A O no hydrogen 2.947 N/A ARG 35.A N ARG 31.A O no hydrogen 3.055 N/A GLU 36.A N ILE 32.A O no hydrogen 3.334 N/A ILE 37.A N VAL 33.A O no hydrogen 3.090 N/A GLU 38.A N VAL 34.A O no hydrogen 2.826 N/A HIS 39.A N ARG 35.A O no hydrogen 3.122 N/A LEU 40.A N GLU 36.A O no hydrogen 3.343 N/A SER 41.A N ILE 37.A O no hydrogen 2.942 N/A SER 41.A OG ILE 37.A O no hydrogen 3.383 N/A SER 41.A OG GLU 38.A O no hydrogen 2.794 N/A LYS 42.A N GLU 38.A O no hydrogen 2.937 N/A GLU 43.A N HIS 39.A O no hydrogen 3.306 N/A ALA 44.A N LEU 40.A O no hydrogen 3.285 N/A GLN 45.A N SER 41.A O no hydrogen 2.938 N/A ILE 46.A N LYS 42.A O no hydrogen 2.853 N/A LYS 47.A N GLU 43.A O no hydrogen 3.166 N/A LEU 48.A N ALA 44.A O no hydrogen 3.070 N/A GLN 49.A N GLN 45.A O no hydrogen 3.238 N/A GLN 49.A N ILE 46.A O no hydrogen 3.251 N/A ILE 50.A N LYS 47.A O no hydrogen 3.330 N/A ILE 51.A N LEU 48.A O no hydrogen 3.218 N/A HIS 52.A N GLN 49.A O no hydrogen 3.135 N/A HIS 52.A NE2 GLU 153.A OE2 no hydrogen 2.488 N/A SER 53.A N ILE 50.A O no hydrogen 3.095 N/A ASP 54.A N ILE 50.A O no hydrogen 2.940 N/A SER 56.A N ASP 54.A OD1 no hydrogen 3.038 N/A SER 56.A OG ASP 54.A OD1 no hydrogen 2.688 N/A GLN 57.A N ASP 54.A O no hydrogen 3.145 N/A GLN 57.A NE2 ASP 54.A OD2 no hydrogen 2.813 N/A ALA 61.A N GLN 57.A O no hydrogen 2.959 N/A CYS 62.A N ILE 58.A O no hydrogen 2.938 N/A CYS 62.A SG ILE 58.A O no hydrogen 3.293 N/A CYS 62.A SG VAL 109.A O no hydrogen 4.007 N/A GLY 63.A N SER 59.A O no hydrogen 3.052 N/A LEU 64.A N ALA 60.A O no hydrogen 3.025 N/A ALA 65.A N ALA 61.A O no hydrogen 2.997 N/A ARG 66.A N CYS 62.A O no hydrogen 3.054 N/A ARG 66.A NE GLU 113.A OE1 no hydrogen 3.008 N/A ARG 66.A NE GLU 113.A OE2 no hydrogen 2.818 N/A ARG 66.A NH2 GLU 113.A OE1 no hydrogen 2.682 N/A LYS 67.A N GLY 63.A O no hydrogen 3.224 N/A GLN 68.A N LEU 64.A O no hydrogen 3.241 N/A VAL 69.A N ALA 65.A O no hydrogen 2.919 N/A GLU 70.A N ARG 66.A O no hydrogen 2.991 N/A CYS 72.A N GLN 68.A O no hydrogen 3.324 N/A CYS 72.A N VAL 69.A O no hydrogen 3.004 N/A CYS 72.A SG GLN 68.A O no hydrogen 3.540 N/A LYS 75.A NZ GLU 36.A OE1 no hydrogen 3.058 N/A TYR 76.A N CYS 72.A O no hydrogen 2.954 N/A TYR 76.A OH THR 99.A OG1 no hydrogen 2.732 N/A GLN 77.A N ALA 73.A O no hydrogen 3.229 N/A LYS 78.A N GLN 74.A O no hydrogen 3.386 N/A LEU 79.A N LYS 75.A O no hydrogen 2.974 N/A ALA 80.A N TYR 76.A O no hydrogen 2.798 N/A GLU 81.A N GLN 77.A O no hydrogen 3.129 N/A GLU 81.A N LYS 78.A O no hydrogen 3.153 N/A LEU 82.A N LEU 79.A O no hydrogen 2.958 N/A VAL 83.A N ALA 80.A O no hydrogen 3.387 N/A GLN 87.A N PRO 84.A O no hydrogen 2.924 N/A TYR 88.A OH HIS 137.A O no hydrogen 2.710 N/A TYR 89.A OH HIS 137.A NE2 no hydrogen 2.840 N/A TYR 89.A OH ASP 139.A OD2 no hydrogen 2.609 N/A ARG 90.A N GLN 87.A O no hydrogen 2.990 N/A ARG 90.A NE GLU 23.A OE1 no hydrogen 3.229 N/A ARG 90.A NH1 GLN 87.A OE1 no hydrogen 3.015 N/A ARG 90.A NH2 GLU 23.A OE1 no hydrogen 2.705 N/A TYR 91.A N TYR 88.A O no hydrogen 3.212 N/A HIS 94.A N TYR 91.A O no hydrogen 2.843 N/A TRP 95.A N SER 92.A O no hydrogen 2.989 N/A TRP 95.A NE1 TYR 88.A OH no hydrogen 3.164 N/A THR 96.A N SER 92.A O no hydrogen 3.015 N/A THR 99.A N TRP 95.A O no hydrogen 3.012 N/A THR 99.A OG1 TYR 76.A OH no hydrogen 2.732 N/A THR 99.A OG1 TRP 95.A O no hydrogen 2.706 N/A GLN 100.A N THR 96.A O no hydrogen 2.921 N/A GLN 100.A NE2 ASP 142.A OD1 no hydrogen 2.976 N/A ARG 101.A N PHE 97.A O no hydrogen 3.085 N/A LEU 102.A N ILE 98.A O no hydrogen 2.866 N/A ILE 103.A N THR 99.A O no hydrogen 2.960 N/A PHE 104.A N GLN 100.A O no hydrogen 2.965 N/A ILE 105.A N ARG 101.A O no hydrogen 2.980 N/A ILE 106.A N LEU 102.A O no hydrogen 2.853 N/A ALA 107.A N ILE 103.A O no hydrogen 2.808 N/A LEU 108.A N PHE 104.A O no hydrogen 2.858 N/A VAL 109.A N ILE 105.A O no hydrogen 2.953 N/A ILE 110.A N ILE 106.A O no hydrogen 3.031 N/A TYR 111.A N ALA 107.A O no hydrogen 2.934 N/A LEU 112.A N LEU 108.A O no hydrogen 2.963 N/A GLU 113.A N VAL 109.A O no hydrogen 2.833 N/A ALA 114.A N ILE 110.A O no hydrogen 2.934 N/A GLY 115.A N TYR 111.A O no hydrogen 2.812 N/A THR 119.A OG1 THR 122.A OG1 no hydrogen 3.206 N/A THR 122.A N THR 119.A OG1 no hydrogen 3.031 N/A THR 122.A OG1 THR 119.A OG1 no hydrogen 3.206 N/A VAL 123.A N THR 119.A O no hydrogen 3.024 N/A ALA 124.A N ARG 120.A O no hydrogen 2.865 N/A GLU 125.A N GLU 121.A O no hydrogen 2.942 N/A GLY 127.A N GLU 125.A O no hydrogen 3.215 N/A LEU 128.A N ALA 124.A O no hydrogen 2.756 N/A LYS 129.A N PHE 136.A O no hydrogen 3.056 N/A GLU 134.A N SER 131.A O no hydrogen 2.939 N/A GLY 135.A N GLN 132.A O no hydrogen 3.359 N/A HIS 137.A NE2 TYR 89.A OH no hydrogen 2.840 N/A LEU 138.A N LYS 129.A O no hydrogen 2.884 N/A GLU 141.A N ASP 139.A OD1 no hydrogen 2.686 N/A TYR 143.A N ASP 139.A O no hydrogen 3.132 N/A TYR 143.A OH VAL 118.A O no hydrogen 2.550 N/A LEU 144.A N VAL 140.A O no hydrogen 2.930 N/A LEU 145.A N GLU 141.A O no hydrogen 2.939 N/A GLY 146.A N ASP 142.A O no hydrogen 2.957 N/A ILE 147.A N TYR 143.A O no hydrogen 3.071 N/A LEU 148.A N LEU 144.A O no hydrogen 3.208 N/A GLN 149.A N GLY 146.A O no hydrogen 3.110 N/A LEU 150.A N ILE 147.A O no hydrogen 2.991 N/A ALA 151.A N LEU 148.A O no hydrogen 3.359 N/A SER 152.A OG GLN 149.A O no hydrogen 3.314 N/A LEU 154.A N LEU 150.A O no hydrogen 2.751 N/A SER 155.A N ALA 151.A O no hydrogen 2.882 N/A SER 155.A OG ALA 151.A O no hydrogen 3.301 N/A SER 155.A OG SER 152.A O no hydrogen 2.997 N/A ARG 156.A N SER 152.A O no hydrogen 3.196 N/A ARG 156.A NH1 GLN 49.A OE1 no hydrogen 2.855 N/A PHE 157.A N GLU 153.A O no hydrogen 2.968 N/A ALA 158.A N LEU 154.A O no hydrogen 2.794 N/A THR 159.A N SER 155.A O no hydrogen 3.375 N/A THR 159.A OG1 SER 155.A O no hydrogen 3.331 N/A ASN 160.A N ARG 156.A O no hydrogen 3.108 N/A SER 161.A N PHE 157.A O no hydrogen 2.809 N/A SER 161.A OG PHE 157.A O no hydrogen 2.828 N/A VAL 162.A N ALA 158.A O no hydrogen 3.331 N/A THR 163.A N THR 159.A O no hydrogen 3.149 N/A THR 163.A OG1 THR 159.A O no hydrogen 3.287 N/A ASP 165.A N SER 161.A O no hydrogen 2.839 N/A TYR 166.A N SER 221.A OG no hydrogen 3.125 N/A GLU 167.A N ASP 165.A OD1 no hydrogen 3.383 N/A ARG 168.A N ASP 165.A OD1 no hydrogen 3.297 N/A ARG 168.A NE TYR 111.A OH no hydrogen 3.352 N/A ARG 168.A NH2 TYR 111.A OH no hydrogen 2.942 N/A ASN 171.A N GLU 167.A O no hydrogen 3.329 N/A ILE 172.A N ARG 168.A O no hydrogen 2.935 N/A SER 173.A N PRO 169.A O no hydrogen 2.811 N/A SER 173.A OG GLU 208.A OE1 no hydrogen 3.553 N/A SER 173.A OG GLU 208.A OE2 no hydrogen 2.409 N/A HIS 174.A N LEU 170.A O no hydrogen 3.049 N/A PHE 175.A N ASN 171.A O no hydrogen 3.137 N/A ILE 176.A N ILE 172.A O no hydrogen 2.793 N/A GLY 177.A N SER 173.A O no hydrogen 2.853 N/A ASP 178.A N HIS 174.A O no hydrogen 3.058 N/A LEU 179.A N PHE 175.A O no hydrogen 3.094 N/A ASN 180.A N ILE 176.A O no hydrogen 2.849 N/A THR 181.A N GLY 177.A O no hydrogen 2.980 N/A THR 181.A OG1 GLY 177.A O no hydrogen 3.124 N/A GLY 182.A N ASP 178.A O no hydrogen 2.917 N/A PHE 183.A N LEU 179.A O no hydrogen 2.903 N/A ARG 184.A N ASN 180.A O no hydrogen 2.998 N/A LEU 185.A N THR 181.A O no hydrogen 3.075 N/A LEU 186.A N PHE 183.A O no hydrogen 3.090 N/A ASN 187.A N ARG 184.A O no hydrogen 3.165 N/A ARG 194.A N ASP 191.A OD1 no hydrogen 3.035 N/A ARG 194.A NH1 ASN 190.A OD1 no hydrogen 3.542 N/A LYS 195.A N ASP 191.A O no hydrogen 3.065 N/A ARG 196.A N GLY 192.A O no hydrogen 3.197 N/A ARG 196.A NH1 GLN 100.A OE1 no hydrogen 3.243 N/A PHE 197.A N LEU 193.A O no hydrogen 2.898 N/A ASP 198.A N ARG 194.A O no hydrogen 2.962 N/A ALA 199.A N ARG 196.A O no hydrogen 3.224 N/A LEU 200.A N PHE 197.A O no hydrogen 2.970 N/A TYR 202.A N ALA 199.A O no hydrogen 3.320 N/A ASP 203.A N LEU 200.A O no hydrogen 3.088 N/A VAL 204.A N LEU 200.A O no hydrogen 2.933 N/A LYS 205.A N LYS 201.A O no hydrogen 2.881 N/A LYS 205.A NZ GLU 209.A OE2 no hydrogen 2.759 N/A LYS 206.A N TYR 202.A O no hydrogen 3.061 N/A ILE 207.A N ASP 203.A O no hydrogen 3.009 N/A GLU 208.A N VAL 204.A O no hydrogen 2.929 N/A GLU 209.A N LYS 205.A O no hydrogen 2.978 N/A VAL 210.A N LYS 206.A O no hydrogen 3.118 N/A VAL 211.A N ILE 207.A O no hydrogen 2.958 N/A TYR 212.A N GLU 208.A O no hydrogen 2.882 N/A ASP 213.A N GLU 209.A O no hydrogen 2.908 N/A VAL 214.A N VAL 210.A O no hydrogen 3.163 N/A SER 215.A N VAL 211.A O no hydrogen 3.010 N/A SER 215.A OG VAL 211.A O no hydrogen 3.378 N/A SER 215.A OG TYR 212.A O no hydrogen 3.351 N/A ILE 216.A N TYR 212.A O no hydrogen 2.847 N/A ARG 217.A N VAL 214.A O no hydrogen 3.292 N/A ARG 217.A NH1 ASP 213.A O no hydrogen 3.013 N/A GLY 218.A N SER 215.A O no hydrogen 3.126 N/A LEU 219.A N VAL 214.A O no hydrogen 2.985 N/A SER 221.A N GLU 167.A OE2 no hydrogen 2.904 N/A SER 221.A OG GLY 164.A O no hydrogen 3.112 N/A SER 221.A OG GLU 167.A OE1 no hydrogen 2.571 N/A