Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3rd5_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 4.A N ASP 7.A OD2 no hydrogen 2.978 N/A ALA 6.A N THR 4.A OG1 no hydrogen 3.243 N/A ASP 7.A N THR 4.A O no hydrogen 2.834 N/A LEU 8.A N ALA 5.A O no hydrogen 3.017 N/A PHE 11.A N ARG 36.A O no hydrogen 2.774 N/A ALA 12.A N SER 10.A OG no hydrogen 3.115 N/A ARG 14.A N PHE 11.A O no hydrogen 2.983 N/A ARG 14.A NH2 ASP 129.A OD2 no hydrogen 2.792 N/A THR 15.A N ASP 85.A OD2 no hydrogen 2.816 N/A VAL 16.A N THR 39.A O no hydrogen 2.909 N/A VAL 17.A N VAL 86.A O no hydrogen 2.916 N/A ILE 18.A N ILE 41.A O no hydrogen 2.871 N/A THR 19.A N ILE 88.A O no hydrogen 3.045 N/A THR 19.A OG1 HIS 116.A NE2 no hydrogen 2.737 N/A GLY 20.A N ALA 43.A O no hydrogen 2.967 N/A ASN 22.A ND2 ASP 46.A O no hydrogen 2.909 N/A ALA 27.A N SER 23.A O no hydrogen 3.131 N/A VAL 28.A N GLY 24.A O no hydrogen 3.000 N/A THR 29.A N LEU 25.A O no hydrogen 3.080 N/A THR 29.A OG1 LEU 25.A O no hydrogen 2.768 N/A ALA 30.A N GLY 26.A O no hydrogen 2.952 N/A ARG 31.A N ALA 27.A O no hydrogen 2.855 N/A ARG 31.A NH2 GLU 32.A OE2 no hydrogen 2.902 N/A ARG 31.A NH2 ASP 206.A OD1 no hydrogen 2.952 N/A GLU 32.A N VAL 28.A O no hydrogen 2.938 N/A LEU 33.A N THR 29.A O no hydrogen 3.186 N/A ALA 34.A N ALA 30.A O no hydrogen 2.902 N/A ARG 35.A N ARG 31.A O no hydrogen 2.978 N/A ARG 35.A NE.A GLU 32.A OE1 no hydrogen 2.836 N/A ARG 35.A NH2.A ALA 5.A O no hydrogen 3.115 N/A ARG 35.A NH2.A GLU 32.A OE1 no hydrogen 2.728 N/A ARG 35.A NH2.B ALA 5.A O no hydrogen 2.947 N/A ARG 36.A N GLU 32.A O no hydrogen 3.331 N/A ARG 36.A N LEU 33.A O no hydrogen 3.075 N/A ARG 36.A NE LEU 8.A O no hydrogen 3.069 N/A ARG 36.A NH2 LEU 8.A O no hydrogen 3.278 N/A GLY 37.A N ALA 34.A O no hydrogen 3.009 N/A ALA 38.A N LEU 33.A O no hydrogen 3.068 N/A THR 39.A N ARG 14.A O no hydrogen 2.844 N/A VAL 40.A N GLN 60.A O no hydrogen 2.884 N/A ILE 41.A N VAL 16.A O no hydrogen 2.868 N/A MET 42.A N GLU 62.A O no hydrogen 2.765 N/A ALA 43.A N ILE 18.A O no hydrogen 2.923 N/A VAL 44.A N ARG 64.A O no hydrogen 3.027 N/A LYS 49.A N ASP 46.A OD1 no hydrogen 3.054 N/A LYS 49.A NZ ASN 22.A O no hydrogen 3.106 N/A GLY 50.A N ASP 46.A O no hydrogen 3.039 N/A GLU 51.A N THR 47.A O no hydrogen 2.843 N/A ALA 52.A N ARG 48.A O no hydrogen 3.062 N/A ALA 53.A N LYS 49.A O no hydrogen 3.255 N/A ALA 54.A N GLY 50.A O no hydrogen 2.846 N/A ARG 55.A N GLU 51.A O no hydrogen 3.015 N/A THR 56.A N ALA 53.A O no hydrogen 3.441 N/A THR 56.A OG1 ALA 53.A O no hydrogen 3.307 N/A MET 57.A N ALA 54.A O no hydrogen 3.070 N/A GLU 62.A N VAL 40.A O no hydrogen 2.846 N/A ARG 64.A N MET 42.A O no hydrogen 2.900 N/A ARG 64.A NE GLU 62.A OE2 no hydrogen 3.005 N/A ARG 64.A NH2 GLU 62.A OE1 no hydrogen 3.010 N/A LEU 66.A N VAL 44.A O no hydrogen 2.907 N/A ASP 67.A N SER 73.A OG no hydrogen 2.914 N/A GLN 69.A N ASP 67.A OD1 no hydrogen 2.995 N/A ASP 70.A N ASP 67.A O no hydrogen 3.015 N/A LEU 71.A N ASP 103.A OD2 no hydrogen 2.841 N/A SER 72.A N ASP 70.A OD1 no hydrogen 3.019 N/A SER 72.A OG ASP 70.A OD1 no hydrogen 2.646 N/A SER 72.A OG ASP 70.A OD2 no hydrogen 3.543 N/A VAL 74.A N ASP 70.A O no hydrogen 3.078 N/A ARG 75.A N.A LEU 71.A O no hydrogen 3.004 N/A ARG 75.A N.B LEU 71.A O no hydrogen 3.011 N/A ARG 75.A NE.B ASP 79.A OD2 no hydrogen 3.437 N/A ARG 75.A NH2.A LYS 263.A O no hydrogen 3.199 N/A ARG 76.A N SER 72.A O no hydrogen 3.066 N/A ARG 76.A NH1 SER 72.A OG no hydrogen 3.152 N/A PHE 77.A N SER 73.A O no hydrogen 2.926 N/A ALA 78.A N VAL 74.A O no hydrogen 2.932 N/A ASP 79.A N ARG 75.A O.A no hydrogen 2.982 N/A ASP 79.A N ARG 75.A O.B no hydrogen 3.001 N/A GLY 80.A N ARG 76.A O no hydrogen 3.331 N/A GLY 80.A N PHE 77.A O no hydrogen 3.061 N/A VAL 81.A N ALA 78.A O no hydrogen 3.050 N/A ALA 84.A N ARG 126.A O no hydrogen 3.090 N/A ASP 85.A N THR 15.A O no hydrogen 2.850 N/A VAL 86.A N THR 15.A O no hydrogen 3.208 N/A LEU 87.A N ARG 130.A O no hydrogen 2.983 N/A ILE 88.A N VAL 17.A O no hydrogen 2.787 N/A ASN 89.A N VAL 132.A O no hydrogen 2.815 N/A ASN 89.A ND2 THR 120.A OG1 no hydrogen 3.127 N/A ASN 89.A ND2 THR 133.A OG1 no hydrogen 3.253 N/A ASN 90.A N THR 19.A OG1 no hydrogen 2.973 N/A ASN 90.A ND2 THR 19.A O no hydrogen 2.912 N/A ALA 91.A N THR 19.A OG1 no hydrogen 2.943 N/A ILE 93.A N ASN 112.A OD1 no hydrogen 2.972 N/A ALA 95.A N GLN 108.A OE1 no hydrogen 2.913 N/A THR 101.A N PHE 105.A O no hydrogen 2.831 N/A VAL 102.A N GLN 69.A O no hydrogen 3.290 N/A ASP 103.A N THR 101.A OG1 no hydrogen 3.279 N/A GLY 104.A N THR 101.A O no hydrogen 2.944 N/A PHE 105.A N THR 101.A OG1 no hydrogen 3.116 N/A GLU 106.A N ASN 150.A OD1 no hydrogen 2.907 N/A SER 107.A N ALA 99.A O no hydrogen 2.872 N/A GLN 108.A N GLU 106.A OE2 no hydrogen 2.886 N/A GLN 108.A NE2 TYR 156.A OH no hydrogen 2.865 N/A GLN 108.A NE2 PRO 158.A O no hydrogen 2.985 N/A ILE 109.A N GLU 106.A OE1 no hydrogen 2.895 N/A GLY 110.A N GLU 106.A O no hydrogen 2.776 N/A THR 111.A N SER 107.A O no hydrogen 2.877 N/A THR 111.A OG1 SER 107.A O no hydrogen 2.754 N/A ASN 112.A N GLN 108.A O no hydrogen 2.915 N/A ASN 112.A ND2 ILE 93.A O no hydrogen 2.961 N/A ASN 112.A ND2 SER 165.A OG no hydrogen 2.983 N/A HIS 113.A N ILE 109.A O no hydrogen 3.116 N/A HIS 113.A NE2 SER 258.A OG no hydrogen 2.893 N/A LEU 114.A N ILE 109.A O no hydrogen 2.865 N/A GLY 115.A N GLY 110.A O no hydrogen 2.867 N/A HIS 116.A ND1 ASN 112.A O no hydrogen 2.903 N/A HIS 116.A NE2 THR 19.A OG1 no hydrogen 2.737 N/A PHE 117.A N HIS 113.A O no hydrogen 2.764 N/A ALA 118.A N LEU 114.A O no hydrogen 3.029 N/A LEU 119.A N GLY 115.A O no hydrogen 2.967 N/A THR 120.A N HIS 116.A O no hydrogen 2.865 N/A THR 120.A OG1 HIS 116.A O no hydrogen 2.783 N/A ASN 121.A N PHE 117.A O no hydrogen 3.078 N/A ASN 121.A ND2 THR 264.A OG1 no hydrogen 3.221 N/A LEU 122.A N ALA 118.A O no hydrogen 3.024 N/A LEU 123.A N LEU 119.A O no hydrogen 2.974 N/A LEU 124.A N THR 120.A O no hydrogen 2.889 N/A ARG 126.A N LEU 123.A O no hydrogen 2.813 N/A ARG 126.A NE VAL 81.A O no hydrogen 2.925 N/A ARG 126.A NH2 VAL 81.A O no hydrogen 3.102 N/A LEU 127.A N LEU 124.A O no hydrogen 3.256 N/A THR 128.A N ALA 84.A O no hydrogen 3.044 N/A THR 128.A OG1 ASP 85.A OD1 no hydrogen 2.559 N/A ASP 129.A N ASP 85.A O no hydrogen 2.945 N/A ARG 130.A N ASP 85.A O no hydrogen 3.239 N/A ARG 130.A NE ASP 129.A OD1 no hydrogen 2.897 N/A ARG 130.A NH1 ALA 215.A O no hydrogen 2.834 N/A ARG 130.A NH1 GLN 218.A O no hydrogen 2.813 N/A ARG 130.A NH2 GLN 218.A O no hydrogen 3.266 N/A VAL 131.A N ARG 188.A O no hydrogen 2.949 N/A VAL 132.A N LEU 87.A O no hydrogen 2.840 N/A THR 133.A N LEU 190.A O no hydrogen 2.939 N/A VAL 134.A N ASN 89.A O no hydrogen 3.031 N/A SER 135.A N ALA 192.A O no hydrogen 2.764 N/A SER 135.A OG LYS 166.A O no hydrogen 2.799 N/A SER 136.A N SER 135.A OG no hydrogen 2.740 N/A SER 136.A OG HIS 198.A O no hydrogen 2.535 N/A ALA 138.A N SER 136.A OG no hydrogen 2.891 N/A HIS 139.A N SER 136.A O no hydrogen 2.978 N/A HIS 139.A ND1 SER 136.A O no hydrogen 2.967 N/A TRP 140.A N MET 137.A O no hydrogen 3.142 N/A GLY 142.A N HIS 139.A O no hydrogen 2.925 N/A ASN 145.A N GLN 164.A OE1 no hydrogen 3.030 N/A ASP 148.A N ASN 145.A O no hydrogen 3.380 N/A ASP 148.A N ASN 145.A OD1 no hydrogen 2.934 N/A TRP 151.A N ASP 148.A O no hydrogen 3.224 N/A ARG 152.A N ASP 148.A OD1 no hydrogen 2.837 N/A ARG 152.A NH1 ARG 152.A O no hydrogen 2.805 N/A SER 153.A N ASP 148.A OD2 no hydrogen 2.918 N/A ARG 154.A NE ASP 148.A O no hydrogen 2.912 N/A ARG 154.A NH2 ASP 148.A O no hydrogen 2.959 N/A ARG 154.A NH2 GLN 164.A OE1 no hydrogen 3.355 N/A TYR 156.A OH VAL 96.A O no hydrogen 2.651 N/A TYR 156.A OH GLU 106.A OE2 no hydrogen 3.379 N/A LEU 160.A N SER 157.A OG no hydrogen 2.988 N/A ALA 161.A N SER 157.A O no hydrogen 2.834 N/A TYR 162.A N PRO 158.A O no hydrogen 3.137 N/A SER 163.A N TRP 159.A O no hydrogen 2.861 N/A SER 163.A OG ALA 138.A O no hydrogen 2.663 N/A SER 163.A OG TRP 159.A O no hydrogen 3.130 N/A GLN 164.A N LEU 160.A O no hydrogen 2.859 N/A GLN 164.A NE2 LEU 149.A O no hydrogen 2.955 N/A SER 165.A N ALA 161.A O no hydrogen 3.214 N/A SER 165.A OG TYR 162.A O no hydrogen 2.767 N/A LYS 166.A N TYR 162.A O no hydrogen 2.940 N/A LYS 166.A NZ VAL 134.A O no hydrogen 3.048 N/A LYS 166.A NZ ASN 169.A OD1 no hydrogen 2.798 N/A LEU 167.A N SER 163.A O no hydrogen 2.916 N/A ALA 168.A N GLN 164.A O no hydrogen 2.918 N/A ASN 169.A N SER 165.A O no hydrogen 3.016 N/A ASN 169.A ND2 ASN 112.A O no hydrogen 3.014 N/A LEU 171.A N LEU 167.A O no hydrogen 2.998 N/A PHE 172.A N ALA 168.A O no hydrogen 2.767 N/A THR 173.A N ASN 169.A O no hydrogen 3.173 N/A THR 173.A OG1 ASN 169.A O no hydrogen 2.897 N/A SER 174.A N LEU 170.A O no hydrogen 2.985 N/A SER 174.A OG.A LEU 170.A O no hydrogen 3.401 N/A SER 174.A OG.A ASP 223.A OD1 no hydrogen 3.166 N/A SER 174.A OG.A ASP 223.A OD2 no hydrogen 3.022 N/A SER 174.A OG.B LEU 170.A O no hydrogen 3.515 N/A SER 174.A OG.B LEU 171.A O no hydrogen 3.145 N/A GLU 175.A N LEU 171.A O no hydrogen 3.035 N/A LEU 176.A N PHE 172.A O no hydrogen 2.814 N/A GLN 177.A N THR 173.A O no hydrogen 2.965 N/A GLN 177.A NE2 GLN 177.A O no hydrogen 3.198 N/A GLN 177.A NE2 THR 181.A OG1 no hydrogen 3.071 N/A ARG 178.A N SER 174.A O no hydrogen 2.991 N/A ARG 178.A NE GLU 175.A OE1 no hydrogen 2.839 N/A ARG 178.A NH2 GLU 175.A OE2 no hydrogen 2.781 N/A ARG 179.A N GLU 175.A O no hydrogen 2.978 N/A ARG 179.A NE.A GLU 175.A OE2 no hydrogen 3.029 N/A LEU 180.A N LEU 176.A O no hydrogen 2.867 N/A THR 181.A N GLN 177.A O no hydrogen 2.918 N/A THR 181.A OG1 GLN 177.A O no hydrogen 3.202 N/A ALA 182.A N ARG 178.A O no hydrogen 2.999 N/A ALA 183.A N ARG 179.A O no hydrogen 2.982 N/A GLY 184.A N THR 181.A O no hydrogen 3.026 N/A SER 185.A N LEU 180.A O no hydrogen 2.998 N/A LEU 187.A N SER 185.A OG no hydrogen 3.039 N/A ARG 188.A N ASP 129.A O no hydrogen 3.109 N/A ARG 188.A NH1 ASP 219.A OD1 no hydrogen 3.000 N/A ARG 188.A NH1 LEU 220.A O no hydrogen 2.860 N/A ALA 189.A N GLN 177.A OE1 no hydrogen 2.889 N/A LEU 190.A N VAL 131.A O no hydrogen 2.842 N/A ALA 191.A N SER 224.A O no hydrogen 2.949 N/A ALA 192.A N THR 133.A O no hydrogen 3.132 N/A HIS 193.A N VAL 226.A O no hydrogen 2.990 N/A GLY 195.A N HIS 193.A ND1 no hydrogen 3.214 N/A TYR 196.A N TYR 232.A O no hydrogen 3.196 N/A TYR 196.A OH ASP 204.A OD1 no hydrogen 2.559 N/A SER 197.A OG HIS 198.A ND1 no hydrogen 2.772 N/A HIS 198.A N GLY 195.A O no hydrogen 3.443 N/A HIS 198.A ND1 SER 197.A OG no hydrogen 2.772 N/A THR 199.A OG1 TYR 196.A O no hydrogen 2.790 N/A ASP 206.A N ALA 202.A O no hydrogen 2.931 N/A PHE 207.A N THR 203.A O no hydrogen 2.986 N/A GLY 208.A N ASP 204.A O no hydrogen 3.004 N/A ALA 209.A N ALA 205.A O no hydrogen 2.918 N/A ARG 210.A N ASP 206.A O no hydrogen 3.048 N/A GLN 211.A N GLY 208.A O no hydrogen 3.196 N/A GLN 211.A NE2 PHE 207.A O no hydrogen 2.968 N/A LEU 213.A N ALA 209.A O no hydrogen 2.864 N/A TYR 214.A N ARG 210.A O no hydrogen 3.018 N/A ALA 215.A N GLN 211.A O no hydrogen 3.175 N/A ALA 216.A N THR 212.A O no hydrogen 2.832 N/A SER 217.A N TYR 214.A O no hydrogen 3.182 N/A SER 217.A OG LEU 213.A O no hydrogen 2.711 N/A SER 217.A OG TYR 214.A O no hydrogen 3.540 N/A SER 217.A OG GLN 218.A OE1 no hydrogen 2.999 N/A GLN 218.A N TYR 214.A O no hydrogen 3.011 N/A ASP 223.A N ALA 189.A O no hydrogen 2.815 N/A SER 224.A N PRO 221.A O no hydrogen 3.212 N/A SER 224.A OG PRO 221.A O no hydrogen 2.656 N/A VAL 226.A N ALA 191.A O no hydrogen 2.912 N/A GLY 227.A N GLN 237.A O no hydrogen 3.040 N/A ARG 229.A N ARG 235.A O no hydrogen 2.820 N/A PHE 230.A N LEU 233.A O no hydrogen 2.917 N/A GLY 231.A N PRO 228.A O no hydrogen 2.962 N/A TYR 232.A N PHE 230.A O no hydrogen 2.915 N/A THR 236.A OG1 GLN 211.A OE1 no hydrogen 2.703 N/A GLN 237.A N GLY 227.A O no hydrogen 3.112 N/A GLN 237.A NE2 PRO 238.A O no hydrogen 3.249 N/A VAL 239.A N PHE 225.A O no hydrogen 2.809 N/A ARG 241.A NH1 ASP 223.A OD1 no hydrogen 2.898 N/A ARG 241.A NH2 ASP 223.A O no hydrogen 2.801 N/A SER 242.A N HIS 139.A NE2 no hydrogen 3.018 N/A ARG 244.A NE GLY 142.A O no hydrogen 2.857 N/A ARG 244.A NH1 GLY 142.A O no hydrogen 3.120 N/A ALA 245.A N SER 242.A OG no hydrogen 2.996 N/A LYS 246.A N ARG 243.A O no hydrogen 2.995 N/A ASP 247.A N ARG 244.A O no hydrogen 3.311 N/A MET 250.A N ASP 247.A OD1 no hydrogen 2.984 N/A ALA 251.A N ASP 247.A O no hydrogen 3.024 N/A ALA 252.A N ALA 248.A O no hydrogen 3.074 N/A ALA 253.A N GLY 249.A O no hydrogen 2.941 N/A LEU 254.A N MET 250.A O no hydrogen 2.825 N/A TRP 255.A N ALA 251.A O no hydrogen 3.044 N/A TRP 255.A NE1 GLU 259.A OE2 no hydrogen 2.851 N/A ALA 256.A N ALA 252.A O no hydrogen 3.203 N/A LEU 257.A N ALA 253.A O no hydrogen 3.021 N/A SER 258.A N LEU 254.A O no hydrogen 2.846 N/A SER 258.A OG HIS 113.A NE2 no hydrogen 2.893 N/A SER 258.A OG LEU 254.A O no hydrogen 2.795 N/A GLU 259.A N TRP 255.A O no hydrogen 2.904 N/A GLN 260.A N ALA 256.A O no hydrogen 3.109 N/A LEU 261.A N LEU 257.A O no hydrogen 2.928 N/A THR 262.A N SER 258.A O no hydrogen 2.975 N/A THR 262.A OG1 SER 258.A O no hydrogen 2.771 N/A THR 262.A OG1 THR 264.A OG1 no hydrogen 2.868 N/A LYS 263.A NZ GLN 260.A O no hydrogen 2.774 N/A THR 264.A OG1 THR 262.A OG1 no hydrogen 2.868 N/A PHE 266.A N GLU 259.A OE2 no hydrogen 3.042 N/A