Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3r3s_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 6.A N ASP 4.A OD1 no hydrogen 2.850 N/A THR 6.A OG1 ASP 4.A OD1 no hydrogen 2.732 N/A THR 6.A OG1 ASP 4.A OD2 no hydrogen 3.210 N/A THR 7.A N ASP 4.A O no hydrogen 3.189 N/A THR 7.A OG1 ASP 4.A O no hydrogen 3.380 N/A TYR 10.A OH GLU 13.A O no hydrogen 2.675 N/A TYR 14.A N PRO 246.A O no hydrogen 3.041 N/A GLN 17.A NE2 PRO 15.A O no hydrogen 2.884 N/A GLN 17.A NE2 THR 29.A O no hydrogen 2.841 N/A GLN 19.A N ILE 236.A O no hydrogen 3.090 N/A GLN 19.A NE2 VAL 24.A O no hydrogen 2.972 N/A VAL 24.A N GLN 19.A OE1 no hydrogen 2.811 N/A GLN 25.A N ASP 85.A OD2 no hydrogen 2.825 N/A ALA 26.A N ASP 85.A OD1 no hydrogen 3.420 N/A LYS 27.A N VAL 24.A O no hydrogen 3.215 N/A MET 28.A N GLN 25.A O no hydrogen 2.975 N/A THR 29.A N GLN 17.A OE1 no hydrogen 3.032 N/A ASP 33.A N GLN 259.A OE1 no hydrogen 3.000 N/A CYS 34.A N GLU 36.A OE1 no hydrogen 2.929 N/A CYS 34.A SG GLN 25.A OE1 no hydrogen 3.908 N/A CYS 34.A SG PRO 32.A O no hydrogen 3.839 N/A CYS 34.A SG GLY 58.A O no hydrogen 3.528 N/A GLY 35.A N ASP 33.A OD1 no hydrogen 2.880 N/A GLU 36.A N GLU 36.A OE1 no hydrogen 2.796 N/A SER 38.A N GLY 35.A O no hydrogen 3.184 N/A TYR 39.A N GLY 35.A O no hydrogen 3.026 N/A TYR 39.A OH GLU 70.A OE2 no hydrogen 2.569 N/A SER 42.A N GLU 70.A OE1 no hydrogen 2.832 N/A ARG 44.A N GLU 70.A OE1 no hydrogen 3.019 N/A ARG 44.A NE GLU 274.A OE1 no hydrogen 2.941 N/A ARG 44.A NH2 GLU 274.A OE1 no hydrogen 3.401 N/A ARG 44.A NH2 GLU 274.A OE2 no hydrogen 2.814 N/A LEU 45.A N GLU 70.A O no hydrogen 2.930 N/A LYS 46.A N GLY 43.A O no hydrogen 3.326 N/A ASP 47.A N GLY 71.A O no hydrogen 2.838 N/A ARG 48.A N LEU 45.A O no hydrogen 2.987 N/A ARG 48.A NE ASP 128.A OD1 no hydrogen 2.861 N/A ARG 48.A NH1 ALA 271.A O no hydrogen 3.059 N/A ARG 48.A NH2 ASP 128.A O no hydrogen 2.990 N/A ARG 48.A NH2 ALA 271.A O no hydrogen 3.094 N/A LYS 49.A N ASP 128.A OD1 no hydrogen 2.873 N/A LYS 49.A NZ ASP 47.A O no hydrogen 3.178 N/A ALA 50.A N ASP 73.A O no hydrogen 2.921 N/A LEU 51.A N ILE 129.A O no hydrogen 2.964 N/A VAL 52.A N ALA 75.A O no hydrogen 2.844 N/A THR 53.A N ALA 131.A O no hydrogen 3.025 N/A GLY 55.A N ASN 77.A O no hydrogen 3.143 N/A SER 57.A OG ASP 56.A OD1 no hydrogen 2.920 N/A GLY 58.A N GLN 25.A OE1 no hydrogen 3.038 N/A ARG 61.A N SER 57.A O no hydrogen 3.070 N/A ARG 61.A NE GLU 36.A OE2 no hydrogen 2.859 N/A ARG 61.A NH1 ASP 56.A O no hydrogen 3.249 N/A ARG 61.A NH1 GLN 88.A OE1.A no hydrogen 2.850 N/A ARG 61.A NH2 GLU 36.A OE2 no hydrogen 2.986 N/A ARG 61.A NH2 GLN 88.A OE1.A no hydrogen 2.990 N/A ARG 61.A NH2 GLN 88.A OE1.B no hydrogen 2.786 N/A ALA 62.A N GLY 58.A O no hydrogen 2.953 N/A ALA 63.A N ILE 59.A O no hydrogen 2.956 N/A ALA 64.A N GLY 60.A O no hydrogen 2.842 N/A ILE 65.A N ARG 61.A O no hydrogen 2.871 N/A ALA 66.A N ALA 62.A O no hydrogen 3.006 N/A TYR 67.A N ALA 63.A O no hydrogen 2.832 N/A TYR 67.A OH TYR 267.A O no hydrogen 2.916 N/A ALA 68.A N ALA 64.A O no hydrogen 3.085 N/A ARG 69.A N ILE 65.A O no hydrogen 2.849 N/A ARG 69.A NH1 GLY 35.A O no hydrogen 3.166 N/A ARG 69.A NH1 GLU 36.A O no hydrogen 3.421 N/A ARG 69.A NH1 TYR 39.A O no hydrogen 2.810 N/A ARG 69.A NH2 GLU 36.A O no hydrogen 2.772 N/A GLU 70.A N ALA 66.A O no hydrogen 2.859 N/A GLU 70.A N TYR 67.A O no hydrogen 3.141 N/A GLY 71.A N ALA 68.A O no hydrogen 2.983 N/A ALA 72.A N TYR 67.A O no hydrogen 2.945 N/A ASP 73.A N ARG 48.A O no hydrogen 2.974 N/A VAL 74.A N LYS 99.A O no hydrogen 2.958 N/A ALA 75.A N ALA 50.A O no hydrogen 2.819 N/A ILE 76.A N VAL 101.A O no hydrogen 2.831 N/A ASN 77.A N VAL 52.A O no hydrogen 3.022 N/A ASN 77.A ND2 LEU 103.A O no hydrogen 2.824 N/A ASN 77.A ND2 GLY 105.A O no hydrogen 3.105 N/A TYR 78.A OH GLU 83.A OE1 no hydrogen 2.727 N/A LEU 79.A N GLU 82.A OE1 no hydrogen 2.848 N/A GLU 82.A N LEU 79.A O no hydrogen 2.803 N/A GLU 83.A N PRO 80.A O no hydrogen 3.074 N/A ALA 86.A N GLU 82.A O no hydrogen 2.936 N/A GLN 87.A N GLU 83.A O no hydrogen 2.799 N/A GLN 87.A NE2 GLU 83.A OE2 no hydrogen 2.883 N/A GLN 88.A N GLU 84.A O no hydrogen 3.351 N/A VAL 89.A N ASP 85.A O no hydrogen 3.154 N/A LYS 90.A N ALA 86.A O no hydrogen 2.865 N/A LYS 90.A NZ GLU 94.A OE2 no hydrogen 2.748 N/A ALA 91.A N GLN 87.A O no hydrogen 3.190 N/A LEU 92.A N GLN 88.A O no hydrogen 3.004 N/A ILE 93.A N VAL 89.A O no hydrogen 2.876 N/A GLU 94.A N LYS 90.A O no hydrogen 2.944 N/A GLU 95.A N ALA 91.A O no hydrogen 2.813 N/A CYS 96.A N ILE 93.A O no hydrogen 2.982 N/A CYS 96.A SG LEU 92.A O no hydrogen 3.421 N/A GLY 97.A N GLU 94.A O no hydrogen 2.861 N/A ARG 98.A N ILE 93.A O no hydrogen 3.418 N/A ARG 98.A NE ASP 73.A OD1 no hydrogen 2.955 N/A ARG 98.A NH1 ASP 47.A OD1 no hydrogen 3.457 N/A ARG 98.A NH2 ASP 47.A OD1 no hydrogen 2.970 N/A ARG 98.A NH2 ASP 73.A OD1 no hydrogen 3.262 N/A ARG 98.A NH2 ASP 73.A OD2 no hydrogen 3.372 N/A LYS 99.A N ASP 73.A OD1 no hydrogen 2.897 N/A LYS 99.A NZ ALA 123.A O no hydrogen 2.740 N/A VAL 101.A N VAL 74.A O no hydrogen 2.982 N/A LEU 103.A N ILE 76.A O no hydrogen 2.832 N/A GLY 105.A N TYR 78.A O no hydrogen 2.894 N/A SER 108.A N ASP 106.A OD1 no hydrogen 2.934 N/A SER 108.A OG ASP 106.A OD1 no hydrogen 2.706 N/A SER 108.A OG ASP 106.A OD2 no hydrogen 3.316 N/A ASP 109.A N ASP 106.A O no hydrogen 3.057 N/A PHE 112.A N ASP 109.A OD1 no hydrogen 3.078 N/A ALA 113.A N ASP 109.A O no hydrogen 2.879 N/A ARG 114.A N GLU 110.A O no hydrogen 2.902 N/A ARG 114.A NE GLU 110.A OE2 no hydrogen 2.828 N/A ARG 114.A NH1 GLN 167.A OE1 no hydrogen 2.797 N/A ARG 114.A NH1 GLU 168.A OE2 no hydrogen 2.789 N/A ARG 114.A NH2 GLU 110.A OE2 no hydrogen 3.339 N/A ARG 114.A NH2 GLN 167.A OE1 no hydrogen 2.802 N/A SER 115.A N SER 111.A O no hydrogen 3.010 N/A SER 115.A OG PHE 112.A O no hydrogen 2.735 N/A LEU 116.A N PHE 112.A O no hydrogen 3.014 N/A LEU 116.A N ALA 113.A O no hydrogen 3.357 N/A HIS 118.A NE2 GLU 168.A OE1 no hydrogen 2.835 N/A LYS 119.A N SER 115.A O no hydrogen 2.894 N/A ALA 120.A N LEU 116.A O no hydrogen 2.883 N/A ARG 121.A N VAL 117.A O no hydrogen 2.962 N/A GLU 122.A N HIS 118.A O no hydrogen 3.045 N/A ALA 123.A N LYS 119.A O no hydrogen 3.025 N/A LEU 124.A N ALA 120.A O no hydrogen 2.907 N/A GLY 126.A N ARG 121.A O no hydrogen 2.986 N/A ASP 128.A N LYS 49.A O no hydrogen 2.835 N/A ILE 129.A N LYS 49.A O no hydrogen 3.060 N/A LEU 130.A N SER 178.A O no hydrogen 2.977 N/A ALA 131.A N LEU 51.A O no hydrogen 2.868 N/A LEU 132.A N ILE 180.A O no hydrogen 2.802 N/A VAL 133.A N THR 53.A OG1 no hydrogen 2.935 N/A ALA 134.A N THR 53.A OG1 no hydrogen 3.099 N/A LYS 136.A N ASN 158.A OD1 no hydrogen 2.844 N/A GLN 137.A NE2 GLN 235.A OE1 no hydrogen 3.096 N/A GLN 137.A NE2 GLY 239.A O no hydrogen 2.870 N/A ALA 139.A N GLY 238.A O no hydrogen 2.834 N/A ILE 140.A N HIS 193.A O no hydrogen 2.850 N/A ASP 145.A N GLU 142.A O no hydrogen 2.903 N/A LEU 146.A N ILE 143.A O no hydrogen 2.997 N/A SER 148.A OG.A GLN 152.A OE1 no hydrogen 2.891 N/A GLN 150.A N THR 147.A OG1 no hydrogen 2.952 N/A GLN 150.A NE2 THR 138.A O no hydrogen 3.509 N/A GLN 150.A NE2 ASP 196.A OD1 no hydrogen 3.559 N/A GLN 150.A NE2 ASP 196.A OD2 no hydrogen 2.917 N/A PHE 151.A N THR 147.A O no hydrogen 2.964 N/A GLN 152.A N SER 148.A O no hydrogen 2.925 N/A GLN 153.A N GLU 149.A O no hydrogen 2.947 N/A GLN 153.A NE2 SER 108.A OG no hydrogen 3.074 N/A THR 154.A N GLN 150.A O no hydrogen 2.892 N/A THR 154.A OG1 GLN 150.A O no hydrogen 2.968 N/A THR 154.A OG1 ASP 196.A OD2 no hydrogen 3.019 N/A PHE 155.A N PHE 151.A O no hydrogen 3.179 N/A ALA 156.A N GLN 152.A O no hydrogen 2.808 N/A VAL 157.A N GLN 153.A O no hydrogen 2.971 N/A ASN 158.A N THR 154.A O no hydrogen 2.976 N/A ASN 158.A ND2 LYS 136.A O no hydrogen 3.009 N/A ASN 158.A ND2 THR 200.A OG1 no hydrogen 2.949 N/A VAL 159.A N PHE 155.A O no hydrogen 2.837 N/A PHE 160.A N PHE 155.A O no hydrogen 2.872 N/A ALA 161.A N ALA 156.A O no hydrogen 2.917 N/A PHE 163.A N VAL 159.A O no hydrogen 3.097 N/A TRP 164.A N PHE 160.A O no hydrogen 2.814 N/A ILE 165.A N ALA 161.A O no hydrogen 2.960 N/A THR 166.A N LEU 162.A O no hydrogen 2.989 N/A THR 166.A OG1 LEU 162.A O no hydrogen 2.718 N/A THR 166.A OG1 PHE 163.A O no hydrogen 3.346 N/A THR 166.A OG1 TYR 207.A OH no hydrogen 2.748 N/A GLN 167.A N PHE 163.A O no hydrogen 2.839 N/A GLU 168.A N TRP 164.A O no hydrogen 3.202 N/A ALA 169.A N ILE 165.A O no hydrogen 2.950 N/A ILE 170.A N THR 166.A O no hydrogen 3.002 N/A LEU 172.A N ALA 169.A O no hydrogen 2.894 N/A LEU 173.A N ALA 169.A O no hydrogen 3.060 N/A LEU 173.A N ILE 170.A O no hydrogen 3.365 N/A GLY 176.A N GLY 219.A O no hydrogen 2.786 N/A ALA 177.A N PRO 174.A O no hydrogen 3.000 N/A SER 178.A N ASP 128.A O no hydrogen 3.108 N/A SER 178.A OG LEU 270.A O no hydrogen 2.696 N/A ILE 179.A N ARG 221.A O no hydrogen 2.874 N/A ILE 180.A N LEU 130.A O no hydrogen 2.757 N/A THR 181.A N ASN 223.A O no hydrogen 2.880 N/A THR 181.A OG1 SER 208.A OG no hydrogen 2.760 N/A THR 181.A OG1 ASN 223.A O no hydrogen 3.452 N/A THR 182.A OG1 LEU 132.A O no hydrogen 2.869 N/A THR 182.A OG1 TYR 267.A OH no hydrogen 2.786 N/A SER 183.A N VAL 225.A O no hydrogen 2.810 N/A SER 183.A OG LYS 201.A O no hydrogen 2.814 N/A ILE 185.A N PRO 227.A O no hydrogen 2.975 N/A GLN 186.A N SER 184.A OG no hydrogen 2.845 N/A GLN 186.A NE2 SER 191.A OG no hydrogen 2.924 N/A ALA 187.A N SER 184.A O no hydrogen 2.901 N/A TYR 188.A N ILE 185.A O no hydrogen 2.903 N/A GLN 189.A N ILE 185.A O no hydrogen 2.867 N/A SER 191.A N GLN 186.A OE1 no hydrogen 2.801 N/A HIS 193.A N HIS 193.A ND1 no hydrogen 3.049 N/A HIS 193.A NE2 GLN 240.A OE1 no hydrogen 3.209 N/A LEU 194.A N SER 191.A O no hydrogen 3.001 N/A TYR 197.A N ASP 196.A OD1 no hydrogen 2.803 N/A ALA 198.A N LEU 194.A O no hydrogen 2.799 N/A THR 200.A N ASP 196.A O no hydrogen 2.973 N/A THR 200.A OG1 TYR 197.A O no hydrogen 2.676 N/A LYS 201.A N TYR 197.A O no hydrogen 3.033 N/A LYS 201.A NZ THR 182.A O no hydrogen 2.952 N/A ALA 202.A N ALA 198.A O no hydrogen 3.038 N/A ALA 203.A N ALA 199.A O no hydrogen 2.957 N/A ILE 204.A N THR 200.A O no hydrogen 2.841 N/A LEU 205.A N LYS 201.A O no hydrogen 3.175 N/A ASN 206.A N ALA 202.A O no hydrogen 3.071 N/A TYR 207.A N ALA 203.A O no hydrogen 2.873 N/A TYR 207.A OH THR 166.A OG1 no hydrogen 2.748 N/A SER 208.A N ILE 204.A O no hydrogen 2.962 N/A SER 208.A OG THR 181.A OG1 no hydrogen 2.760 N/A SER 208.A OG ILE 204.A O no hydrogen 2.704 N/A ARG 209.A N.A LEU 205.A O no hydrogen 3.157 N/A ARG 209.A N.B LEU 205.A O no hydrogen 3.167 N/A ARG 209.A N.B ASN 206.A O no hydrogen 3.111 N/A ARG 209.A NE.B ALA 280.A O no hydrogen 2.957 N/A ARG 209.A NH1.A ALA 280.A O no hydrogen 2.890 N/A GLY 210.A N ASN 206.A O no hydrogen 3.020 N/A LEU 211.A N TYR 207.A O no hydrogen 2.803 N/A ALA 212.A N SER 208.A O no hydrogen 2.899 N/A LYS 213.A N ARG 209.A O.A no hydrogen 3.063 N/A LYS 213.A N ARG 209.A O.B no hydrogen 3.170 N/A GLN 214.A N GLY 210.A O no hydrogen 3.043 N/A VAL 215.A N LEU 211.A O no hydrogen 2.909 N/A LYS 218.A N VAL 215.A O no hydrogen 2.930 N/A GLY 219.A N ALA 216.A O no hydrogen 2.951 N/A ILE 220.A N VAL 215.A O no hydrogen 3.484 N/A ARG 221.A N ALA 177.A O no hydrogen 3.078 N/A ARG 221.A NH1 LEU 270.A O no hydrogen 3.446 N/A ARG 221.A NH1 VAL 278.A O no hydrogen 3.115 N/A ARG 221.A NH2 LEU 270.A O no hydrogen 3.134 N/A VAL 222.A N THR 279.A OG1 no hydrogen 3.015 N/A ASN 223.A N ILE 179.A O no hydrogen 2.900 N/A ASN 223.A ND2 VAL 278.A O no hydrogen 2.910 N/A ILE 224.A N GLU 281.A O no hydrogen 2.896 N/A VAL 225.A N THR 181.A O no hydrogen 2.875 N/A ALA 226.A N HIS 283.A O no hydrogen 2.798 N/A GLY 228.A N VAL 285.A O no hydrogen 2.874 N/A TRP 231.A N GLY 258.A O no hydrogen 2.903 N/A TRP 231.A NE1 PRO 30.A O no hydrogen 2.835 N/A GLN 235.A N THR 232.A O no hydrogen 3.022 N/A GLN 235.A NE2 GLN 137.A OE1 no hydrogen 2.952 N/A ILE 236.A N ALA 233.A O no hydrogen 3.272 N/A SER 237.A OG ALA 233.A O no hydrogen 2.821 N/A GLY 239.A N LEU 234.A O no hydrogen 3.035 N/A GLN 240.A N GLN 235.A O no hydrogen 3.330 N/A GLN 240.A NE2 GLN 235.A OE1 no hydrogen 2.878 N/A THR 241.A OG1 ASP 243.A OD1 no hydrogen 2.696 N/A GLN 242.A NE2 GLN 17.A O no hydrogen 3.435 N/A LYS 244.A N THR 241.A O no hydrogen 3.026 N/A ILE 245.A N GLN 242.A O no hydrogen 3.211 N/A PHE 248.A N ILE 245.A O no hydrogen 3.041 N/A GLN 250.A N GLN 247.A O no hydrogen 2.941 N/A GLN 250.A NE2 GLU 13.A OE2 no hydrogen 2.701 N/A GLN 251.A N GLN 251.A OE1 no hydrogen 2.694 N/A GLN 251.A NE2 GLU 289.A OE1 no hydrogen 3.470 N/A GLN 251.A NE2 GLU 289.A OE2 no hydrogen 3.082 N/A THR 252.A N GLY 249.A O no hydrogen 3.210 N/A THR 252.A OG1 GLY 249.A O no hydrogen 2.964 N/A THR 252.A OG1 ARG 256.A O no hydrogen 3.152 N/A MET 254.A N GLY 287.A O no hydrogen 3.079 N/A LYS 255.A N THR 252.A O no hydrogen 2.835 N/A LYS 255.A N THR 252.A OG1 no hydrogen 3.175 N/A ARG 256.A NE PRO 5.A O no hydrogen 2.961 N/A ARG 256.A NH1 ALA 257.A O no hydrogen 2.946 N/A ARG 256.A NH1 GLU 262.A OE1 no hydrogen 2.832 N/A ARG 256.A NH1 GLU 262.A OE2 no hydrogen 3.558 N/A ARG 256.A NH2 PRO 5.A O no hydrogen 2.884 N/A ARG 256.A NH2 GLU 262.A OE2 no hydrogen 2.776 N/A GLY 258.A N PRO 229.A O no hydrogen 2.832 N/A GLN 259.A N GLU 262.A OE1 no hydrogen 2.874 N/A ALA 261.A N ASP 33.A O no hydrogen 2.820 N/A GLU 262.A N GLN 259.A O no hydrogen 2.877 N/A LEU 263.A N PRO 260.A O no hydrogen 2.898 N/A ALA 264.A N ALA 261.A O no hydrogen 3.181 N/A TYR 267.A N LEU 263.A O no hydrogen 3.364 N/A TYR 267.A OH THR 182.A OG1 no hydrogen 2.786 N/A VAL 268.A N ALA 264.A O no hydrogen 2.969 N/A TYR 269.A N PRO 265.A O no hydrogen 2.923 N/A LEU 270.A N VAL 266.A O no hydrogen 2.979 N/A ALA 271.A N TYR 267.A O no hydrogen 3.079 N/A SER 272.A N VAL 268.A O no hydrogen 2.865 N/A SER 272.A OG GLU 274.A OE1 no hydrogen 2.706 N/A GLU 274.A N SER 272.A OG no hydrogen 3.039 N/A SER 275.A N SER 272.A O no hydrogen 3.282 N/A SER 275.A OG TYR 269.A O no hydrogen 2.794 N/A SER 275.A OG LEU 270.A O no hydrogen 3.130 N/A SER 275.A OG SER 272.A O no hydrogen 2.992 N/A VAL 278.A N SER 275.A O no hydrogen 2.899 N/A THR 279.A OG1 VAL 222.A O no hydrogen 3.410 N/A ALA 280.A N VAL 222.A O no hydrogen 2.743 N/A GLU 281.A N ASN 223.A OD1 no hydrogen 2.996 N/A HIS 283.A N ILE 224.A O no hydrogen 2.871 N/A HIS 283.A ND1 ILE 224.A O no hydrogen 3.129 N/A VAL 285.A N ALA 226.A O no hydrogen 3.290 N/A CYS 286.A SG ALA 226.A O no hydrogen 3.377 N/A GLU 289.A N CYS 286.A O no hydrogen 3.076 N/A HIS 290.A ND1 LEU 291.A O no hydrogen 2.861 N/A