Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4a94_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 3.A OH GLU 15.A OE2 no hydrogen 2.568 N/A GLY 4.A N ASN 2.A OD1 no hydrogen 2.778 N/A ALA 5.A N ASN 2.A O no hydrogen 3.140 N/A TYR 6.A OH LEU 276.A O no hydrogen 2.736 N/A HIS 7.A NE2 ASN 2.A O no hydrogen 2.822 N/A ALA 11.A N SER 8.A OG no hydrogen 3.124 N/A ILE 12.A N SER 8.A O no hydrogen 3.103 N/A TYR 13.A N LEU 9.A O no hydrogen 2.912 N/A TYR 13.A OH PRO 40.A O no hydrogen 2.685 N/A HIS 14.A N GLU 10.A O no hydrogen 2.925 N/A GLU 15.A N ALA 11.A O no hydrogen 2.954 N/A MET 16.A N ILE 12.A O no hydrogen 3.052 N/A ASP 17.A N TYR 13.A O no hydrogen 3.115 N/A ASN 18.A N HIS 14.A O no hydrogen 2.908 N/A ASN 18.A ND2 GLU 15.A OE1 no hydrogen 3.201 N/A ILE 19.A N GLU 15.A O no hydrogen 2.895 N/A ALA 20.A N MET 16.A O no hydrogen 3.106 N/A ALA 21.A N ASP 17.A O no hydrogen 2.938 N/A ASP 22.A N ASN 18.A O no hydrogen 2.973 N/A PHE 23.A N ILE 19.A O no hydrogen 3.153 N/A LEU 26.A N PHE 23.A O no hydrogen 2.987 N/A ALA 27.A N PHE 23.A O no hydrogen 2.821 N/A ARG 28.A N LYS 45.A O no hydrogen 3.073 N/A ARG 29.A NH1 TYR 13.A O no hydrogen 2.995 N/A VAL 30.A N VAL 43.A O no hydrogen 2.683 N/A ILE 32.A N MET 41.A O no hydrogen 3.168 N/A HIS 34.A ND1 SER 35.A O no hydrogen 2.704 N/A SER 35.A N ARG 39.A O no hydrogen 2.764 N/A SER 35.A OG ARG 39.A O no hydrogen 3.498 N/A SER 35.A OG ASP 109.A OD1 no hydrogen 2.695 N/A SER 35.A OG ASP 109.A OD2 no hydrogen 3.113 N/A PHE 36.A N GLU 170.A OE2 no hydrogen 2.993 N/A GLU 37.A N ASP 109.A OD2 no hydrogen 2.866 N/A ASN 38.A N SER 35.A O no hydrogen 3.006 N/A ARG 39.A N SER 35.A OG no hydrogen 2.941 N/A ARG 39.A NH1 GLU 37.A OE1 no hydrogen 2.630 N/A ARG 39.A NH1 ASP 109.A OD1 no hydrogen 2.933 N/A MET 41.A N GLY 33.A O no hydrogen 2.904 N/A VAL 43.A N VAL 30.A O no hydrogen 2.851 N/A LEU 44.A N LEU 102.A O no hydrogen 2.863 N/A LYS 45.A N ARG 28.A O no hydrogen 2.924 N/A PHE 46.A N ILE 100.A O no hydrogen 2.831 N/A SER 47.A N LEU 26.A O no hydrogen 2.885 N/A SER 47.A OG ASP 99.A OD1 no hydrogen 2.654 N/A THR 48.A OG1 LEU 95.A O no hydrogen 2.691 N/A GLY 49.A N SER 47.A OG no hydrogen 3.292 N/A ARG 54.A N GLY 51.A O no hydrogen 3.199 N/A ARG 54.A NE ASP 99.A OD1 no hydrogen 3.130 N/A ARG 54.A NH2 GLU 96.A O no hydrogen 3.288 N/A ALA 56.A N ASN 183.A O no hydrogen 3.136 N/A VAL 57.A N ASP 99.A O no hydrogen 2.842 N/A TRP 58.A N GLY 186.A O no hydrogen 2.893 N/A TRP 58.A NE1 ASN 60.A OD1 no hydrogen 3.002 N/A LEU 59.A N PHE 101.A O no hydrogen 2.756 N/A ASN 60.A N ILE 188.A O no hydrogen 2.749 N/A ASN 60.A ND2 ASP 189.A OD1 no hydrogen 2.939 N/A ALA 61.A N LEU 103.A O no hydrogen 2.939 N/A HIS 64.A NE2 ASP 137.A OD1 no hydrogen 2.614 N/A SER 65.A N ARG 122.A O no hydrogen 3.470 N/A SER 65.A OG TRP 121.A O no hydrogen 2.789 N/A ARG 66.A NH1 LEU 120.A O no hydrogen 2.878 N/A ARG 66.A NH1 GLU 158.A OE2 no hydrogen 3.304 N/A ARG 66.A NH2 GLU 158.A OE1 no hydrogen 2.818 N/A ARG 66.A NH2 GLU 158.A OE2 no hydrogen 3.362 N/A GLU 67.A N HIS 64.A O no hydrogen 3.123 N/A TRP 68.A NE1 THR 114.A OG1 no hydrogen 2.874 N/A SER 70.A N GLU 67.A O no hydrogen 2.800 N/A SER 70.A OG GLU 67.A O no hydrogen 2.624 N/A GLN 71.A NE2 GLU 67.A O no hydrogen 3.035 N/A ALA 72.A N TRP 68.A O no hydrogen 3.139 N/A THR 73.A N ILE 69.A O no hydrogen 2.851 N/A THR 73.A OG1 ILE 69.A O no hydrogen 2.862 N/A ALA 74.A N SER 70.A O no hydrogen 2.877 N/A ILE 75.A N GLN 71.A O no hydrogen 3.034 N/A TRP 76.A N ALA 72.A O no hydrogen 3.256 N/A THR 77.A N THR 73.A O no hydrogen 2.909 N/A THR 77.A OG1 THR 73.A O no hydrogen 2.695 N/A ALA 78.A N ALA 74.A O no hydrogen 3.021 N/A ARG 79.A N ILE 75.A O no hydrogen 3.298 N/A ARG 79.A NE TYR 3.A OH no hydrogen 2.874 N/A ARG 79.A NH1 ASP 22.A OD2 no hydrogen 3.053 N/A ARG 79.A NH2 TYR 3.A OH no hydrogen 3.565 N/A ARG 79.A NH2 GLU 15.A OE2 no hydrogen 2.905 N/A LYS 80.A N TRP 76.A O no hydrogen 2.821 N/A LYS 80.A NZ ASP 84.A OD2 no hydrogen 3.016 N/A ILE 81.A N THR 77.A O no hydrogen 2.880 N/A VAL 82.A N ALA 78.A O no hydrogen 3.343 N/A SER 83.A N ARG 79.A O no hydrogen 2.914 N/A SER 83.A OG ARG 79.A O no hydrogen 2.692 N/A ASP 84.A N LYS 80.A O no hydrogen 2.946 N/A TYR 85.A N ILE 81.A O no hydrogen 3.056 N/A GLN 86.A N THR 92.A OG1 no hydrogen 2.800 N/A GLN 86.A NE2 TYR 85.A OH no hydrogen 3.467 N/A GLN 86.A NE2 GLU 96.A OE2 no hydrogen 3.525 N/A ARG 87.A N ASP 84.A O no hydrogen 2.878 N/A ARG 87.A NH1 SER 83.A O no hydrogen 3.344 N/A ASP 88.A N ASP 84.A O no hydrogen 2.902 N/A ALA 90.A N ASP 88.A OD1 no hydrogen 2.976 N/A ILE 91.A N ASP 88.A OD2 no hydrogen 3.063 N/A THR 92.A N ASP 88.A O no hydrogen 3.223 N/A THR 92.A OG1 ASP 88.A O no hydrogen 2.644 N/A SER 93.A N PRO 89.A O no hydrogen 3.032 N/A SER 93.A OG PRO 89.A O no hydrogen 3.240 N/A SER 93.A OG ALA 90.A O no hydrogen 3.269 N/A ILE 94.A N ALA 90.A O no hydrogen 3.020 N/A LEU 95.A N ILE 91.A O no hydrogen 3.058 N/A GLU 96.A N THR 92.A O no hydrogen 2.917 N/A LYS 97.A N SER 93.A O no hydrogen 3.150 N/A LYS 97.A N ILE 94.A O no hydrogen 3.022 N/A MET 98.A N ILE 94.A O no hydrogen 2.931 N/A ASP 99.A N PRO 55.A O no hydrogen 3.015 N/A ILE 100.A N PHE 46.A O no hydrogen 3.058 N/A PHE 101.A N VAL 57.A O no hydrogen 2.847 N/A LEU 102.A N LEU 44.A O no hydrogen 2.893 N/A LEU 103.A N LEU 59.A O no hydrogen 2.901 N/A ALA 106.A N ALA 61.A O no hydrogen 2.837 N/A ASN 107.A ND2 ILE 63.A O no hydrogen 3.089 N/A ASN 107.A ND2 LYS 123.A O no hydrogen 2.993 N/A GLY 110.A N ASN 107.A OD1 no hydrogen 3.137 N/A TYR 111.A N ASN 107.A O no hydrogen 3.144 N/A TYR 111.A OH HIS 7.A O no hydrogen 2.634 N/A VAL 112.A N PRO 108.A O no hydrogen 3.030 N/A TYR 113.A N ASP 109.A O no hydrogen 3.021 N/A THR 114.A N GLY 110.A O no hydrogen 2.881 N/A THR 114.A OG1 TYR 111.A O no hydrogen 2.744 N/A GLN 115.A N VAL 112.A O no hydrogen 2.961 N/A THR 116.A N TYR 113.A O no hydrogen 3.227 N/A THR 116.A OG1 VAL 112.A O no hydrogen 3.201 N/A GLN 117.A N TYR 113.A O no hydrogen 2.873 N/A ASN 118.A N TYR 113.A O no hydrogen 3.069 N/A ARG 119.A NH1 ARG 66.A O no hydrogen 2.934 N/A ARG 119.A NH1 ARG 119.A O no hydrogen 2.923 N/A ARG 119.A NH2 PHE 274.A O no hydrogen 3.040 N/A TRP 121.A N ASN 118.A O no hydrogen 3.055 N/A TRP 121.A NE1 THR 124.A O no hydrogen 3.117 N/A ARG 122.A NE ASP 137.A OD2 no hydrogen 3.081 N/A ARG 122.A NE GLU 158.A O no hydrogen 3.134 N/A ARG 122.A NH2 ASP 137.A OD2 no hydrogen 2.769 N/A LYS 123.A NZ ILE 134.A O no hydrogen 3.117 N/A LYS 123.A NZ GLY 135.A O no hydrogen 3.031 N/A LYS 123.A NZ SER 157.A O no hydrogen 3.070 N/A THR 124.A N ALA 136.A O no hydrogen 2.938 N/A THR 124.A OG1 SER 126.A OG no hydrogen 3.324 N/A THR 124.A OG1 ALA 136.A O no hydrogen 3.365 N/A THR 124.A OG1 GLU 168.A OE1 no hydrogen 2.683 N/A SER 126.A OG THR 124.A OG1 no hydrogen 3.324 N/A SER 126.A OG GLU 168.A OE1 no hydrogen 2.673 N/A ASN 128.A ND2 CYS 133.A O no hydrogen 2.956 N/A ASN 128.A ND2 GLY 135.A O no hydrogen 3.300 N/A SER 131.A N ASN 128.A O no hydrogen 2.950 N/A CYS 133.A N SER 131.A OG no hydrogen 2.972 N/A GLY 135.A N SER 126.A O no hydrogen 2.837 N/A ALA 136.A N THR 124.A OG1 no hydrogen 3.080 N/A ASP 137.A N TYR 160.A O no hydrogen 2.805 N/A ASN 139.A N ASP 137.A OD1 no hydrogen 2.808 N/A ARG 140.A N ASP 137.A O no hydrogen 2.979 N/A ARG 140.A NE GLY 150.A O no hydrogen 3.036 N/A ARG 140.A NH1 ASN 139.A O no hydrogen 2.888 N/A ASN 141.A ND2 HIS 161.A O no hydrogen 2.905 N/A ASN 141.A ND2 HIS 164.A O no hydrogen 3.261 N/A ASN 141.A ND2 SER 167.A OG no hydrogen 2.957 N/A TRP 142.A N GLY 247.A O no hydrogen 2.871 N/A ALA 144.A N TRP 142.A O no hydrogen 2.875 N/A GLY 148.A N SER 145.A O no hydrogen 2.965 N/A SER 152.A N VAL 159.A O no hydrogen 2.986 N/A ASN 154.A N SER 152.A OG no hydrogen 2.959 N/A CYS 156.A N ASN 154.A OD1 no hydrogen 2.820 N/A SER 157.A N ASN 154.A O no hydrogen 2.880 N/A VAL 159.A N SER 157.A OG no hydrogen 2.997 N/A TYR 160.A N SER 157.A O no hydrogen 3.383 N/A HIS 161.A N SER 152.A O no hydrogen 3.100 N/A HIS 161.A ND1 GLY 162.A O no hydrogen 2.694 N/A HIS 161.A NE2 ASP 153.A OD1 no hydrogen 2.676 N/A HIS 164.A ND1 ALA 165.A O no hydrogen 3.022 N/A ASN 166.A N ASN 141.A O no hydrogen 2.831 N/A SER 167.A N HIS 164.A O no hydrogen 3.128 N/A SER 167.A OG HIS 164.A O no hydrogen 3.271 N/A SER 167.A OG GLU 168.A OE2 no hydrogen 2.824 N/A GLU 168.A N ASN 141.A OD1 no hydrogen 2.997 N/A GLU 170.A N GLU 170.A OE1 no hydrogen 2.783 N/A VAL 171.A N GLU 168.A O no hydrogen 2.895 N/A LYS 172.A N GLU 168.A O no hydrogen 2.887 N/A LYS 172.A NZ ASP 176.A OD2 no hydrogen 2.710 N/A SER 173.A N VAL 169.A O no hydrogen 2.857 N/A SER 173.A OG VAL 169.A O no hydrogen 2.679 N/A VAL 175.A N VAL 171.A O no hydrogen 2.941 N/A ASP 176.A N LYS 172.A O no hydrogen 2.809 N/A PHE 177.A N SER 173.A O no hydrogen 3.117 N/A ILE 178.A N VAL 174.A O no hydrogen 2.960 N/A GLN 179.A N VAL 175.A O no hydrogen 2.937 N/A LYS 180.A N ASP 176.A O no hydrogen 2.952 N/A HIS 181.A N PHE 177.A O no hydrogen 2.890 N/A GLY 182.A N ILE 178.A O no hydrogen 2.926 N/A LYS 185.A N ALA 56.A O no hydrogen 2.871 N/A PHE 187.A N PHE 260.A O no hydrogen 2.987 N/A ILE 188.A N TRP 58.A O no hydrogen 2.906 N/A ASP 189.A N PHE 262.A O no hydrogen 2.897 N/A LEU 190.A N ASN 60.A O no hydrogen 2.737 N/A HIS 191.A N PHE 264.A O no hydrogen 2.752 N/A HIS 191.A NE2 ASP 189.A OD2 no hydrogen 2.682 N/A SER 192.A N GLU 67.A OE1 no hydrogen 2.960 N/A SER 194.A N LEU 266.A O no hydrogen 3.102 N/A SER 194.A OG TYR 193.A O no hydrogen 2.515 N/A GLN 195.A N LEU 266.A O no hydrogen 3.288 N/A GLN 195.A NE2 GLU 232.A O no hydrogen 3.023 N/A LEU 196.A N GLU 265.A O no hydrogen 3.081 N/A LEU 197.A N GLN 234.A O no hydrogen 2.856 N/A MET 198.A N THR 263.A O no hydrogen 2.848 N/A TYR 199.A N GLY 236.A O no hydrogen 3.164 N/A TYR 199.A OH ASP 215.A OD2 no hydrogen 2.695 N/A TYR 201.A OH ASP 255.A OD1 no hydrogen 2.667 N/A GLY 202.A N ASP 251.A OD2 no hydrogen 2.669 N/A TYR 203.A N ASP 251.A OD2 no hydrogen 3.143 N/A TYR 203.A OH ASP 255.A OD2 no hydrogen 2.620 N/A LYS 206.A N SER 204.A OG no hydrogen 2.882 N/A LYS 206.A NZ TYR 203.A OH no hydrogen 3.225 N/A LYS 207.A NZ ALA 208.A O no hydrogen 3.021 N/A ASP 210.A N TYR 254.A OH no hydrogen 3.077 N/A ALA 211.A N ALA 208.A O no hydrogen 2.881 N/A LEU 214.A N ASP 210.A O no hydrogen 2.916 N/A ASP 215.A N ALA 211.A O no hydrogen 2.860 N/A LYS 216.A N GLU 212.A O no hydrogen 3.125 N/A VAL 217.A N GLU 213.A O no hydrogen 2.837 N/A ALA 218.A N LEU 214.A O no hydrogen 2.824 N/A ARG 219.A N ASP 215.A O no hydrogen 2.919 N/A ARG 219.A NE ASP 215.A OD1 no hydrogen 2.880 N/A LEU 220.A N LYS 216.A O no hydrogen 3.073 N/A ALA 221.A N VAL 217.A O no hydrogen 2.896 N/A ALA 222.A N ALA 218.A O no hydrogen 2.850 N/A LYS 223.A N ARG 219.A O no hydrogen 3.035 N/A ALA 224.A N LEU 220.A O no hydrogen 3.072 N/A LEU 225.A N ALA 221.A O no hydrogen 2.935 N/A ALA 226.A N ALA 222.A O no hydrogen 2.965 N/A SER 227.A N ALA 224.A O no hydrogen 3.141 N/A SER 227.A OG ALA 224.A O no hydrogen 2.704 N/A VAL 228.A N LEU 225.A O no hydrogen 3.496 N/A SER 229.A OG GLU 287.A OE1 no hydrogen 3.364 N/A GLY 230.A N ALA 226.A O no hydrogen 2.780 N/A THR 231.A OG1 GLU 287.A OE1 no hydrogen 2.673 N/A THR 231.A OG1 GLU 287.A OE2 no hydrogen 3.487 N/A GLN 234.A N GLN 195.A O no hydrogen 3.130 N/A GLY 236.A N LEU 197.A O no hydrogen 3.383 N/A THR 238.A N TYR 199.A O no hydrogen 2.938 N/A THR 238.A OG1 TYR 199.A O no hydrogen 3.412 N/A CYS 239.A N TYR 201.A O no hydrogen 2.893 N/A CYS 239.A SG GLY 202.A O no hydrogen 3.753 N/A THR 241.A N THR 238.A O no hydrogen 3.047 N/A THR 241.A OG1 PRO 237.A O no hydrogen 2.709 N/A VAL 242.A N THR 238.A O no hydrogen 2.982 N/A ALA 245.A N GLY 202.A O no hydrogen 2.920 N/A SER 246.A N GLY 150.A O no hydrogen 2.977 N/A SER 246.A OG GLY 148.A O no hydrogen 3.036 N/A GLY 247.A N ALA 144.A O no hydrogen 2.875 N/A SER 249.A N ASN 139.A OD1 no hydrogen 2.860 N/A SER 249.A OG ASN 139.A OD1 no hydrogen 3.331 N/A SER 249.A OG ASP 189.A OD2 no hydrogen 2.739 N/A TRP 252.A N SER 248.A O no hydrogen 3.145 N/A ALA 253.A N SER 249.A O no hydrogen 2.910 N/A TYR 254.A N ILE 250.A O no hydrogen 2.901 N/A TYR 254.A OH ASP 210.A OD2 no hydrogen 2.629 N/A ASP 255.A N ASP 251.A O no hydrogen 2.935 N/A ASN 256.A N TRP 252.A O no hydrogen 2.959 N/A ASN 256.A N ALA 253.A O no hydrogen 3.158 N/A ASN 256.A ND2 TRP 252.A O no hydrogen 2.819 N/A GLY 257.A N TYR 254.A O no hydrogen 3.389 N/A ILE 258.A N ALA 253.A O no hydrogen 2.935 N/A LYS 259.A NZ GLU 213.A OE1 no hydrogen 2.881 N/A LYS 259.A NZ GLU 213.A OE2 no hydrogen 3.413 N/A PHE 260.A N LYS 185.A O no hydrogen 3.133 N/A ALA 261.A N LYS 259.A O no hydrogen 3.026 N/A PHE 262.A N PHE 187.A O no hydrogen 2.961 N/A THR 263.A N MET 198.A O no hydrogen 2.833 N/A PHE 264.A N ASP 189.A O no hydrogen 2.954 N/A GLU 265.A N LEU 196.A O no hydrogen 2.788 N/A LEU 266.A N HIS 191.A O no hydrogen 2.804 N/A ARG 267.A NE GLU 287.A OE2 no hydrogen 2.754 N/A ARG 267.A NH1 GLN 280.A OE1 no hydrogen 3.034 N/A ARG 267.A NH2 GLU 287.A OE1 no hydrogen 2.867 N/A ARG 267.A NH2 GLU 287.A OE2 no hydrogen 3.465 N/A GLY 270.A N ASP 268.A OD1 no hydrogen 2.891 N/A TYR 272.A N ASP 268.A OD2 no hydrogen 2.744 N/A GLY 273.A N ASP 268.A OD1 no hydrogen 2.922 N/A LEU 275.A N TYR 272.A O no hydrogen 3.077 N/A GLN 280.A N PRO 277.A O no hydrogen 2.987 N/A ILE 281.A N ALA 278.A O no hydrogen 2.948 N/A THR 284.A N GLN 280.A O no hydrogen 2.908 N/A THR 284.A OG1 GLN 280.A O no hydrogen 2.761 N/A ALA 285.A N ILE 281.A O no hydrogen 2.814 N/A GLU 286.A N ILE 282.A O no hydrogen 2.882 N/A GLU 287.A N PRO 283.A O no hydrogen 3.256 N/A THR 288.A N THR 284.A O no hydrogen 2.918 N/A THR 288.A OG1 THR 284.A O no hydrogen 2.777 N/A TRP 289.A N ALA 285.A O no hydrogen 2.969 N/A LEU 290.A N GLU 287.A O no hydrogen 3.220 N/A GLY 291.A N GLU 287.A O no hydrogen 3.449 N/A LEU 292.A N THR 288.A O no hydrogen 2.836 N/A LYS 293.A N TRP 289.A O no hydrogen 2.927 N/A LYS 293.A NZ ASP 88.A OD2 no hydrogen 3.143 N/A THR 294.A N LEU 290.A O no hydrogen 3.147 N/A THR 294.A OG1 LEU 290.A O no hydrogen 2.951 N/A ILE 295.A N GLY 291.A O no hydrogen 3.167 N/A MET 296.A N LEU 292.A O no hydrogen 2.977 N/A GLU 297.A N LYS 293.A O no hydrogen 2.723 N/A HIS 298.A N THR 294.A O no hydrogen 3.211 N/A HIS 298.A NE2 GLU 213.A OE2 no hydrogen 2.714 N/A VAL 299.A N ILE 295.A O no hydrogen 2.972 N/A ARG 300.A N MET 296.A O no hydrogen 2.912 N/A ARG 300.A NE ASP 301.A OD1 no hydrogen 2.829 N/A ARG 300.A NH1 SER 93.A OG no hydrogen 2.845 N/A ARG 300.A NH2 ASP 301.A OD1 no hydrogen 3.388 N/A ARG 300.A NH2 ASP 301.A OD2 no hydrogen 3.026 N/A ASP 301.A N GLU 297.A O no hydrogen 2.953 N/A ASP 301.A N HIS 298.A O no hydrogen 3.172 N/A ASN 302.A N VAL 299.A O no hydrogen 3.244 N/A ASN 302.A ND2 ASP 301.A O no hydrogen 3.348 N/A