Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2dck_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 2.A N MET 27.A O no hydrogen 2.758 N/A ASN 5.A ND2 LYS 19.A O no hydrogen 3.402 N/A GLU 6.A N PHE 17.A O no hydrogen 3.104 N/A GLY 8.A N TYR 15.A O no hydrogen 3.139 N/A THR 9.A OG1 ASP 14.A OD2 no hydrogen 2.957 N/A HIS 10.A N TYR 13.A O no hydrogen 2.760 N/A TYR 13.A N HIS 10.A O no hydrogen 2.960 N/A ASP 14.A N GLY 50.A O no hydrogen 2.786 N/A TYR 15.A N GLY 8.A O no hydrogen 2.837 N/A TYR 15.A OH GLU 6.A OE1 no hydrogen 2.566 N/A GLU 16.A N ARG 48.A O no hydrogen 3.060 N/A PHE 17.A N GLU 6.A O no hydrogen 2.982 N/A TRP 18.A N LEU 46.A O no hydrogen 2.973 N/A LYS 19.A N ASN 5.A OD1 no hydrogen 2.827 N/A LYS 19.A NZ ASP 20.A O no hydrogen 2.871 N/A LYS 19.A NZ GLY 22.A O no hydrogen 2.643 N/A LYS 19.A NZ GLY 23.A O no hydrogen 3.227 N/A ASP 20.A N ASN 44.A O no hydrogen 3.146 N/A SER 24.A N SER 40.A O no hydrogen 3.110 N/A SER 24.A OG SER 40.A OG no hydrogen 3.257 N/A SER 26.A N GLN 38.A O no hydrogen 2.788 N/A MET 27.A N ILE 2.A O no hydrogen 2.835 N/A THR 28.A N SER 36.A O no hydrogen 2.845 N/A ASN 30.A N THR 34.A O no hydrogen 2.882 N/A GLY 32.A N ASP 11.A OD2 no hydrogen 2.644 N/A THR 34.A N SER 31.A O no hydrogen 3.129 N/A THR 34.A OG1 SER 31.A O no hydrogen 2.582 N/A PHE 35.A N VAL 193.A O no hydrogen 3.196 N/A SER 36.A N THR 28.A O no hydrogen 2.800 N/A ALA 37.A N ALA 191.A O no hydrogen 2.889 N/A GLN 38.A N SER 26.A O no hydrogen 2.891 N/A TRP 39.A N GLY 189.A O no hydrogen 2.930 N/A TRP 39.A NE1 SER 187.A OG no hydrogen 3.078 N/A SER 40.A N SER 24.A O no hydrogen 2.971 N/A SER 40.A OG SER 24.A OG no hydrogen 3.257 N/A ASN 41.A N SER 188.A OG no hydrogen 2.954 N/A VAL 42.A N SER 187.A O no hydrogen 3.198 N/A ASN 43.A ND2 SER 21.A O no hydrogen 2.989 N/A ASN 44.A N ASP 20.A OD2 no hydrogen 3.020 N/A ASN 44.A ND2 ASP 20.A OD1 no hydrogen 2.755 N/A ILE 45.A N GLY 184.A O no hydrogen 3.035 N/A LEU 46.A N TRP 18.A O no hydrogen 2.766 N/A PHE 47.A N VAL 182.A O no hydrogen 2.953 N/A ARG 48.A N GLU 16.A O no hydrogen 3.080 N/A ARG 48.A NE GLU 177.A OE1 no hydrogen 2.995 N/A ARG 48.A NE GLU 177.A OE2 no hydrogen 3.299 N/A ARG 48.A NH2 GLU 177.A OE2 no hydrogen 2.715 N/A LYS 49.A N LEU 180.A O no hydrogen 3.247 N/A LYS 49.A NZ HIS 10.A ND1 no hydrogen 2.829 N/A LYS 49.A NZ GLY 32.A O no hydrogen 2.770 N/A LYS 49.A NZ THR 34.A O no hydrogen 3.143 N/A GLY 50.A N ASP 14.A O no hydrogen 2.912 N/A LYS 51.A N VAL 178.A O no hydrogen 2.896 N/A LYS 52.A N ASP 14.A OD1 no hydrogen 2.869 N/A LYS 52.A NZ GLU 16.A OE2 no hydrogen 2.847 N/A LYS 52.A NZ GLU 177.A OE1 no hydrogen 2.607 N/A PHE 53.A N TYR 176.A O no hydrogen 2.839 N/A THR 56.A OG1 ASP 54.A OD2 no hydrogen 2.662 N/A THR 58.A N GLN 61.A OE1 no hydrogen 3.075 N/A THR 58.A OG1 GLN 60.A OE1 no hydrogen 3.476 N/A HIS 59.A NE2 GLU 166.A OE1 no hydrogen 2.848 N/A GLN 60.A N GLN 60.A OE1 no hydrogen 2.897 N/A GLN 61.A N THR 58.A OG1 no hydrogen 3.126 N/A ILE 62.A N THR 58.A O no hydrogen 3.116 N/A GLY 63.A N HIS 59.A O no hydrogen 2.967 N/A MET 65.A N SER 159.A OG no hydrogen 2.749 N/A SER 66.A N THR 199.A O no hydrogen 3.103 N/A ILE 67.A N ILE 156.A O no hydrogen 2.895 N/A ASN 68.A N THR 197.A O no hydrogen 2.992 N/A ASN 68.A ND2 THR 155.A OG1 no hydrogen 3.278 N/A TYR 69.A N GLY 154.A O no hydrogen 2.849 N/A TYR 69.A OH ASP 98.A OD2 no hydrogen 2.650 N/A GLY 70.A N SER 195.A O no hydrogen 2.770 N/A ALA 71.A N THR 152.A O no hydrogen 2.840 N/A THR 72.A N ASN 192.A O no hydrogen 2.816 N/A TYR 73.A OH SER 79.A OG no hydrogen 2.733 N/A ASN 74.A N SER 190.A O no hydrogen 2.916 N/A ASN 76.A N SER 188.A O no hydrogen 2.694 N/A SER 79.A OG TYR 73.A OH no hydrogen 2.733 N/A SER 79.A OG GLU 183.A O no hydrogen 2.695 N/A TYR 80.A N GLU 183.A O no hydrogen 2.848 N/A LEU 81.A N SER 99.A O no hydrogen 2.695 N/A THR 82.A N THR 181.A O no hydrogen 3.025 N/A THR 82.A OG1 VAL 83.A O no hydrogen 2.734 N/A THR 82.A OG1 ILE 96.A O no hydrogen 3.012 N/A VAL 83.A N ILE 96.A O no hydrogen 2.669 N/A TYR 84.A N ALA 179.A O no hydrogen 2.762 N/A TYR 84.A OH GLU 93.A OE2 no hydrogen 2.592 N/A GLY 85.A N PHE 94.A O no hydrogen 3.185 N/A TRP 86.A N GLU 177.A O no hydrogen 3.264 N/A THR 87.A N VAL 92.A O no hydrogen 2.874 N/A THR 87.A OG1 PRO 90.A O no hydrogen 2.794 N/A VAL 88.A N ASN 174.A O no hydrogen 2.781 N/A VAL 92.A N THR 87.A O no hydrogen 3.100 N/A GLU 93.A N GLN 141.A O no hydrogen 3.175 N/A PHE 94.A N GLY 85.A O no hydrogen 2.870 N/A TYR 95.A N TYR 143.A O no hydrogen 2.935 N/A TYR 95.A OH GLU 183.A OE2 no hydrogen 2.799 N/A ILE 96.A N VAL 83.A O no hydrogen 2.816 N/A VAL 97.A N SER 145.A O no hydrogen 2.814 N/A ASP 98.A N LEU 81.A O no hydrogen 2.988 N/A SER 99.A N LEU 81.A O no hydrogen 3.274 N/A GLY 101.A N SER 79.A O no hydrogen 3.016 N/A THR 102.A N GLY 77.A O no hydrogen 3.027 N/A ARG 104.A NE ARG 147.A O no hydrogen 3.078 N/A ARG 104.A NH1 GLN 122.A OE1 no hydrogen 3.022 N/A ARG 104.A NH1 VAL 146.A O no hydrogen 3.022 N/A ARG 104.A NH1 ARG 147.A O no hydrogen 3.129 N/A ARG 104.A NH2 GLN 122.A OE1 no hydrogen 3.056 N/A LYS 111.A N ILE 123.A O no hydrogen 2.757 N/A ILE 114.A N TYR 121.A O no hydrogen 2.847 N/A VAL 116.A N GLY 119.A O no hydrogen 3.051 N/A GLY 119.A N VAL 116.A O no hydrogen 2.873 N/A THR 120.A OG1 ASN 115.A OD1 no hydrogen 2.723 N/A TYR 121.A N ILE 114.A O no hydrogen 2.812 N/A TYR 121.A OH ASP 98.A OD1 no hydrogen 2.598 N/A GLN 122.A N VAL 146.A O no hydrogen 2.986 N/A ILE 123.A N GLY 112.A O no hydrogen 2.931 N/A TYR 124.A N TRP 144.A O no hydrogen 2.931 N/A THR 126.A N GLN 142.A O no hydrogen 2.983 N/A THR 127.A OG1 GLN 141.A OE1 no hydrogen 2.952 N/A ARG 128.A N PHE 140.A O no hydrogen 2.768 N/A ASN 130.A N THR 139.A OG1 no hydrogen 3.063 N/A GLN 131.A N ALA 138.A O no hydrogen 2.927 N/A SER 133.A OG GLY 136.A O no hydrogen 2.640 N/A LYS 135.A N SER 133.A OG no hydrogen 2.907 N/A LYS 135.A NZ GLU 55.A OE1 no hydrogen 3.047 N/A LYS 135.A NZ GLU 55.A OE2 no hydrogen 3.064 N/A GLY 136.A N SER 133.A O no hydrogen 3.144 N/A ALA 138.A N GLN 131.A O no hydrogen 3.031 N/A PHE 140.A N ARG 128.A O no hydrogen 2.916 N/A GLN 141.A NE2 GLU 125.A OE1 no hydrogen 2.935 N/A GLN 142.A N THR 126.A O no hydrogen 2.840 N/A GLN 142.A NE2 GLU 93.A OE1 no hydrogen 2.789 N/A TYR 143.A N GLU 93.A O no hydrogen 2.980 N/A TYR 143.A OH ASN 171.A O no hydrogen 2.355 N/A TRP 144.A N TYR 124.A O no hydrogen 3.035 N/A TRP 144.A NE1 GLN 142.A OE1 no hydrogen 2.912 N/A SER 145.A N TYR 95.A O no hydrogen 2.885 N/A SER 145.A OG HIS 161.A ND1 no hydrogen 2.879 N/A VAL 146.A N GLN 122.A O no hydrogen 2.930 N/A ARG 147.A N VAL 97.A O no hydrogen 2.970 N/A ARG 147.A NH1 SER 149.A O no hydrogen 2.896 N/A THR 148.A N THR 120.A O no hydrogen 2.809 N/A THR 148.A OG1 THR 120.A O no hydrogen 3.365 N/A LYS 150.A NZ TRP 100.A O no hydrogen 2.617 N/A LYS 150.A NZ GLY 101.A O no hydrogen 3.020 N/A ARG 151.A N ASP 98.A O no hydrogen 3.080 N/A ARG 151.A NE ASP 98.A OD2 no hydrogen 2.866 N/A ARG 151.A NH1 ASP 98.A OD2 no hydrogen 3.062 N/A ARG 151.A NH1 THR 155.A O no hydrogen 2.838 N/A GLY 154.A N TYR 69.A O no hydrogen 2.892 N/A ILE 156.A N ILE 67.A O no hydrogen 2.654 N/A SER 157.A N ASP 117.A OD1 no hydrogen 2.765 N/A SER 157.A OG ASP 117.A OD1 no hydrogen 3.388 N/A SER 157.A OG ASP 117.A OD2 no hydrogen 2.593 N/A SER 159.A N MET 65.A O no hydrogen 3.293 N/A HIS 161.A N SER 157.A O no hydrogen 3.322 N/A HIS 161.A ND1 SER 145.A OG no hydrogen 2.879 N/A PHE 162.A N VAL 158.A O no hydrogen 3.020 N/A ARG 163.A N SER 159.A O no hydrogen 2.922 N/A ALA 164.A N GLU 160.A O no hydrogen 3.105 N/A TRP 165.A N HIS 161.A O no hydrogen 2.985 N/A TRP 165.A NE1 SER 145.A OG no hydrogen 3.042 N/A GLU 166.A N PHE 162.A O no hydrogen 3.072 N/A SER 167.A N ARG 163.A O no hydrogen 2.958 N/A SER 167.A OG ALA 164.A O no hydrogen 2.767 N/A LEU 168.A N ALA 164.A O no hydrogen 3.124 N/A LEU 168.A N TRP 165.A O no hydrogen 2.914 N/A GLY 169.A N GLU 166.A O no hydrogen 2.939 N/A MET 170.A N TRP 165.A O no hydrogen 2.974 N/A GLY 173.A N THR 87.A OG1 no hydrogen 3.013 N/A MET 175.A N GLN 57.A O no hydrogen 2.968 N/A TYR 176.A N TRP 86.A O no hydrogen 2.841 N/A GLU 177.A N TRP 86.A O no hydrogen 3.216 N/A VAL 178.A N LYS 51.A O no hydrogen 3.000 N/A ALA 179.A N TYR 84.A O no hydrogen 2.895 N/A THR 181.A N THR 82.A O no hydrogen 2.822 N/A THR 181.A OG1 ALA 179.A O no hydrogen 3.007 N/A VAL 182.A N PHE 47.A O no hydrogen 2.692 N/A GLU 183.A N TYR 80.A O no hydrogen 3.035 N/A GLY 184.A N ILE 45.A O no hydrogen 3.024 N/A TYR 185.A N ASN 78.A O no hydrogen 2.967 N/A GLN 186.A N ASN 43.A O no hydrogen 2.992 N/A SER 187.A OG ASN 78.A O no hydrogen 2.711 N/A SER 187.A OG TYR 185.A O no hydrogen 3.494 N/A SER 188.A N ASN 76.A O no hydrogen 3.184 N/A GLY 189.A N TRP 39.A O no hydrogen 2.793 N/A SER 190.A N ASN 74.A O no hydrogen 3.056 N/A ALA 191.A N ALA 37.A O no hydrogen 2.807 N/A ASN 192.A N THR 72.A O no hydrogen 2.692 N/A VAL 193.A N PHE 35.A O no hydrogen 2.802 N/A TYR 194.A N GLY 70.A O no hydrogen 3.046 N/A SER 195.A N GLY 70.A O no hydrogen 3.205 N/A THR 197.A N ASN 68.A O no hydrogen 2.851 N/A LEU 198.A N TYR 13.A OH no hydrogen 2.768 N/A THR 199.A N SER 66.A O no hydrogen 2.830 N/A GLY 201.A N ASN 64.A O no hydrogen 2.958 N/A THR 203.A N ILE 319.A O no hydrogen 2.937 N/A ARG 204.A NE GLU 318.A OE2 no hydrogen 3.127 N/A ARG 204.A NH2 GLU 318.A OE2 no hydrogen 3.045 N/A VAL 205.A N LEU 317.A O no hydrogen 2.772 N/A ALA 207.A N ASP 315.A O no hydrogen 3.038 N/A GLU 208.A N GLU 208.A OE2 no hydrogen 2.608 N/A SER 209.A N GLU 206.A O no hydrogen 2.954 N/A SER 209.A OG GLU 206.A O no hydrogen 2.845 N/A MET 210.A N ALA 207.A O no hydrogen 3.139 N/A THR 211.A N SER 237.A O no hydrogen 2.951 N/A LYS 212.A NZ ASN 219.A OD1 no hydrogen 2.852 N/A GLY 213.A N ASN 235.A O no hydrogen 2.916 N/A TYR 216.A N ASP 234.A OD1 no hydrogen 2.825 N/A THR 217.A OG1 GLY 213.A O no hydrogen 2.710 N/A SER 218.A N ALA 228.A O no hydrogen 3.246 N/A ILE 220.A N GLY 226.A O no hydrogen 2.816 N/A GLY 226.A N ILE 220.A O no hydrogen 2.937 N/A VAL 227.A N LEU 314.A O no hydrogen 2.952 N/A ALA 228.A N SER 218.A O no hydrogen 2.808 N/A LEU 229.A N ALA 312.A O no hydrogen 2.836 N/A TYR 230.A N ASP 234.A OD2 no hydrogen 2.891 N/A TYR 230.A OH SER 218.A OG no hydrogen 2.841 N/A ALA 231.A N ASP 234.A OD2 no hydrogen 2.876 N/A GLY 233.A N VAL 303.A O no hydrogen 2.933 N/A ASP 234.A N ALA 231.A O no hydrogen 2.892 N/A ASN 235.A N GLY 213.A O no hydrogen 2.988 N/A VAL 236.A N LEU 301.A O no hydrogen 3.015 N/A SER 237.A N THR 211.A O no hydrogen 3.023 N/A PHE 238.A N VAL 299.A O no hydrogen 2.971 N/A HIS 240.A N GLN 297.A O no hydrogen 3.032 N/A PHE 242.A N GLY 295.A O no hydrogen 3.417 N/A LYS 244.A NZ ASN 246.A O no hydrogen 3.048 N/A LYS 244.A NZ ARG 320.A O no hydrogen 2.412 N/A LYS 244.A NZ ARG 320.A OXT no hydrogen 3.429 N/A SER 247.A N ILE 290.A O no hydrogen 2.982 N/A SER 247.A OG HIS 292.A NE2 no hydrogen 2.531 N/A SER 248.A N ARG 320.A OXT no hydrogen 2.680 N/A PHE 249.A N ILE 287.A O no hydrogen 2.812 N/A SER 250.A N GLU 318.A O no hydrogen 2.828 N/A SER 250.A OG THR 286.A OG1 no hydrogen 2.553 N/A LEU 251.A N TYR 285.A O no hydrogen 2.744 N/A ARG 252.A N TYR 316.A O no hydrogen 2.937 N/A ARG 252.A NH1 ASP 315.A OD2 no hydrogen 2.858 N/A GLY 253.A N ALA 283.A O no hydrogen 3.050 N/A ALA 254.A N TYR 313.A O no hydrogen 2.963 N/A SER 255.A N ASP 279.A O no hydrogen 3.031 N/A SER 255.A OG ASN 257.A O no hydrogen 3.102 N/A SER 255.A OG ASN 257.A OD1 no hydrogen 3.280 N/A SER 255.A OG ASN 259.A O no hydrogen 2.777 N/A ASN 256.A N ASP 311.A O no hydrogen 3.173 N/A ASN 256.A ND2 ASP 311.A O no hydrogen 3.465 N/A ASN 257.A N SER 255.A OG no hydrogen 3.074 N/A ASN 257.A ND2 THR 309.A O no hydrogen 2.965 N/A ASN 259.A N ASN 257.A OD1 no hydrogen 2.756 N/A ALA 261.A N PHE 277.A O no hydrogen 2.731 N/A VAL 263.A N PHE 275.A O no hydrogen 3.089 N/A ASP 264.A N ILE 302.A O no hydrogen 2.860 N/A LEU 265.A N GLY 273.A O no hydrogen 2.865 N/A ARG 266.A N GLU 300.A O no hydrogen 3.035 N/A ILE 267.A N GLN 270.A O no hydrogen 3.051 N/A GLY 268.A N LEU 298.A O no hydrogen 2.991 N/A GLN 270.A N ILE 267.A O no hydrogen 3.192 N/A ARG 272.A N LEU 265.A O no hydrogen 2.897 N/A THR 274.A OG1 ASP 264.A OD1 no hydrogen 2.782 N/A PHE 275.A N VAL 263.A O no hydrogen 2.862 N/A PHE 277.A N ALA 261.A O no hydrogen 2.987 N/A TYR 281.A N ASP 279.A OD2 no hydrogen 3.052 N/A ALA 283.A N GLY 253.A O no hydrogen 3.008 N/A TYR 285.A N LEU 251.A O no hydrogen 2.943 N/A THR 286.A OG1 SER 250.A OG no hydrogen 2.553 N/A ILE 287.A N PHE 249.A O no hydrogen 2.762 N/A ASN 288.A ND2 SER 248.A OG no hydrogen 2.438 N/A ILE 290.A N SER 247.A O no hydrogen 2.937 N/A HIS 292.A N ALA 245.A O no hydrogen 2.956 N/A HIS 292.A ND1 GLY 293.A O no hydrogen 3.356 N/A HIS 292.A NE2 SER 247.A OG no hydrogen 2.531 N/A GLY 293.A N ALA 245.A O no hydrogen 3.453 N/A GLY 295.A N PHE 242.A O no hydrogen 2.941 N/A GLN 297.A N HIS 240.A O no hydrogen 2.968 N/A VAL 299.A N PHE 238.A O no hydrogen 2.741 N/A GLU 300.A N ARG 266.A O no hydrogen 2.921 N/A LEU 301.A N VAL 236.A O no hydrogen 2.918 N/A ILE 302.A N ASP 264.A O no hydrogen 2.952 N/A VAL 303.A N ASP 234.A O no hydrogen 3.095 N/A THR 304.A OG1 ASP 264.A OD2 no hydrogen 2.529 N/A GLY 308.A N ASP 306.A OD1 no hydrogen 3.375 N/A THR 309.A N ASP 307.A OD2 no hydrogen 3.128 N/A THR 309.A OG1 ASP 307.A OD2 no hydrogen 2.449 N/A ALA 312.A N LEU 229.A O no hydrogen 3.042 N/A TYR 313.A N ALA 254.A O no hydrogen 2.840 N/A LEU 314.A N VAL 227.A O no hydrogen 2.878 N/A ASP 315.A N ARG 252.A O no hydrogen 2.776 N/A LEU 317.A N VAL 205.A O no hydrogen 2.814 N/A GLU 318.A N SER 250.A O no hydrogen 2.731 N/A ILE 319.A N THR 203.A O no hydrogen 2.851 N/A ARG 320.A N SER 248.A O no hydrogen 2.948 N/A ARG 320.A NH1 SER 250.A OG no hydrogen 3.384 N/A ARG 320.A NH2 SER 250.A OG no hydrogen 3.099 N/A