Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1pbp_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 2.A N ASN 29.A OD1 no hydrogen 2.718 N/A LEU 4.A N LYS 30.A O no hydrogen 2.627 N/A THR 5.A N ASP 51.A OD2 no hydrogen 2.760 N/A THR 5.A OG1 ASP 51.A OD2 no hydrogen 3.313 N/A GLY 6.A N ASN 32.A O no hydrogen 2.917 N/A ALA 7.A N PHE 52.A O no hydrogen 3.254 N/A GLY 8.A N GLN 34.A O no hydrogen 2.925 N/A ALA 9.A N ALA 54.A O no hydrogen 2.902 N/A ALA 13.A N THR 10.A O no hydrogen 3.106 N/A TYR 16.A N PRO 12.A O no hydrogen 2.914 N/A TYR 16.A OH THR 74.A OG1 no hydrogen 2.715 N/A ALA 17.A N ALA 13.A O no hydrogen 2.787 N/A LYS 18.A N PRO 14.A O no hydrogen 3.057 N/A TRP 19.A N VAL 15.A O no hydrogen 2.871 N/A TRP 19.A NE1 GLY 284.A O no hydrogen 2.857 N/A ALA 20.A N TYR 16.A O no hydrogen 2.974 N/A ASP 21.A N ALA 17.A O no hydrogen 3.000 N/A THR 22.A N LYS 18.A O no hydrogen 3.100 N/A THR 22.A OG1 LYS 18.A O no hydrogen 3.018 N/A TYR 23.A N TRP 19.A O no hydrogen 2.771 N/A GLN 24.A N ALA 20.A O no hydrogen 3.038 N/A LYS 25.A N ASP 21.A O no hydrogen 3.082 N/A LYS 25.A NZ ASP 21.A OD2 no hydrogen 2.878 N/A GLU 26.A N THR 22.A O no hydrogen 2.887 N/A THR 27.A N TYR 23.A O no hydrogen 2.859 N/A THR 27.A OG1 TYR 23.A O no hydrogen 2.860 N/A GLY 28.A N GLN 24.A O no hydrogen 2.764 N/A ASN 29.A N THR 27.A OG1 no hydrogen 3.131 N/A LYS 30.A N ALA 2.A O no hydrogen 2.920 N/A ASN 32.A N LEU 4.A O no hydrogen 2.786 N/A TYR 33.A OH ALA 9.A O no hydrogen 2.580 N/A GLN 34.A N GLY 6.A O no hydrogen 2.904 N/A ILE 36.A N GLY 8.A O no hydrogen 2.823 N/A GLY 37.A N GLY 8.A O no hydrogen 2.879 N/A SER 38.A OG ASP 56.A OD2 no hydrogen 3.300 N/A SER 39.A N GLY 138.A O no hydrogen 3.409 N/A GLY 41.A N GLY 37.A O no hydrogen 2.936 N/A VAL 42.A N SER 38.A O no hydrogen 3.051 N/A LYS 43.A N SER 39.A O no hydrogen 3.086 N/A GLN 44.A N GLY 40.A O no hydrogen 2.905 N/A ILE 45.A N GLY 41.A O no hydrogen 3.016 N/A ILE 46.A N VAL 42.A O no hydrogen 2.997 N/A ALA 47.A N LYS 43.A O no hydrogen 2.901 N/A ASN 48.A N ILE 45.A O no hydrogen 2.999 N/A THR 49.A N GLN 44.A O no hydrogen 3.118 N/A THR 49.A OG1 GLN 44.A O no hydrogen 3.462 N/A THR 49.A OG1 GLN 44.A OE1 no hydrogen 2.787 N/A ASP 51.A N THR 5.A O no hydrogen 2.764 N/A PHE 52.A N THR 5.A O no hydrogen 3.353 N/A GLY 53.A N LEU 259.A O no hydrogen 2.950 N/A ALA 54.A N ALA 7.A O no hydrogen 2.840 N/A SER 55.A N PHE 257.A O no hydrogen 3.059 N/A SER 55.A OG ALA 57.A O no hydrogen 2.840 N/A ASP 56.A N SER 38.A OG no hydrogen 3.004 N/A ALA 57.A N SER 55.A OG no hydrogen 3.176 N/A LEU 59.A N GLN 71.A OE1 no hydrogen 2.744 N/A LYS 63.A N SER 60.A OG no hydrogen 3.287 N/A LYS 63.A NZ GLU 67.A OE2 no hydrogen 2.608 N/A LEU 64.A N SER 60.A O no hydrogen 2.885 N/A ALA 65.A N ASP 61.A O no hydrogen 2.956 N/A GLN 66.A N GLU 62.A O no hydrogen 2.785 N/A GLU 67.A N LYS 63.A O no hydrogen 3.076 N/A GLY 68.A N ALA 65.A O no hydrogen 3.366 N/A LEU 69.A N LEU 64.A O no hydrogen 2.885 N/A PHE 70.A N ILE 260.A O no hydrogen 2.794 N/A GLN 71.A NE2 LEU 59.A O no hydrogen 3.166 N/A PHE 72.A N ILE 258.A O no hydrogen 2.933 N/A THR 74.A N THR 256.A O no hydrogen 3.105 N/A THR 74.A OG1 TYR 16.A OH no hydrogen 2.715 N/A THR 74.A OG1 THR 256.A O no hydrogen 3.554 N/A ILE 76.A N ALA 294.A O no hydrogen 2.948 N/A GLY 77.A N SER 254.A O no hydrogen 2.960 N/A GLY 78.A N GLU 195.A OE2 no hydrogen 3.264 N/A VAL 79.A N ILE 252.A O no hydrogen 2.926 N/A VAL 80.A N VAL 194.A O no hydrogen 2.842 N/A ALA 82.A N GLY 192.A O no hydrogen 2.820 N/A VAL 83.A N ALA 205.A O no hydrogen 2.923 N/A ASN 84.A N ALA 190.A O no hydrogen 2.799 N/A ASN 84.A ND2 VAL 184.A O no hydrogen 2.857 N/A LEU 88.A N ILE 85.A O no hydrogen 3.038 N/A LYS 89.A N GLU 92.A OE2 no hydrogen 2.746 N/A GLY 91.A N TYR 206.A O no hydrogen 2.720 N/A GLU 92.A N LYS 89.A O no hydrogen 3.176 N/A VAL 94.A N ASN 120.A OD1 no hydrogen 2.890 N/A LEU 95.A N LYS 208.A O no hydrogen 3.339 N/A LYS 98.A NZ ASP 102.A OD2 no hydrogen 3.184 N/A THR 99.A N ASP 96.A OD1 no hydrogen 2.952 N/A THR 99.A OG1 ASP 96.A OD1 no hydrogen 2.524 N/A LEU 100.A N ASP 96.A O no hydrogen 2.997 N/A GLY 101.A N GLY 97.A O no hydrogen 2.910 N/A ASP 102.A N LYS 98.A O no hydrogen 3.058 N/A ILE 103.A N THR 99.A O no hydrogen 2.981 N/A TYR 104.A N LEU 100.A O no hydrogen 3.020 N/A TYR 104.A OH VAL 133.A O no hydrogen 2.778 N/A LEU 105.A N GLY 101.A O no hydrogen 2.733 N/A GLY 106.A N ILE 103.A O no hydrogen 2.984 N/A LYS 107.A NZ GLU 155.A OE1 no hydrogen 3.235 N/A ILE 108.A N ASP 102.A O no hydrogen 3.171 N/A LYS 110.A NZ SER 127.A O no hydrogen 3.122 N/A TRP 111.A N GLN 128.A O no hydrogen 2.871 N/A TRP 111.A NE1 GLY 189.A O no hydrogen 3.027 N/A ASP 113.A N LYS 110.A O no hydrogen 3.005 N/A ALA 115.A N ASP 113.A OD1 no hydrogen 2.656 N/A ILE 116.A N ASP 113.A O no hydrogen 2.886 N/A ALA 117.A N ASP 113.A O no hydrogen 3.009 N/A LYS 118.A N GLU 114.A O no hydrogen 2.916 N/A LYS 118.A NZ THR 99.A OG1 no hydrogen 3.313 N/A LYS 118.A NZ ALA 115.A O no hydrogen 2.560 N/A LEU 119.A N ILE 116.A O no hydrogen 3.008 N/A ASN 120.A N ALA 117.A O no hydrogen 2.887 N/A ASN 120.A ND2 VAL 94.A O no hydrogen 2.943 N/A ASN 120.A ND2 ILE 116.A O no hydrogen 2.762 N/A LEU 123.A N ASN 120.A O no hydrogen 3.078 N/A ILE 130.A N LYS 109.A O no hydrogen 2.924 N/A ALA 131.A N GLY 189.A O no hydrogen 3.010 N/A VAL 133.A N ILE 191.A O no hydrogen 2.858 N/A ARG 134.A N LEU 172.A O no hydrogen 2.878 N/A ARG 134.A NH1 ARG 135.A O no hydrogen 2.986 N/A ARG 135.A N TYR 193.A OH no hydrogen 3.022 N/A ARG 135.A NE ASP 137.A OD1 no hydrogen 2.911 N/A ARG 135.A NH2 ASP 137.A OD2 no hydrogen 2.845 N/A ALA 136.A N GLY 174.A O no hydrogen 2.821 N/A SER 139.A N SER 164.A O no hydrogen 3.018 N/A SER 142.A N SER 139.A OG no hydrogen 2.998 N/A SER 142.A OG TYR 193.A OH no hydrogen 2.696 N/A PHE 143.A N SER 139.A O no hydrogen 3.108 N/A VAL 144.A N GLY 140.A O no hydrogen 2.989 N/A PHE 145.A N ASP 141.A O no hydrogen 2.816 N/A THR 146.A N SER 142.A O no hydrogen 2.683 N/A THR 146.A OG1 SER 142.A O no hydrogen 2.692 N/A THR 146.A OG1 PHE 143.A O no hydrogen 3.134 N/A THR 146.A OG1 GLY 163.A O no hydrogen 3.315 N/A SER 147.A N PHE 143.A O no hydrogen 2.699 N/A SER 147.A OG PHE 143.A O no hydrogen 2.787 N/A TYR 148.A N VAL 144.A O no hydrogen 2.962 N/A LEU 149.A N PHE 145.A O no hydrogen 2.932 N/A ALA 150.A N THR 146.A O no hydrogen 2.955 N/A LYS 151.A N TYR 148.A O no hydrogen 2.969 N/A LYS 151.A NZ ASP 240.A OD2 no hydrogen 2.702 N/A LYS 151.A NZ THR 242.A O no hydrogen 3.012 N/A LYS 151.A NZ THR 242.A OG1 no hydrogen 2.972 N/A VAL 152.A N TYR 148.A O no hydrogen 3.253 N/A VAL 152.A N LEU 149.A O no hydrogen 3.140 N/A ASN 153.A N LEU 149.A O no hydrogen 2.781 N/A ASN 153.A ND2 LYS 98.A O no hydrogen 2.904 N/A ASN 153.A ND2 ASP 102.A OD1 no hydrogen 2.881 N/A TRP 156.A N ASN 153.A OD1 no hydrogen 3.134 N/A TRP 156.A NE1 GLY 161.A O no hydrogen 2.856 N/A LYS 157.A N ASN 153.A O no hydrogen 2.956 N/A ASN 158.A N GLU 154.A O no hydrogen 2.883 N/A ASN 159.A N GLU 155.A O no hydrogen 2.859 N/A ASN 159.A ND2 GLU 155.A O no hydrogen 3.079 N/A VAL 160.A N TRP 156.A O no hydrogen 2.885 N/A GLY 161.A N TRP 156.A O no hydrogen 2.876 N/A THR 162.A OG1 THR 146.A O no hydrogen 3.285 N/A GLY 163.A N THR 146.A OG1 no hydrogen 3.041 N/A LEU 172.A N VAL 132.A O no hydrogen 2.897 N/A GLY 174.A N ARG 134.A O no hydrogen 2.783 N/A GLY 176.A N ASP 137.A OD1 no hydrogen 3.029 N/A ASN 177.A ND2 THR 10.A OG1 no hydrogen 2.739 N/A ASN 177.A ND2 ASP 141.A OD1 no hydrogen 2.987 N/A ILE 180.A N GLY 176.A O no hydrogen 3.234 N/A ALA 181.A N ASN 177.A O no hydrogen 2.979 N/A ALA 182.A N ASP 178.A O no hydrogen 2.926 N/A PHE 183.A N GLY 179.A O no hydrogen 3.065 N/A VAL 184.A N ILE 180.A O no hydrogen 2.930 N/A GLN 185.A N ALA 181.A O no hydrogen 3.105 N/A ARG 186.A N ALA 182.A O no hydrogen 3.268 N/A ARG 186.A N PHE 183.A O no hydrogen 3.204 N/A GLY 189.A N ASN 84.A O no hydrogen 2.616 N/A ALA 190.A N LEU 187.A O no hydrogen 3.064 N/A ILE 191.A N ALA 131.A O no hydrogen 3.118 N/A GLY 192.A N ALA 82.A O no hydrogen 3.043 N/A TYR 193.A OH SER 142.A OG no hydrogen 2.696 N/A VAL 194.A N VAL 80.A O no hydrogen 2.983 N/A GLU 195.A N ASN 177.A OD1 no hydrogen 2.855 N/A TYR 196.A N GLY 78.A O no hydrogen 2.787 N/A ALA 197.A N GLU 195.A OE1 no hydrogen 3.004 N/A TYR 198.A N GLU 195.A O no hydrogen 2.966 N/A TYR 198.A OH THR 10.A O no hydrogen 2.491 N/A ALA 199.A N TYR 196.A O no hydrogen 2.783 N/A LYS 200.A N TYR 196.A O no hydrogen 3.146 N/A LYS 200.A NZ ASP 292.A OD1 no hydrogen 3.529 N/A LYS 200.A NZ ASP 292.A OD2 no hydrogen 2.817 N/A GLN 201.A N ALA 197.A O no hydrogen 2.928 N/A ASN 202.A N TYR 198.A O no hydrogen 3.325 N/A ASN 202.A N ALA 199.A O no hydrogen 3.219 N/A ASN 202.A ND2 TYR 198.A O no hydrogen 2.710 N/A ASN 203.A N LYS 200.A O no hydrogen 3.042 N/A LEU 204.A N ALA 199.A O no hydrogen 2.813 N/A TYR 206.A N SER 90.A OG no hydrogen 3.108 N/A THR 207.A N LEU 81.A O no hydrogen 3.144 N/A THR 207.A OG1 LYS 208.A O no hydrogen 2.884 N/A LYS 208.A N LEU 93.A O no hydrogen 2.807 N/A LEU 209.A N VAL 217.A O no hydrogen 3.161 N/A ILE 210.A N LEU 95.A O no hydrogen 3.178 N/A SER 211.A N LYS 215.A O no hydrogen 2.727 N/A SER 211.A OG LYS 215.A O no hydrogen 3.288 N/A GLY 214.A N SER 211.A O no hydrogen 2.769 N/A LYS 215.A N SER 211.A OG no hydrogen 2.963 N/A VAL 217.A N LEU 209.A O no hydrogen 2.792 N/A GLU 222.A N GLU 222.A OE1 no hydrogen 2.798 N/A ASN 223.A N THR 220.A OG1 no hydrogen 3.068 N/A ASN 223.A ND2 SER 218.A O no hydrogen 2.771 N/A PHE 224.A N THR 220.A O no hydrogen 3.092 N/A ALA 225.A N GLU 221.A O no hydrogen 3.095 N/A ASN 226.A N GLU 222.A O no hydrogen 2.909 N/A ASN 226.A ND2 ASN 223.A OD1 no hydrogen 3.228 N/A ASN 226.A ND2 ASP 248.A O no hydrogen 3.177 N/A ALA 227.A N ASN 223.A O no hydrogen 3.320 N/A ALA 227.A N PHE 224.A O no hydrogen 3.013 N/A ALA 228.A N ALA 225.A O no hydrogen 2.909 N/A LYS 229.A N ASN 226.A O no hydrogen 3.452 N/A LYS 229.A NZ ASN 226.A OD1 no hydrogen 2.841 N/A ALA 231.A N ALA 228.A O no hydrogen 3.073 N/A SER 234.A OG ASP 232.A OD1 no hydrogen 3.049 N/A LYS 235.A N ASP 232.A O no hydrogen 2.972 N/A ALA 238.A N THR 236.A OG1 no hydrogen 3.042 N/A GLN 239.A N PHE 237.A O no hydrogen 2.843 N/A GLN 239.A NE2 THR 236.A O no hydrogen 2.890 N/A THR 242.A N ASP 240.A OD1 no hydrogen 3.126 N/A THR 242.A OG1 ASP 240.A OD1 no hydrogen 2.743 N/A ASN 243.A N PRO 251.A O no hydrogen 2.650 N/A GLN 244.A NE2 THR 242.A O no hydrogen 3.141 N/A GLY 246.A N ASP 213.A OD2 no hydrogen 2.651 N/A TRP 250.A N ASN 223.A O no hydrogen 2.894 N/A TRP 250.A NE1 VAL 79.A O no hydrogen 2.697 N/A THR 253.A OG1 TRP 250.A O no hydrogen 2.850 N/A SER 254.A N GLY 77.A O no hydrogen 3.214 N/A SER 254.A OG THR 255.A O no hydrogen 2.532 N/A THR 255.A OG1 VAL 75.A O no hydrogen 2.715 N/A THR 256.A N THR 255.A OG1 no hydrogen 2.814 N/A THR 256.A OG1 ASP 56.A OD1 no hydrogen 2.642 N/A PHE 257.A N SER 55.A O no hydrogen 2.762 N/A ILE 258.A N PHE 72.A O no hydrogen 2.791 N/A LEU 259.A N GLY 53.A O no hydrogen 2.888 N/A ILE 260.A N PHE 70.A O no hydrogen 2.969 N/A HIS 261.A NE2 ILE 45.A O no hydrogen 2.819 N/A LYS 262.A N GLY 68.A O no hydrogen 2.852 N/A GLN 264.A N LYS 313.A O no hydrogen 2.807 N/A GLN 264.A NE2 HIS 261.A O no hydrogen 2.862 N/A GLN 269.A N LYS 266.A O no hydrogen 2.736 N/A GLN 269.A NE2 SER 3.A O no hydrogen 2.989 N/A GLN 269.A NE2 ASP 51.A OD1 no hydrogen 3.204 N/A GLY 270.A N LYS 266.A O no hydrogen 3.137 N/A THR 271.A N PRO 267.A O no hydrogen 2.954 N/A THR 271.A OG1 PRO 267.A O no hydrogen 2.918 N/A GLU 272.A N GLU 268.A O no hydrogen 3.253 N/A VAL 273.A N GLN 269.A O no hydrogen 2.970 N/A LEU 274.A N GLY 270.A O no hydrogen 3.120 N/A LYS 275.A N THR 271.A O no hydrogen 3.096 N/A PHE 276.A N GLU 272.A O no hydrogen 3.034 N/A PHE 277.A N VAL 273.A O no hydrogen 2.994 N/A ASP 278.A N LEU 274.A O no hydrogen 2.640 N/A TRP 279.A N LYS 275.A O no hydrogen 2.713 N/A ALA 280.A N PHE 276.A O no hydrogen 2.932 N/A TYR 281.A N PHE 277.A O no hydrogen 2.939 N/A TYR 281.A OH PRO 73.A O no hydrogen 2.618 N/A LYS 282.A N ASP 278.A O no hydrogen 2.958 N/A LYS 282.A NZ ASP 278.A OD2 no hydrogen 3.070 N/A THR 283.A N TRP 279.A O no hydrogen 2.913 N/A THR 283.A OG1 TRP 279.A O no hydrogen 3.159 N/A GLY 284.A N ALA 280.A O no hydrogen 2.703 N/A LYS 286.A NZ ASP 290.A OD1 no hydrogen 3.139 N/A LYS 286.A NZ ASP 290.A OD2 no hydrogen 2.775 N/A ALA 288.A N GLY 284.A O no hydrogen 3.085 N/A ASN 289.A N ALA 285.A O no hydrogen 2.884 N/A ASN 289.A ND2 TYR 293.A O no hydrogen 2.645 N/A ASP 290.A N LYS 286.A O no hydrogen 2.857 N/A LEU 291.A N GLN 287.A O no hydrogen 3.182 N/A LEU 291.A N ALA 288.A O no hydrogen 2.915 N/A ASP 292.A N ASN 289.A O no hydrogen 2.871 N/A TYR 293.A N ALA 288.A O no hydrogen 2.937 N/A TYR 293.A OH PHE 11.A O no hydrogen 2.707 N/A ALA 294.A N ILE 76.A O no hydrogen 2.810 N/A VAL 300.A N PRO 297.A O no hydrogen 2.990 N/A VAL 301.A N PRO 297.A O no hydrogen 3.327 N/A GLU 302.A N ASP 298.A O no hydrogen 2.922 N/A GLN 303.A N SER 299.A O no hydrogen 3.224 N/A GLN 303.A NE2 TRP 233.A O no hydrogen 2.853 N/A VAL 304.A N VAL 300.A O no hydrogen 2.933 N/A ARG 305.A N VAL 301.A O no hydrogen 2.911 N/A ARG 305.A NE ASP 278.A OD1 no hydrogen 2.592 N/A ARG 305.A NH2 ASP 278.A OD1 no hydrogen 2.628 N/A ALA 306.A N GLU 302.A O no hydrogen 2.811 N/A ALA 307.A N GLN 303.A O no hydrogen 2.870 N/A TRP 308.A N VAL 304.A O no hydrogen 2.793 N/A LYS 309.A N ARG 305.A O no hydrogen 3.262 N/A LYS 309.A NZ TYR 321.A O no hydrogen 3.455 N/A LYS 309.A NZ TYR 321.A OXT no hydrogen 2.813 N/A THR 310.A N ALA 306.A O no hydrogen 3.260 N/A THR 310.A OG1 ALA 306.A O no hydrogen 3.494 N/A THR 310.A OG1 ALA 307.A O no hydrogen 3.318 N/A ASN 311.A N ALA 307.A O no hydrogen 2.885 N/A ASN 311.A ND2 ALA 307.A O no hydrogen 2.761 N/A ILE 312.A N TRP 308.A O no hydrogen 3.014 N/A LYS 313.A N LYS 262.A O no hydrogen 2.980 N/A LYS 313.A NZ THR 310.A O no hydrogen 3.420 N/A ASP 314.A N LYS 318.A O no hydrogen 2.727 N/A SER 316.A N ASP 314.A OD1 no hydrogen 2.854 N/A GLY 317.A N ASP 314.A O no hydrogen 3.008 N/A LYS 318.A N ASP 314.A OD1 no hydrogen 2.957 N/A LEU 320.A N ILE 312.A O no hydrogen 2.985 N/A TYR 321.A OH ASP 278.A OD2 no hydrogen 2.766 N/A