Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2pbl_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 1.A N LEU 172.A O no hydrogen 3.420 N/A LEU 3.A N ARG 173.A O no hydrogen 2.958 N/A TYR 7.A N LEU 3.A O no hydrogen 3.136 N/A ALA 8.A N ASP 5.A O no hydrogen 3.211 N/A TYR 12.A N ASN 9.A O no hydrogen 2.955 N/A TYR 12.A OH ASP 5.A OD1 no hydrogen 2.619 N/A TYR 12.A OH ASP 5.A OD2 no hydrogen 2.931 N/A ILE 13.A N GLY 10.A O no hydrogen 3.067 N/A ALA 16.A N ILE 13.A O no hydrogen 3.147 N/A ASP 18.A N GLY 15.A O no hydrogen 2.905 N/A TYR 19.A N ALA 16.A O no hydrogen 3.144 N/A ARG 22.A N ASP 18.A O no hydrogen 3.326 N/A TRP 23.A N TYR 19.A O no hydrogen 2.843 N/A ALA 24.A N PRO 20.A O no hydrogen 3.083 N/A ALA 25.A N PRO 21.A O no hydrogen 2.980 N/A SER 26.A N ARG 22.A O no hydrogen 2.866 N/A SER 26.A OG ARG 22.A O no hydrogen 3.010 N/A ALA 27.A N TRP 23.A O no hydrogen 2.749 N/A GLU 28.A N ALA 24.A O no hydrogen 3.040 N/A ASP 29.A N ALA 25.A O no hydrogen 3.015 N/A PHE 30.A N SER 26.A O no hydrogen 3.070 N/A ARG 31.A N ALA 27.A O no hydrogen 2.909 N/A ARG 31.A NH1 SER 78.A O.A no hydrogen 2.816 N/A ARG 31.A NH1 SER 78.A O.B no hydrogen 2.844 N/A ARG 31.A NH1 SER 81.A OG no hydrogen 2.958 N/A ASN 32.A N GLU 28.A O no hydrogen 3.018 N/A SER 33.A N ASP 29.A O no hydrogen 2.961 N/A SER 33.A OG ASP 29.A O no hydrogen 3.513 N/A SER 33.A OG PHE 30.A O no hydrogen 2.385 N/A LEU 34.A N PHE 30.A O no hydrogen 3.259 N/A LEU 34.A N ARG 31.A O no hydrogen 3.076 N/A ARG 37.A N LEU 34.A O no hydrogen 3.157 N/A ARG 37.A NH1 LEU 56.A O no hydrogen 2.679 N/A ALA 38.A N GLN 35.A O no hydrogen 3.145 N/A ARG 39.A N LEU 54.A O no hydrogen 2.708 N/A ARG 39.A NH1 GLU 123.A OE1 no hydrogen 2.856 N/A ARG 39.A NH2 GLU 123.A OE1 no hydrogen 3.014 N/A ASN 41.A N ASP 53.A OD1 no hydrogen 2.755 N/A LEU 42.A N PHE 52.A O no hydrogen 2.763 N/A TYR 44.A N HIS 50.A O no hydrogen 2.779 N/A TYR 44.A OH SER 97.A O no hydrogen 2.584 N/A GLY 45.A N HIS 50.A O no hydrogen 3.325 N/A GLY 47.A N HIS 50.A ND1 no hydrogen 2.955 N/A ARG 49.A NE TYR 98.A O no hydrogen 2.895 N/A ARG 49.A NH2 PHE 75.A O no hydrogen 2.932 N/A ARG 49.A NH2 TYR 98.A O no hydrogen 3.126 N/A HIS 50.A N GLY 47.A O no hydrogen 3.034 N/A HIS 50.A NE2 GLU 99.A OE1 no hydrogen 2.992 N/A LYS 51.A NZ SER 43.A OG no hydrogen 3.072 N/A PHE 52.A N LEU 42.A O no hydrogen 2.774 N/A LEU 54.A N ARG 39.A O no hydrogen 2.927 N/A PHE 55.A N VAL 94.A O no hydrogen 2.905 N/A LEU 56.A N ARG 37.A O no hydrogen 2.822 N/A VAL 62.A N GLY 91.A O no hydrogen 2.750 N/A LEU 64.A N PRO 127.A O no hydrogen 2.884 N/A PHE 65.A N ALA 93.A O no hydrogen 2.882 N/A VAL 66.A N VAL 129.A O no hydrogen 2.820 N/A PHE 67.A N ALA 95.A O no hydrogen 2.840 N/A VAL 68.A N ALA 131.A O no hydrogen 2.880 N/A HIS 69.A ND1 GLY 70.A O no hydrogen 2.794 N/A TYR 72.A OH TYR 7.A O no hydrogen 2.565 N/A LYS 77.A N SER 97.A OG no hydrogen 2.936 N/A LYS 77.A NZ ASN 41.A OD1 no hydrogen 2.831 N/A LYS 77.A NZ ASP 53.A OD1 no hydrogen 2.885 N/A LYS 77.A NZ ASP 53.A OD2 no hydrogen 3.354 N/A SER 78.A N.A ASP 76.A OD1 no hydrogen 2.951 N/A SER 78.A N.B ASP 76.A OD1 no hydrogen 2.959 N/A SER 78.A OG.A ASP 76.A OD1 no hydrogen 2.667 N/A TRP 80.A N LYS 77.A O no hydrogen 3.333 N/A LEU 83.A N TRP 80.A O no hydrogen 2.963 N/A ALA 84.A N SER 81.A O no hydrogen 2.853 N/A VAL 85.A N HIS 82.A O no hydrogen 3.436 N/A GLY 86.A N LEU 242.A O no hydrogen 3.048 N/A LEU 88.A N ALA 84.A O no hydrogen 2.964 N/A SER 89.A N VAL 85.A O no hydrogen 2.975 N/A SER 89.A OG GLY 86.A O no hydrogen 2.712 N/A LYS 90.A N ALA 87.A O no hydrogen 3.034 N/A LYS 90.A NZ THR 254.A OG1 no hydrogen 2.585 N/A GLY 91.A N LEU 88.A O no hydrogen 2.952 N/A TRP 92.A N ALA 87.A O no hydrogen 3.119 N/A ALA 93.A N GLY 63.A O no hydrogen 2.874 N/A VAL 94.A N PHE 55.A O no hydrogen 2.804 N/A ALA 95.A N PHE 65.A O no hydrogen 2.796 N/A SER 97.A N LYS 51.A O no hydrogen 2.941 N/A TYR 98.A OH HIS 69.A O no hydrogen 2.694 N/A GLU 99.A N GLN 112.A OE1 no hydrogen 2.794 N/A CYS 101.A N TRP 73.A O no hydrogen 2.778 N/A CYS 101.A SG TRP 73.A O no hydrogen 3.775 N/A CYS 101.A SG VAL 104.A O no hydrogen 3.398 N/A VAL 104.A N LEU 100.A O no hydrogen 3.145 N/A ARG 105.A N GLU 108.A OE2 no hydrogen 2.810 N/A ARG 105.A NH1 LYS 180.A O no hydrogen 2.870 N/A ILE 109.A N ARG 105.A O no hydrogen 3.019 N/A THR 110.A N ILE 106.A O no hydrogen 2.915 N/A THR 110.A OG1 ILE 106.A O no hydrogen 3.332 N/A THR 110.A OG1 GLU 188.A OE1 no hydrogen 3.001 N/A GLN 111.A N SER 107.A O no hydrogen 3.300 N/A GLN 112.A N GLU 108.A O no hydrogen 2.998 N/A GLN 112.A NE2 GLU 99.A OE1 no hydrogen 3.042 N/A ILE 113.A N ILE 109.A O no hydrogen 2.900 N/A SER 114.A N THR 110.A O no hydrogen 3.012 N/A SER 114.A OG VAL 147.A O no hydrogen 2.792 N/A GLN 115.A N GLN 111.A O no hydrogen 3.017 N/A ALA 116.A N GLN 112.A O no hydrogen 2.819 N/A VAL 117.A N ILE 113.A O no hydrogen 2.852 N/A THR 118.A N SER 114.A O no hydrogen 3.035 N/A THR 118.A OG1 SER 114.A O no hydrogen 2.824 N/A ALA 119.A N GLN 115.A O no hydrogen 3.002 N/A ALA 120.A N ALA 116.A O no hydrogen 2.892 N/A ALA 121.A N VAL 117.A O no hydrogen 2.824 N/A LYS 122.A N ALA 119.A O no hydrogen 3.092 N/A GLU 123.A N ALA 120.A O no hydrogen 2.953 N/A ILE 124.A N ALA 120.A O no hydrogen 3.185 N/A ILE 128.A N ARG 155.A O no hydrogen 3.014 N/A VAL 129.A N LEU 64.A O no hydrogen 2.802 N/A LEU 130.A N ASN 158.A O no hydrogen 3.014 N/A ALA 131.A N VAL 66.A O no hydrogen 2.924 N/A GLY 132.A N VAL 160.A O no hydrogen 3.424 N/A HIS 133.A N VAL 68.A O no hydrogen 2.994 N/A HIS 133.A NE2 HIS 235.A O no hydrogen 2.681 N/A SER 134.A N ILE 162.A O no hydrogen 2.868 N/A SER 134.A OG HIS 235.A NE2 no hydrogen 2.744 N/A GLY 136.A N HIS 133.A O no hydrogen 2.823 N/A GLY 137.A N SER 134.A O no hydrogen 2.812 N/A HIS 138.A N SER 134.A O no hydrogen 2.982 N/A HIS 138.A NE2 GLU 188.A O no hydrogen 2.766 N/A LEU 139.A N ALA 135.A O no hydrogen 2.898 N/A VAL 140.A N GLY 136.A O no hydrogen 2.911 N/A ALA 141.A N GLY 137.A O no hydrogen 3.130 N/A ARG 142.A N HIS 138.A O no hydrogen 3.126 N/A ARG 142.A NE GLU 188.A OE1 no hydrogen 2.841 N/A ARG 142.A NH1 ASP 144.A OD2 no hydrogen 2.986 N/A ARG 142.A NH2 GLU 188.A OE1 no hydrogen 3.367 N/A ARG 142.A NH2 GLU 188.A OE2 no hydrogen 2.987 N/A ASP 144.A N ARG 142.A O no hydrogen 3.170 N/A GLU 146.A N ASP 144.A OD1 no hydrogen 3.055 N/A VAL 147.A N ASP 144.A O no hydrogen 2.841 N/A LEU 148.A N ASP 144.A O no hydrogen 3.163 N/A VAL 152.A N PRO 149.A O no hydrogen 3.012 N/A GLY 153.A N PRO 149.A O no hydrogen 2.949 N/A ALA 154.A N GLU 150.A O no hydrogen 2.762 N/A ARG 155.A N VAL 152.A O no hydrogen 2.976 N/A ARG 155.A NE GLY 126.A O no hydrogen 2.963 N/A ARG 155.A NH1 ALA 121.A O no hydrogen 3.018 N/A ARG 155.A NH2 ILE 124.A O no hydrogen 2.797 N/A ARG 155.A NH2 GLY 126.A O no hydrogen 2.829 N/A ILE 156.A N GLY 153.A O no hydrogen 2.830 N/A ARG 157.A N ILE 128.A O no hydrogen 2.750 N/A ARG 157.A NE ALA 255.A O no hydrogen 2.764 N/A ARG 157.A NH2 ALA 255.A OXT no hydrogen 2.741 N/A ASN 158.A ND2 ILE 253.A O no hydrogen 2.729 N/A ASN 158.A ND2 ALA 255.A O no hydrogen 2.783 N/A VAL 159.A N LYS 199.A O no hydrogen 2.848 N/A VAL 160.A N LEU 130.A O no hydrogen 2.848 N/A ILE 162.A N GLY 132.A O no hydrogen 2.709 N/A SER 163.A N TRP 203.A O no hydrogen 2.706 N/A SER 163.A OG GLU 208.A OE2 no hydrogen 2.553 N/A SER 166.A N GLN 215.A OE1 no hydrogen 2.793 N/A SER 166.A OG GLN 215.A O no hydrogen 2.634 N/A SER 166.A OG GLN 215.A OE1 no hydrogen 3.181 N/A ASP 167.A N GLN 215.A OE1 no hydrogen 2.933 N/A LEU 168.A N SER 189.A OG no hydrogen 3.004 N/A ARG 169.A N ASP 167.A OD1 no hydrogen 3.116 N/A ARG 169.A NH1 GLU 192.A OE2 no hydrogen 3.100 N/A ARG 169.A NH2 ASP 167.A OD1 no hydrogen 3.364 N/A ARG 169.A NH2 ASP 167.A OD2 no hydrogen 3.456 N/A ARG 169.A NH2 GLU 192.A OE2 no hydrogen 3.345 N/A LEU 171.A N LEU 168.A O no hydrogen 2.956 N/A LEU 172.A N ARG 169.A O no hydrogen 3.034 N/A ARG 173.A N PRO 170.A O no hydrogen 3.064 N/A THR 174.A N LEU 171.A O no hydrogen 3.048 N/A THR 174.A OG1 LEU 171.A O no hydrogen 2.762 N/A SER 175.A N ASP 4.A OD1 no hydrogen 2.844 N/A SER 175.A OG GLY 1.A O no hydrogen 3.139 N/A SER 175.A OG ASP 4.A OD1 no hydrogen 3.476 N/A SER 175.A OG ASP 4.A OD2 no hydrogen 2.652 N/A GLU 177.A N SER 175.A O no hydrogen 3.009 N/A LYS 180.A N ASN 176.A O no hydrogen 2.827 N/A LYS 180.A NZ GLU 177.A O no hydrogen 3.031 N/A ALA 184.A N ASP 181.A OD1 no hydrogen 2.909 N/A ALA 185.A N ASP 181.A O no hydrogen 3.026 N/A ILE 186.A N ALA 182.A O no hydrogen 2.969 N/A ALA 187.A N ASP 183.A O no hydrogen 2.827 N/A GLU 188.A N ALA 184.A O no hydrogen 3.147 N/A SER 189.A N ILE 186.A O no hydrogen 3.017 N/A SER 189.A OG ALA 185.A O no hydrogen 2.441 N/A VAL 191.A N SER 166.A O no hydrogen 3.034 N/A GLU 192.A N SER 189.A O no hydrogen 2.923 N/A GLN 193.A NE2 GLU 192.A O no hydrogen 3.400 N/A TYR 196.A N LEU 143.A O no hydrogen 2.786 N/A TYR 196.A OH LEU 148.A O no hydrogen 2.746 N/A LYS 199.A N ARG 157.A O no hydrogen 3.075 N/A THR 201.A N VAL 159.A O no hydrogen 2.987 N/A VAL 202.A N ASP 226.A O no hydrogen 2.970 N/A TRP 203.A N PRO 161.A O no hydrogen 3.106 N/A VAL 204.A N VAL 228.A O no hydrogen 2.886 N/A GLY 205.A N GLU 208.A OE2 no hydrogen 2.867 N/A GLY 206.A N ALA 230.A O no hydrogen 2.861 N/A ALA 207.A N LYS 233.A O no hydrogen 2.856 N/A GLU 208.A N GLY 205.A O no hydrogen 3.079 N/A ARG 209.A NE ALA 6.A O no hydrogen 3.501 N/A ARG 209.A NH1 ASP 5.A O no hydrogen 3.012 N/A LEU 213.A N ARG 209.A O no hydrogen 3.151 N/A ASP 214.A N PRO 210.A O no hydrogen 2.880 N/A GLN 215.A N ALA 211.A O no hydrogen 2.849 N/A GLN 215.A NE2 TYR 7.A OH no hydrogen 2.872 N/A GLN 215.A NE2 ASP 167.A O no hydrogen 2.951 N/A ALA 216.A N PHE 212.A O no hydrogen 3.056 N/A ILE 217.A N LEU 213.A O no hydrogen 3.173 N/A TRP 218.A N ASP 214.A O no hydrogen 2.872 N/A LEU 219.A N GLN 215.A O no hydrogen 3.379 N/A VAL 220.A N ALA 216.A O no hydrogen 3.001 N/A GLU 221.A N ILE 217.A O no hydrogen 2.770 N/A ALA 222.A N TRP 218.A O no hydrogen 2.974 N/A TRP 223.A N LEU 219.A O no hydrogen 3.042 N/A TRP 223.A NE1 PRO 190.A O no hydrogen 2.961 N/A ALA 225.A N VAL 220.A O no hydrogen 3.133 N/A ASP 226.A N VAL 200.A O no hydrogen 2.954 N/A VAL 228.A N VAL 202.A O no hydrogen 2.811 N/A ALA 230.A N VAL 204.A O no hydrogen 2.860 N/A LYS 233.A N ALA 230.A O no hydrogen 3.134 N/A HIS 234.A N ASN 237.A OD1 no hydrogen 2.935 N/A HIS 235.A ND1 GLU 208.A OE1 no hydrogen 2.781 N/A HIS 235.A NE2 SER 134.A OG no hydrogen 2.744 N/A PHE 236.A N HIS 234.A ND1 no hydrogen 3.182 N/A VAL 238.A N HIS 234.A O no hydrogen 3.198 N/A GLU 240.A N ASN 237.A O no hydrogen 2.962 N/A LEU 242.A N ILE 239.A O no hydrogen 3.048 N/A ALA 243.A N GLU 240.A O no hydrogen 3.062 N/A ASP 244.A N PRO 241.A O no hydrogen 2.995 N/A GLU 246.A N ASP 244.A OD1 no hydrogen 2.920 N/A SER 247.A N ASP 244.A O no hydrogen 3.069 N/A SER 247.A OG PRO 241.A O no hydrogen 2.612 N/A SER 247.A OG ASP 244.A O no hydrogen 2.992 N/A VAL 250.A N SER 247.A OG no hydrogen 3.048 N/A ALA 251.A N SER 247.A O no hydrogen 2.986 N/A VAL 252.A N.A ASP 248.A O no hydrogen 3.025 N/A VAL 252.A N.B ASP 248.A O no hydrogen 3.023 N/A ILE 253.A N LEU 249.A O no hydrogen 3.173 N/A THR 254.A N VAL 250.A O no hydrogen 2.999 N/A THR 254.A OG1 VAL 250.A O no hydrogen 2.814 N/A THR 254.A OG1 ALA 251.A O no hydrogen 3.567 N/A ALA 255.A N VAL 252.A O.B no hydrogen 3.067 N/A