Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4pgk_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 6.A N ASP 4.A OD1 no hydrogen 3.334 N/A THR 6.A OG1 ASP 4.A OD1 no hydrogen 2.659 N/A SER 7.A N ASP 4.A O no hydrogen 3.386 N/A SER 7.A OG ASP 4.A O no hydrogen 3.149 N/A TYR 10.A N SER 7.A OG no hydrogen 3.190 N/A LYS 11.A N SER 7.A O no hydrogen 3.083 N/A ASP 12.A N ASP 8.A O no hydrogen 2.962 N/A ALA 13.A N ARG 9.A O no hydrogen 3.349 N/A TYR 14.A N TYR 10.A O no hydrogen 2.813 N/A TYR 14.A OH TYR 118.A OH no hydrogen 2.778 N/A SER 15.A N LYS 11.A O no hydrogen 2.943 N/A SER 15.A OG ASP 12.A O no hydrogen 2.579 N/A ARG 16.A NE ASP 180.A OD2 no hydrogen 2.807 N/A ARG 16.A NH1 ASP 12.A OD1 no hydrogen 3.070 N/A ARG 16.A NH2 ASP 12.A OD2 no hydrogen 2.839 N/A ARG 16.A NH2 ASP 180.A OD1 no hydrogen 2.832 N/A ILE 17.A N ALA 13.A O no hydrogen 3.212 N/A ASN 18.A N TYR 14.A O no hydrogen 2.833 N/A ILE 20.A N ARG 16.A O no hydrogen 3.044 N/A VAL 21.A N ILE 17.A O no hydrogen 3.073 N/A ILE 22.A N ASN 18.A O no hydrogen 2.929 N/A GLU 23.A N ALA 19.A O no hydrogen 2.887 N/A GLY 24.A N ILE 20.A O no hydrogen 2.854 N/A GLU 25.A N VAL 21.A O no hydrogen 3.129 N/A GLN 26.A N ILE 22.A O no hydrogen 3.149 N/A GLN 26.A NE2 ASP 30.A OD1 no hydrogen 2.909 N/A GLU 27.A N GLU 23.A O no hydrogen 2.912 N/A ALA 28.A N GLY 24.A O no hydrogen 2.923 N/A HIS 29.A N GLU 25.A O no hydrogen 3.074 N/A HIS 29.A ND1 ASP 30.A OD1 no hydrogen 3.028 N/A ASP 30.A N GLN 26.A O no hydrogen 3.047 N/A ASN 31.A N GLU 27.A O no hydrogen 2.816 N/A ASN 31.A ND2 GLN 103.A OE1.A no hydrogen 2.733 N/A ASN 31.A ND2 GLN 103.A OE1.B no hydrogen 2.794 N/A TYR 32.A N ALA 28.A O no hydrogen 3.007 N/A TYR 32.A OH.A GLU 108.A OE2.A no hydrogen 2.793 N/A TYR 32.A OH.B GLU 53.A OE2 no hydrogen 2.712 N/A TYR 32.A OH.B GLU 108.A OE2.A no hydrogen 2.513 N/A TYR 32.A OH.B GLU 108.A OE2.B no hydrogen 3.423 N/A TYR 32.A OH.B HIS 140.A ND1.A no hydrogen 2.366 N/A ILE 33.A N HIS 29.A O no hydrogen 3.240 N/A ALA 34.A N ASP 30.A O no hydrogen 2.954 N/A ILE 35.A N ASN 31.A O no hydrogen 2.858 N/A GLY 36.A N TYR 32.A O no hydrogen 3.286 N/A GLY 36.A N ILE 33.A O no hydrogen 3.150 N/A THR 37.A N ALA 34.A O no hydrogen 3.042 N/A THR 37.A OG1 ALA 34.A O no hydrogen 2.579 N/A LEU 38.A N ILE 35.A O no hydrogen 2.952 N/A LEU 39.A N ILE 35.A O no hydrogen 2.771 N/A HIS 42.A N LEU 39.A O no hydrogen 3.036 N/A LEU 46.A N HIS 42.A O no hydrogen 2.953 N/A LYS 47.A N VAL 43.A O no hydrogen 2.860 N/A LYS 47.A NZ GLU 44.A OE1 no hydrogen 3.165 N/A LYS 47.A NZ GLU 44.A OE2 no hydrogen 3.388 N/A ARG 48.A N GLU 44.A O no hydrogen 3.131 N/A LEU 49.A N GLU 45.A O no hydrogen 2.996 N/A ALA 50.A N LEU 46.A O no hydrogen 2.934 N/A LYS 51.A N LYS 47.A O no hydrogen 3.056 N/A MET 52.A N ARG 48.A O no hydrogen 3.241 N/A GLU 53.A N LEU 49.A O no hydrogen 3.317 N/A MET 54.A N ALA 50.A O no hydrogen 3.351 N/A ARG 55.A N LYS 51.A O no hydrogen 3.260 N/A HIS 56.A N MET 52.A O no hydrogen 3.063 N/A HIS 56.A ND1 GLU 53.A OE1 no hydrogen 3.045 N/A LYS 57.A N GLU 53.A O no hydrogen 2.746 N/A LYS 57.A NZ GLN 26.A OE1 no hydrogen 2.670 N/A LYS 58.A N MET 54.A O no hydrogen 3.067 N/A GLY 59.A N ARG 55.A O no hydrogen 3.096 N/A PHE 60.A N HIS 56.A O no hydrogen 2.848 N/A THR 61.A N LYS 57.A O no hydrogen 2.874 N/A THR 61.A OG1 LYS 57.A O no hydrogen 2.683 N/A ALA 62.A N LYS 58.A O no hydrogen 3.122 N/A CYS 63.A N GLY 59.A O no hydrogen 3.278 N/A CYS 63.A N PHE 60.A O no hydrogen 3.224 N/A CYS 63.A SG GLY 59.A O no hydrogen 3.452 N/A LYS 65.A N THR 61.A O no hydrogen 3.221 N/A ASN 66.A N ALA 62.A O no hydrogen 2.948 N/A LEU 67.A N CYS 63.A O no hydrogen 3.394 N/A GLY 68.A N LYS 65.A O no hydrogen 3.033 N/A VAL 69.A N GLY 64.A O no hydrogen 2.782 N/A ASP 72.A N SER 15.A O no hydrogen 2.882 N/A MET 73.A N ALA 71.A O no hydrogen 3.067 N/A PHE 75.A N ASP 72.A OD1 no hydrogen 3.361 N/A ALA 76.A N ASP 72.A O no hydrogen 3.325 N/A ARG 77.A N MET 73.A O no hydrogen 2.987 N/A GLU 78.A N ASP 74.A O no hydrogen 3.166 N/A PHE 79.A N PHE 75.A O no hydrogen 2.898 N/A PHE 80.A N ALA 76.A O no hydrogen 3.182 N/A ALA 81.A N GLU 78.A O no hydrogen 3.280 N/A ARG 84.A N PHE 80.A O no hydrogen 2.850 N/A ARG 84.A NH1 GLU 27.A OE2 no hydrogen 2.837 N/A ARG 84.A NH1 ARG 77.A O no hydrogen 2.941 N/A ARG 84.A NH2 ARG 77.A O no hydrogen 3.315 N/A ASP 85.A N ALA 81.A O no hydrogen 2.890 N/A ASN 86.A N PRO 82.A O no hydrogen 3.250 N/A ASN 86.A ND2 ASN 166.A OD1 no hydrogen 2.848 N/A PHE 87.A N LEU 83.A O no hydrogen 3.062 N/A GLN 88.A N ARG 84.A O no hydrogen 2.989 N/A THR 89.A N ASP 85.A O no hydrogen 3.010 N/A THR 89.A OG1 ASP 85.A O no hydrogen 2.869 N/A ALA 90.A N ASN 86.A O no hydrogen 3.169 N/A LEU 91.A N PHE 87.A O no hydrogen 2.893 N/A GLY 92.A N GLN 88.A O no hydrogen 3.001 N/A GLN 93.A N THR 89.A O no hydrogen 3.196 N/A GLY 94.A N LEU 91.A O no hydrogen 3.058 N/A LYS 95.A N ALA 90.A O no hydrogen 2.736 N/A LYS 95.A NZ GLN 93.A OE1 no hydrogen 3.254 N/A THR 96.A N GLY 94.A O no hydrogen 3.156 N/A THR 98.A N GLU 158.A OE2 no hydrogen 3.144 N/A THR 98.A OG1 GLU 158.A OE2 no hydrogen 2.659 N/A CYS 99.A N LYS 95.A O no hydrogen 3.129 N/A CYS 99.A SG PHE 87.A O no hydrogen 3.861 N/A CYS 99.A SG LYS 95.A O no hydrogen 3.500 N/A LEU 100.A N THR 96.A O no hydrogen 2.934 N/A LEU 101.A N PRO 97.A O no hydrogen 2.888 N/A ILE 102.A N THR 98.A O no hydrogen 3.013 N/A GLN 103.A N CYS 99.A O no hydrogen 3.181 N/A GLN 103.A NE2.A GLU 108.A OE2.A no hydrogen 3.194 N/A GLN 103.A NE2.B GLU 108.A OE2.A no hydrogen 3.149 N/A LEU 106.A N LEU 101.A O no hydrogen 2.879 N/A ILE 107.A N ILE 102.A O no hydrogen 2.892 N/A GLU 108.A N GLN 103.A O no hydrogen 3.322 N/A ALA 109.A N LEU 105.A O no hydrogen 2.979 N/A PHE 110.A N LEU 106.A O no hydrogen 2.969 N/A ALA 111.A N ILE 107.A O no hydrogen 2.896 N/A ILE 112.A N GLU 108.A O no hydrogen 2.886 N/A SER 113.A N ALA 109.A O no hydrogen 3.087 N/A SER 113.A OG LEU 191.A O no hydrogen 2.615 N/A ALA 114.A N PHE 110.A O no hydrogen 3.082 N/A TYR 115.A N ALA 111.A O no hydrogen 2.862 N/A TYR 115.A OH GLU 25.A OE2 no hydrogen 2.687 N/A HIS 116.A N ILE 112.A O no hydrogen 2.931 N/A HIS 116.A ND1 ASP 194.A OD2 no hydrogen 3.145 N/A THR 117.A N SER 113.A O no hydrogen 3.030 N/A THR 117.A OG1 SER 113.A O no hydrogen 2.677 N/A TYR 118.A N ALA 114.A O no hydrogen 2.928 N/A ILE 119.A N TYR 115.A O no hydrogen 3.046 N/A VAL 121.A N TYR 118.A O no hydrogen 3.034 N/A SER 122.A N ILE 119.A O no hydrogen 3.379 N/A SER 122.A OG ILE 119.A O no hydrogen 2.713 N/A ALA 126.A N ASP 123.A OD1 no hydrogen 2.970 N/A ARG 127.A N ASP 123.A O no hydrogen 2.875 N/A ARG 127.A NE SER 122.A O no hydrogen 3.397 N/A ARG 127.A NE SER 122.A OG no hydrogen 3.357 N/A ARG 127.A NH2 SER 122.A O no hydrogen 3.097 N/A LYS 128.A N PRO 124.A O no hydrogen 3.485 N/A ILE 129.A N PHE 125.A O no hydrogen 3.379 N/A THR 130.A N ALA 126.A O no hydrogen 2.959 N/A THR 130.A OG1 ALA 126.A O no hydrogen 2.704 N/A GLU 131.A N ARG 127.A O no hydrogen 2.823 N/A GLY 132.A N LYS 128.A O no hydrogen 2.941 N/A VAL 133.A N ILE 129.A O no hydrogen 2.926 N/A VAL 133.A N THR 130.A O no hydrogen 2.984 N/A VAL 134.A N.B THR 130.A O no hydrogen 3.101 N/A LYS 135.A N.B GLU 131.A O no hydrogen 2.961 N/A GLU 137.A N.A VAL 134.A O.A no hydrogen 3.218 N/A GLU 137.A N.B VAL 133.A O no hydrogen 2.681 N/A TYR 138.A N.A LYS 135.A O.A no hydrogen 3.292 N/A TYR 138.A N.B LYS 135.A O.A no hydrogen 2.914 N/A THR 139.A OG1.B LEU 141.A O.B no hydrogen 3.292 N/A LEU 141.A N.A GLU 137.A O.A no hydrogen 3.093 N/A ASN 142.A N.A TYR 138.A O.A no hydrogen 2.708 N/A TYR 143.A N.A THR 139.A O.A no hydrogen 2.849 N/A TYR 143.A OH.A HIS 42.A ND1 no hydrogen 2.802 N/A GLY 144.A N.A HIS 140.A O.A no hydrogen 3.211 N/A GLU 145.A N.A LEU 141.A O.A no hydrogen 2.983 N/A GLU 145.A OE1.B LEU 141.A O.A no hydrogen 1.789 N/A GLU 145.A OE1.B GLU 145.A OE2.B no hydrogen 2.204 N/A GLU 145.A OE1.B SER 202.A OG.A no hydrogen 3.340 N/A GLU 145.A OE2.B LEU 141.A O.A no hydrogen 3.315 N/A GLU 145.A OE2.B GLU 145.A OE1.B no hydrogen 2.204 N/A ALA 146.A N ASN 142.A O.A no hydrogen 3.055 N/A ALA 146.A N ASN 142.A O.B no hydrogen 3.082 N/A TRP 147.A N TYR 143.A O.A no hydrogen 3.436 N/A LEU 148.A N GLY 144.A O.A no hydrogen 3.490 N/A LEU 148.A N GLY 144.A O.B no hydrogen 2.655 N/A LYS 149.A N GLU 145.A O.B no hydrogen 2.901 N/A LYS 149.A NZ GLU 205.A O no hydrogen 2.950 N/A ALA 150.A N ALA 146.A O no hydrogen 3.166 N/A ASN 151.A N TRP 147.A O no hydrogen 2.996 N/A ASN 151.A ND2 TRP 147.A O no hydrogen 2.730 N/A SER 154.A N ASN 151.A O no hydrogen 3.269 N/A SER 154.A OG ASN 151.A O no hydrogen 2.963 N/A CYS 155.A N LEU 152.A O no hydrogen 3.021 N/A CYS 155.A SG ASN 151.A O no hydrogen 3.252 N/A CYS 155.A SG LEU 152.A O no hydrogen 4.018 N/A ARG 156.A NE.A GLU 153.A OE1 no hydrogen 3.193 N/A ARG 156.A NE.A GLU 153.A OE2 no hydrogen 3.044 N/A ARG 156.A NH1.B GLU 153.A OE1 no hydrogen 2.825 N/A ARG 156.A NH1.B GLU 153.A OE2 no hydrogen 3.308 N/A ARG 156.A NH2.A GLU 153.A OE2 no hydrogen 2.884 N/A ARG 156.A NH2.B GLU 153.A OE2 no hydrogen 2.811 N/A LEU 159.A N CYS 155.A O no hydrogen 3.081 N/A LEU 160.A N ARG 156.A O.A no hydrogen 3.225 N/A LEU 160.A N ARG 156.A O.B no hydrogen 3.181 N/A GLU 161.A N GLU 157.A O no hydrogen 3.145 N/A ALA 162.A N GLU 158.A O no hydrogen 2.828 N/A ASN 163.A N LEU 159.A O no hydrogen 2.894 N/A ASN 163.A ND2 MET 216.A O no hydrogen 2.791 N/A ARG 164.A N.A LEU 160.A O no hydrogen 3.060 N/A ARG 164.A N.B LEU 160.A O no hydrogen 3.053 N/A ARG 164.A NH2.B GLU 161.A OE1 no hydrogen 2.808 N/A GLU 165.A N GLU 161.A O no hydrogen 3.065 N/A ASN 166.A N ALA 162.A O no hydrogen 2.888 N/A ASN 166.A ND2 ALA 162.A O no hydrogen 2.915 N/A LEU 167.A N ASN 163.A O no hydrogen 2.856 N/A ILE 170.A N ASN 166.A O no hydrogen 3.324 N/A LEU 171.A N LEU 167.A O no hydrogen 3.213 N/A ARG 172.A N PRO 168.A O no hydrogen 2.982 N/A MET 173.A N LEU 169.A O no hydrogen 2.964 N/A LEU 174.A N ILE 170.A O no hydrogen 3.096 N/A ASP 175.A N LEU 171.A O no hydrogen 3.053 N/A GLN 176.A N ARG 172.A O no hydrogen 3.021 N/A VAL 177.A N MET 173.A O no hydrogen 3.293 N/A VAL 177.A N LEU 174.A O no hydrogen 3.112 N/A ALA 181.A N VAL 177.A O no hydrogen 2.998 N/A ALA 182.A N ALA 178.A O no hydrogen 3.018 N/A VAL 183.A N GLY 179.A O no hydrogen 3.248 N/A LEU 184.A N ASP 180.A O no hydrogen 3.251 N/A GLN 185.A N ALA 182.A O no hydrogen 2.988 N/A GLN 185.A NE2 ALA 1.A O no hydrogen 3.001 N/A MET 186.A N ALA 181.A O no hydrogen 2.929 N/A LYS 188.A NZ ASP 175.A OD1 no hydrogen 2.799 N/A GLU 189.A N ASP 187.A OD1 no hydrogen 3.037 N/A LEU 191.A N ASP 187.A O no hydrogen 3.254 N/A ILE 192.A N LYS 188.A O no hydrogen 2.964 N/A GLU 193.A N GLU 189.A O no hydrogen 2.999 N/A ASP 194.A N ASP 190.A O no hydrogen 3.055 N/A PHE 195.A N LEU 191.A O no hydrogen 3.026 N/A LEU 196.A N ILE 192.A O no hydrogen 2.977 N/A ILE 197.A N GLU 193.A O no hydrogen 3.025 N/A ALA 198.A N ASP 194.A O no hydrogen 3.044 N/A TYR 199.A N PHE 195.A O no hydrogen 2.848 N/A TYR 199.A OH ASN 163.A OD1 no hydrogen 2.690 N/A GLN 200.A N LEU 196.A O no hydrogen 2.802 N/A GLU 201.A N ILE 197.A O no hydrogen 2.923 N/A SER 202.A N ALA 198.A O no hydrogen 3.257 N/A SER 202.A OG.A GLU 145.A OE1.B no hydrogen 3.340 N/A SER 202.A OG.A ALA 198.A O no hydrogen 2.929 N/A SER 202.A OG.B ALA 198.A O no hydrogen 3.433 N/A SER 202.A OG.B TYR 199.A O no hydrogen 2.670 N/A LEU 203.A N TYR 199.A O no hydrogen 3.109 N/A THR 204.A N GLN 200.A O no hydrogen 2.991 N/A THR 204.A OG1 GLN 200.A O no hydrogen 2.820 N/A GLU 205.A N GLU 201.A O no hydrogen 3.130 N/A ILE 206.A N SER 202.A O no hydrogen 3.015 N/A GLY 207.A N LEU 203.A O no hydrogen 3.211 N/A PHE 208.A N LEU 203.A O no hydrogen 3.126 N/A ASN 209.A N GLU 212.A OE1 no hydrogen 2.990 N/A GLU 212.A N ASN 209.A OD1 no hydrogen 2.913 N/A ILE 213.A N ASN 209.A O no hydrogen 3.023 N/A THR 214.A N THR 210.A O no hydrogen 2.996 N/A THR 214.A OG1 THR 210.A O no hydrogen 2.855 N/A ARG 215.A N ARG 211.A O no hydrogen 3.030 N/A MET 216.A N GLU 212.A O no hydrogen 2.977 N/A ALA 217.A N ILE 213.A O no hydrogen 2.799 N/A ALA 218.A N THR 214.A O no hydrogen 3.049 N/A ALA 219.A N MET 216.A O no hydrogen 3.192 N/A ALA 220.A N ALA 217.A O no hydrogen 3.375 N/A