Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6gdp_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 5.A N ASP 88.A OD1 no hydrogen 2.874 N/A ALA 6.A N ARG 29.A O no hydrogen 2.781 N/A VAL 7.A N VAL 89.A O no hydrogen 2.857 N/A VAL 8.A N VAL 31.A O no hydrogen 3.062 N/A THR 9.A N VAL 91.A O no hydrogen 3.051 N/A THR 9.A OG1 VAL 91.A O no hydrogen 3.388 N/A GLY 10.A N HIS 33.A ND1 no hydrogen 2.915 N/A ALA 11.A N HIS 33.A O no hydrogen 2.889 N/A LYS 13.A NZ.A SER 37.A OG no hydrogen 3.153 N/A LYS 13.A NZ.B SER 37.A OG no hydrogen 3.147 N/A ARG 14.A NH1 LEU 193.A O no hydrogen 2.878 N/A ARG 14.A NH2 LEU 192.A O no hydrogen 2.849 N/A ARG 17.A N LYS 13.A O no hydrogen 3.087 N/A ARG 17.A NH2 GLU 47.A OE1 no hydrogen 3.060 N/A ALA 18.A N ARG 14.A O no hydrogen 3.054 N/A ILE 19.A N ILE 15.A O no hydrogen 2.955 N/A ALA 20.A N GLY 16.A O no hydrogen 2.936 N/A VAL 21.A N ARG 17.A O no hydrogen 2.797 N/A LYS 22.A N ALA 18.A O no hydrogen 2.966 N/A LYS 22.A NZ GLU 219.A OE1 no hydrogen 2.635 N/A LYS 22.A NZ ASP 223.A OD1 no hydrogen 3.006 N/A LEU 23.A N ILE 19.A O no hydrogen 2.878 N/A HIS 24.A N ALA 20.A O no hydrogen 2.932 N/A HIS 24.A NE2 THR 55.A OG1 no hydrogen 2.750 N/A GLN 25.A N VAL 21.A O no hydrogen 2.846 N/A THR 26.A N LYS 22.A O no hydrogen 3.014 N/A THR 26.A OG1 LYS 22.A O no hydrogen 2.739 N/A GLY 27.A N HIS 24.A O no hydrogen 2.978 N/A TYR 28.A N LEU 23.A O no hydrogen 2.962 N/A ARG 29.A N PRO 4.A O no hydrogen 2.954 N/A ARG 29.A NE ALA 3.A O no hydrogen 3.162 N/A ARG 29.A NH2 ALA 3.A O no hydrogen 2.808 N/A ARG 29.A NH2 PHE 84.A O no hydrogen 3.108 N/A VAL 30.A N THR 55.A O no hydrogen 2.857 N/A VAL 31.A N ALA 6.A O no hydrogen 2.846 N/A ILE 32.A N VAL 57.A O no hydrogen 2.777 N/A HIS 33.A N VAL 8.A O no hydrogen 3.121 N/A HIS 33.A NE2 ALA 61.A O no hydrogen 2.831 N/A TYR 34.A N CYS 59.A O no hydrogen 3.074 N/A ALA 38.A N ASN 36.A O no hydrogen 3.001 N/A ALA 41.A N SER 37.A O no hydrogen 2.879 N/A VAL 42.A N ALA 38.A O no hydrogen 2.993 N/A SER 43.A N GLU 39.A O no hydrogen 2.928 N/A LEU 44.A N ALA 40.A O no hydrogen 3.041 N/A ALA 45.A N ALA 41.A O no hydrogen 2.966 N/A ASP 46.A N VAL 42.A O no hydrogen 2.868 N/A GLU 47.A N SER 43.A O no hydrogen 3.101 N/A LEU 48.A N LEU 44.A O no hydrogen 2.956 N/A ASN 49.A N ALA 45.A O no hydrogen 2.846 N/A ASN 49.A ND2 ALA 56.A O no hydrogen 2.864 N/A LYS 50.A N ASP 46.A O no hydrogen 2.950 N/A GLU 51.A N GLU 47.A O no hydrogen 3.193 N/A ARG 52.A N LEU 48.A O no hydrogen 3.003 N/A ARG 52.A NH1 HIS 24.A O no hydrogen 2.932 N/A ARG 52.A NH2 HIS 24.A O no hydrogen 2.975 N/A THR 55.A N ASN 49.A OD1 no hydrogen 2.831 N/A THR 55.A OG1 HIS 24.A NE2 no hydrogen 2.750 N/A THR 55.A OG1 ARG 52.A O no hydrogen 2.640 N/A ALA 56.A N ASN 49.A OD1 no hydrogen 2.977 N/A VAL 57.A N VAL 30.A O no hydrogen 3.046 N/A CYS 59.A N ILE 32.A O no hydrogen 2.997 N/A CYS 59.A SG SER 79.A OG.A no hydrogen 3.412 N/A CYS 59.A SG SER 79.A OG.B no hydrogen 3.693 N/A GLN 60.A NE2 HIS 35.A O no hydrogen 3.019 N/A ALA 61.A N TYR 34.A O no hydrogen 2.939 N/A THR 64.A N ASP 62.A OD1 no hydrogen 3.027 N/A THR 64.A OG1 ASP 62.A OD1 no hydrogen 2.665 N/A THR 64.A OG1 ASP 62.A OD2 no hydrogen 3.567 N/A ASN 65.A N ALA 113.A O no hydrogen 2.866 N/A VAL 68.A N SER 66.A OG no hydrogen 3.153 N/A LEU 69.A N SER 66.A O no hydrogen 3.129 N/A SER 72.A N VAL 68.A O no hydrogen 3.037 N/A SER 72.A OG VAL 68.A O no hydrogen 3.522 N/A CYS 73.A N LEU 69.A O no hydrogen 2.913 N/A CYS 73.A SG LEU 69.A O no hydrogen 3.512 N/A CYS 73.A SG ALA 122.A O no hydrogen 3.909 N/A GLU 74.A N PRO 70.A O no hydrogen 2.908 N/A GLU 75.A N ALA 71.A O no hydrogen 2.910 N/A ILE 76.A N SER 72.A O no hydrogen 3.000 N/A ILE 77.A N CYS 73.A O no hydrogen 3.234 N/A ASN 78.A N GLU 74.A O no hydrogen 2.787 N/A SER 79.A N GLU 75.A O no hydrogen 2.832 N/A SER 79.A OG.A GLU 75.A O no hydrogen 2.913 N/A SER 79.A OG.A GLU 75.A OE2 no hydrogen 3.107 N/A SER 79.A OG.B ILE 76.A O no hydrogen 2.657 N/A CYS 80.A N ILE 77.A O no hydrogen 3.093 N/A CYS 80.A SG ARG 86.A O no hydrogen 3.408 N/A PHE 81.A N ILE 77.A O no hydrogen 3.291 N/A ARG 82.A N ASN 78.A O no hydrogen 2.805 N/A ARG 82.A NH1.A GLU 75.A OE2 no hydrogen 2.997 N/A ARG 82.A NH1.B GLU 75.A OE1 no hydrogen 2.990 N/A ARG 82.A NH1.B GLU 75.A OE2 no hydrogen 3.496 N/A ARG 82.A NH2.A GLU 75.A OE1 no hydrogen 3.185 N/A ARG 82.A NH2.A GLU 75.A OE2 no hydrogen 3.091 N/A ARG 82.A NH2.B GLU 75.A OE2 no hydrogen 2.921 N/A ALA 83.A N SER 79.A O no hydrogen 3.032 N/A PHE 84.A N CYS 80.A O no hydrogen 2.876 N/A GLY 85.A N PHE 81.A O no hydrogen 2.803 N/A ARG 86.A NE ASP 88.A OD1 no hydrogen 2.781 N/A ARG 86.A NH1 MET 1.A O no hydrogen 3.161 N/A ARG 86.A NH2 ASP 88.A OD1 no hydrogen 3.481 N/A ARG 86.A NH2 ASP 88.A OD2 no hydrogen 2.939 N/A CYS 87.A SG VAL 89.A O no hydrogen 3.984 N/A ASP 88.A N ALA 5.A O no hydrogen 2.804 N/A VAL 89.A N ALA 5.A O no hydrogen 3.184 N/A LEU 90.A N SER 139.A O no hydrogen 3.144 N/A VAL 91.A N VAL 7.A O no hydrogen 2.804 N/A ASN 92.A N VAL 141.A O no hydrogen 2.865 N/A ASN 92.A ND2 ASN 142.A OD1 no hydrogen 2.784 N/A ASN 93.A N THR 9.A OG1 no hydrogen 2.960 N/A ASN 93.A ND2 THR 9.A O no hydrogen 3.152 N/A ALA 94.A N THR 9.A OG1 no hydrogen 2.994 N/A SER 95.A OG ALA 96.A O no hydrogen 3.311 N/A SER 95.A OG ASN 119.A OD1 no hydrogen 2.730 N/A ALA 96.A N THR 118.A OG1 no hydrogen 2.945 N/A TYR 98.A OH GLU 114.A OE1 no hydrogen 2.634 N/A THR 100.A N ALA 154.A O no hydrogen 2.750 N/A LYS 106.A NZ GLU 114.A OE1 no hydrogen 2.712 N/A LYS 106.A NZ GLU 114.A OE2 no hydrogen 3.536 N/A THR 107.A OG1 THR 110.A OG1 no hydrogen 3.028 N/A THR 110.A N THR 107.A OG1 no hydrogen 2.985 N/A THR 110.A OG1 THR 107.A OG1 no hydrogen 3.028 N/A GLN 111.A N THR 107.A O no hydrogen 3.023 N/A VAL 112.A N VAL 108.A O no hydrogen 2.844 N/A ALA 113.A N GLU 109.A O no hydrogen 2.927 N/A GLU 114.A N THR 110.A O no hydrogen 2.877 N/A LEU 115.A N GLN 111.A O no hydrogen 2.843 N/A ILE 116.A N VAL 112.A O no hydrogen 2.926 N/A GLY 117.A N ALA 113.A O no hydrogen 2.983 N/A THR 118.A N GLU 114.A O no hydrogen 2.891 N/A THR 118.A OG1 GLU 114.A O no hydrogen 2.748 N/A ASN 119.A N LEU 115.A O no hydrogen 3.337 N/A ASN 119.A ND2 ALA 96.A O no hydrogen 2.992 N/A ASN 119.A ND2 LEU 115.A O no hydrogen 2.988 N/A ALA 120.A N ILE 116.A O no hydrogen 3.003 N/A ILE 121.A N ILE 116.A O no hydrogen 2.967 N/A ALA 122.A N GLY 117.A O no hydrogen 2.772 N/A PHE 124.A N ALA 120.A O no hydrogen 3.061 N/A LEU 125.A N ILE 121.A O no hydrogen 2.885 N/A LEU 126.A N ALA 122.A O no hydrogen 2.805 N/A THR 127.A N PRO 123.A O no hydrogen 2.820 N/A THR 127.A OG1 PRO 123.A O no hydrogen 2.639 N/A MET 128.A N PHE 124.A O no hydrogen 2.954 N/A SER 129.A N LEU 125.A O no hydrogen 2.880 N/A SER 129.A OG LEU 125.A O no hydrogen 3.342 N/A PHE 130.A N LEU 126.A O no hydrogen 2.814 N/A ALA 131.A N THR 127.A O no hydrogen 2.955 N/A GLN 132.A N MET 128.A O no hydrogen 2.913 N/A ARG 133.A N SER 129.A O no hydrogen 3.100 N/A ARG 133.A NE ASN 78.A OD1 no hydrogen 2.937 N/A ARG 133.A NH2 ASN 78.A OD1 no hydrogen 2.677 N/A GLN 134.A N ALA 131.A O no hydrogen 3.274 N/A GLN 134.A NE2 CYS 87.A O no hydrogen 2.953 N/A GLN 134.A NE2 PHE 130.A O no hydrogen 3.089 N/A SER 139.A N ASP 88.A O no hydrogen 3.068 N/A ILE 140.A N ARG 182.A O no hydrogen 2.861 N/A VAL 141.A N LEU 90.A O no hydrogen 2.919 N/A ASN 142.A N ASN 184.A O no hydrogen 2.831 N/A ASN 142.A ND2 THR 169.A OG1 no hydrogen 2.922 N/A LEU 143.A N ASN 92.A O no hydrogen 2.928 N/A CYS 144.A N VAL 186.A O no hydrogen 2.796 N/A CYS 144.A SG ASN 142.A O no hydrogen 3.637 N/A ALA 146.A N PRO 188.A O no hydrogen 2.780 N/A MET 147.A N ASP 145.A OD1 no hydrogen 2.911 N/A VAL 148.A N ASP 145.A O no hydrogen 3.348 N/A GLN 150.A N MET 147.A O no hydrogen 2.901 N/A GLN 150.A NE2 SER 248.A O no hydrogen 2.939 N/A PHE 155.A N CYS 152.A O no hydrogen 3.305 N/A LEU 157.A N THR 100.A OG1 no hydrogen 3.299 N/A TYR 158.A OH ASP 145.A OD2 no hydrogen 2.595 N/A ASN 159.A N PHE 155.A O no hydrogen 2.930 N/A ASN 159.A ND2 VAL 148.A O no hydrogen 2.976 N/A MET 160.A N SER 156.A O no hydrogen 2.781 N/A GLY 161.A N LEU 157.A O no hydrogen 2.975 N/A LYS 162.A N TYR 158.A O no hydrogen 2.980 N/A LYS 162.A NZ ASN 119.A OD1 no hydrogen 3.020 N/A LYS 162.A NZ LEU 143.A O no hydrogen 2.840 N/A HIS 163.A N ASN 159.A O no hydrogen 2.891 N/A HIS 163.A NE2 VAL 148.A O no hydrogen 2.972 N/A ALA 164.A N MET 160.A O no hydrogen 2.874 N/A LEU 165.A N GLY 161.A O no hydrogen 2.960 N/A VAL 166.A N LYS 162.A O no hydrogen 3.130 N/A GLY 167.A N HIS 163.A O no hydrogen 3.094 N/A LEU 168.A N ALA 164.A O no hydrogen 2.831 N/A THR 169.A N LEU 165.A O no hydrogen 2.914 N/A THR 169.A OG1 LEU 165.A O no hydrogen 2.784 N/A GLN 170.A N.A VAL 166.A O no hydrogen 3.062 N/A GLN 170.A N.B VAL 166.A O no hydrogen 3.027 N/A SER 171.A N GLY 167.A O no hydrogen 2.871 N/A SER 171.A OG GLY 167.A O no hydrogen 3.247 N/A ALA 172.A N LEU 168.A O no hydrogen 2.763 N/A ALA 173.A N THR 169.A O no hydrogen 2.973 N/A LEU 174.A N GLN 170.A O.A no hydrogen 3.109 N/A LEU 174.A N GLN 170.A O.B no hydrogen 3.059 N/A GLU 175.A N SER 171.A O no hydrogen 2.998 N/A LEU 176.A N ALA 172.A O no hydrogen 2.879 N/A ALA 177.A N ALA 173.A O no hydrogen 3.130 N/A TYR 179.A N LEU 176.A O no hydrogen 2.939 N/A GLY 180.A N ALA 177.A O no hydrogen 2.918 N/A ILE 181.A N LEU 176.A O no hydrogen 3.315 N/A ARG 182.A N LEU 138.A O no hydrogen 3.141 N/A ARG 182.A NH1 LEU 228.A O no hydrogen 2.876 N/A ARG 182.A NH1 ILE 236.A O no hydrogen 3.175 N/A ARG 182.A NH2 ASN 137.A OD1 no hydrogen 3.060 N/A ARG 182.A NH2 LEU 228.A O no hydrogen 2.852 N/A VAL 183.A N THR 237.A OG1 no hydrogen 2.948 N/A ASN 184.A N ILE 140.A O no hydrogen 2.955 N/A ASN 184.A ND2 ILE 236.A O no hydrogen 2.991 N/A GLY 185.A N SER 239.A O no hydrogen 2.786 N/A VAL 186.A N ASN 142.A O no hydrogen 2.980 N/A ALA 187.A N ILE 241.A O no hydrogen 2.837 N/A SER 191.A OG ALA 216.A O no hydrogen 2.883 N/A MET 197.A N PRO 194.A O no hydrogen 3.038 N/A LYS 202.A N GLY 198.A O no hydrogen 2.987 N/A ASP 203.A N GLU 199.A O no hydrogen 2.879 N/A LYS 204.A N GLU 200.A O no hydrogen 3.100 N/A TRP 205.A N GLU 201.A O no hydrogen 3.344 N/A ARG 206.A N LYS 202.A O no hydrogen 2.921 N/A ARG 206.A NE GLU 215.A OE1 no hydrogen 3.469 N/A ARG 206.A NE GLU 215.A OE2 no hydrogen 2.805 N/A ARG 206.A NH1 GLU 199.A OE2 no hydrogen 2.902 N/A ARG 206.A NH1 ASP 203.A OD1 no hydrogen 2.886 N/A ARG 206.A NH2 GLU 215.A OE1 no hydrogen 2.888 N/A ARG 207.A N ASP 203.A O no hydrogen 2.977 N/A LYS 208.A N TRP 205.A O no hydrogen 3.044 N/A VAL 209.A N ARG 206.A O no hydrogen 3.149 N/A LEU 211.A N GLY 245.A O no hydrogen 2.941 N/A GLY 212.A N PRO 210.A O no hydrogen 3.073 N/A ARG 213.A N VAL 209.A O no hydrogen 2.994 N/A ARG 213.A NH1 ARG 207.A O no hydrogen 2.844 N/A ARG 214.A NE.B GLU 215.A OE2 no hydrogen 3.437 N/A GLU 215.A N GLU 215.A OE2 no hydrogen 2.701 N/A ALA 216.A N VAL 190.A O no hydrogen 2.950 N/A SER 217.A N GLN 220.A OE1 no hydrogen 2.937 N/A GLN 220.A N SER 217.A OG no hydrogen 3.057 N/A ILE 221.A N SER 217.A O no hydrogen 3.284 N/A ALA 222.A N ALA 218.A O no hydrogen 2.964 N/A ASP 223.A N GLU 219.A O no hydrogen 2.802 N/A ALA 224.A N ILE 221.A O no hydrogen 3.025 N/A VAL 225.A N ILE 221.A O no hydrogen 3.308 N/A ILE 226.A N ALA 222.A O no hydrogen 2.911 N/A PHE 227.A N ASP 223.A O no hydrogen 3.046 N/A LEU 228.A N ALA 224.A O no hydrogen 3.063 N/A VAL 229.A N VAL 225.A O no hydrogen 2.997 N/A SER 230.A N ILE 226.A O no hydrogen 3.126 N/A SER 230.A N PHE 227.A O no hydrogen 3.067 N/A SER 230.A OG PHE 227.A O no hydrogen 2.724 N/A SER 232.A N SER 230.A OG no hydrogen 2.997 N/A ALA 233.A N SER 230.A O no hydrogen 3.146 N/A GLN 234.A NE2.B SER 136.A O no hydrogen 3.593 N/A ILE 236.A N ALA 233.A O no hydrogen 2.887 N/A GLY 238.A N VAL 183.A O no hydrogen 2.713 N/A SER 239.A N ASN 184.A OD1 no hydrogen 2.927 N/A ILE 241.A N GLY 185.A O no hydrogen 2.884 N/A LYS 242.A NZ.B SER 248.A OG no hydrogen 3.167 N/A VAL 243.A N ALA 187.A O no hydrogen 2.922 N/A GLY 246.A N ASP 244.A OD1 no hydrogen 2.934 N/A LEU 247.A N ASP 244.A O no hydrogen 2.971 N/A SER 248.A N ASP 244.A OD2 no hydrogen 2.977 N/A SER 248.A OG ASP 244.A OD2 no hydrogen 2.751 N/A LEU 249.A N GLY 246.A O no hydrogen 2.898 N/A VAL 250.A N LEU 247.A O no hydrogen 3.061 N/A HIS 251.A ND1 ALA 252.A OXT no hydrogen 2.719 N/A