Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3p77_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 2.A N GLU 101.A OE2 no hydrogen 2.756 N/A HIS 4.A N ILE 99.A O no hydrogen 2.909 N/A HIS 4.A ND1 ASP 30.A OD2 no hydrogen 2.600 N/A SER 5.A N ASP 30.A OD1 no hydrogen 2.908 N/A SER 5.A OG.B ASP 98.A OD1 no hydrogen 2.718 N/A LEU 6.A N CYS 97.A O no hydrogen 2.834 N/A ARG 7.A N TYR 28.A O no hydrogen 2.906 N/A ARG 7.A NH1 LEU 6.A O no hydrogen 3.152 N/A ARG 7.A NH1 ASP 98.A OD1 no hydrogen 2.861 N/A ARG 7.A NH2 ASP 98.A OD1 no hydrogen 2.990 N/A TYR 8.A N PHE 95.A O no hydrogen 2.781 N/A PHE 9.A N VAL 26.A O no hydrogen 2.862 N/A LEU 10.A N MET 93.A O no hydrogen 2.870 N/A THR 11.A N VAL 24.A O no hydrogen 2.900 N/A GLY 12.A N MET 91.A O no hydrogen 2.813 N/A MET 13.A N ARG 22.A O no hydrogen 2.743 N/A THR 14.A N HIS 89.A O no hydrogen 3.078 N/A THR 14.A OG1 HIS 89.A O no hydrogen 3.568 N/A MET 20.A N GLY 17.A O no hydrogen 3.055 N/A PHE 23.A N SER 39.A OG no hydrogen 3.040 N/A VAL 24.A N THR 11.A O no hydrogen 2.906 N/A ILE 25.A N TYR 37.A O no hydrogen 2.892 N/A VAL 26.A N PHE 9.A O no hydrogen 2.987 N/A GLY 27.A N GLY 35.A O no hydrogen 2.917 N/A TYR 28.A N ARG 7.A O no hydrogen 2.870 N/A VAL 29.A N LYS 32.A O no hydrogen 2.785 N/A ASP 30.A N SER 5.A O no hydrogen 2.938 N/A LYS 32.A N VAL 29.A O no hydrogen 2.982 N/A PHE 34.A N GLY 27.A O no hydrogen 2.893 N/A THR 36.A N GLN 45.A O no hydrogen 3.069 N/A TYR 37.A N ILE 25.A O no hydrogen 2.930 N/A TYR 37.A OH GLU 70.A OE1 no hydrogen 2.679 N/A SER 39.A N PHE 23.A O no hydrogen 2.897 N/A SER 39.A OG PHE 23.A O no hydrogen 3.365 N/A LYS 40.A N ASN 38.A OD1 no hydrogen 2.832 N/A SER 41.A N ASN 38.A OD1 no hydrogen 2.928 N/A SER 41.A OG ASN 38.A O no hydrogen 3.399 N/A SER 41.A OG THR 43.A O no hydrogen 3.485 N/A SER 41.A OG THR 43.A OG1.B no hydrogen 3.376 N/A ARG 42.A N ASN 38.A O no hydrogen 2.831 N/A THR 43.A N SER 41.A OG no hydrogen 3.320 N/A THR 43.A OG1.A SER 41.A O no hydrogen 3.086 N/A THR 43.A OG1.B SER 41.A OG no hydrogen 3.376 N/A ALA 44.A N THR 63.A OG1 no hydrogen 2.934 N/A GLN 45.A N THR 36.A O no hydrogen 2.939 N/A ILE 47.A N PHE 34.A O no hydrogen 2.888 N/A MET 50.A N ILE 47.A O no hydrogen 2.914 N/A LEU 51.A N ILE 47.A O no hydrogen 2.898 N/A GLN 56.A NE2 ASP 60.A OD1 no hydrogen 2.774 N/A HIS 58.A N ASP 55.A OD2 no hydrogen 2.984 N/A HIS 58.A NE2 TYR 167.A OH no hydrogen 2.648 N/A TRP 59.A NE1 GLU 54.A OE1 no hydrogen 2.883 N/A ASP 60.A N GLN 56.A O no hydrogen 2.763 N/A THR 61.A N GLU 57.A O no hydrogen 3.137 N/A THR 61.A OG1 GLU 57.A O no hydrogen 3.356 N/A GLN 62.A N HIS 58.A O no hydrogen 3.005 N/A GLN 62.A NE2 HIS 58.A O no hydrogen 3.185 N/A THR 63.A N TRP 59.A O no hydrogen 2.940 N/A THR 63.A OG1 TRP 59.A O no hydrogen 2.860 N/A GLN 64.A N ASP 60.A O no hydrogen 3.055 N/A LYS 65.A N THR 61.A O no hydrogen 2.977 N/A LYS 65.A NZ GLU 155.A OE2 no hydrogen 2.682 N/A ALA 66.A N GLN 62.A O no hydrogen 2.869 N/A GLN 67.A N THR 63.A O no hydrogen 2.891 N/A GLN 67.A NE2 ARG 42.A O no hydrogen 3.014 N/A GLY 68.A N GLN 64.A O no hydrogen 3.108 N/A GLY 69.A N LYS 65.A O no hydrogen 3.038 N/A GLU 70.A N ALA 66.A O no hydrogen 2.924 N/A ARG 71.A N GLN 67.A O no hydrogen 3.195 N/A ASP 72.A N GLY 68.A O no hydrogen 3.032 N/A PHE 73.A N GLY 69.A O no hydrogen 2.898 N/A ASP 74.A N GLU 70.A O no hydrogen 3.051 N/A TRP 75.A N ARG 71.A O no hydrogen 3.249 N/A ASN 76.A N ASP 72.A O no hydrogen 3.157 N/A LEU 77.A N PHE 73.A O no hydrogen 3.033 N/A ASN 78.A N ASP 74.A O no hydrogen 3.318 N/A ARG 79.A N TRP 75.A O no hydrogen 3.024 N/A ARG 79.A N ASN 76.A O no hydrogen 3.191 N/A LEU 80.A N ASN 76.A O no hydrogen 2.930 N/A TYR 84.A N LEU 80.A O no hydrogen 3.133 N/A TYR 84.A OH ASP 132.A OD1 no hydrogen 3.104 N/A TYR 84.A OH ASP 132.A OD2 no hydrogen 2.780 N/A ASN 85.A N GLU 82.A O no hydrogen 3.041 N/A LYS 86.A N PRO 81.A O no hydrogen 2.915 N/A LYS 86.A NZ ASP 114.A OD2 no hydrogen 3.106 N/A HIS 89.A N THR 14.A OG1 no hydrogen 2.964 N/A HIS 89.A ND1 ASP 114.A OD1 no hydrogen 3.206 N/A HIS 89.A ND1 ASP 114.A OD2 no hydrogen 2.645 N/A THR 90.A N ASP 114.A OD1 no hydrogen 2.875 N/A MET 91.A N GLY 12.A O no hydrogen 2.867 N/A GLN 92.A N ALA 112.A O no hydrogen 2.858 N/A MET 93.A N LEU 10.A O no hydrogen 3.006 N/A MET 94.A N GLN 110.A O no hydrogen 2.901 N/A PHE 95.A N TYR 8.A O no hydrogen 3.154 N/A GLY 96.A N TYR 108.A O no hydrogen 2.896 N/A CYS 97.A N LEU 6.A O no hydrogen 2.989 N/A ASP 98.A N ARG 106.A O no hydrogen 2.891 N/A ILE 99.A N HIS 4.A O no hydrogen 2.925 N/A LEU 100.A N SER 104.A O no hydrogen 2.973 N/A GLU 101.A N GLY 2.A O no hydrogen 2.843 N/A GLY 103.A N LEU 100.A O no hydrogen 3.021 N/A SER 104.A N ASP 102.A OD2 no hydrogen 2.946 N/A SER 104.A OG ASP 102.A OD2 no hydrogen 2.636 N/A ARG 106.A N ASP 98.A O no hydrogen 3.015 N/A ARG 106.A NH1 SER 104.A OG no hydrogen 2.927 N/A ARG 106.A NH1 ILE 105.A O no hydrogen 3.035 N/A TYR 108.A N GLY 96.A O no hydrogen 2.919 N/A TYR 108.A OH ASP 98.A OD2 no hydrogen 2.524 N/A GLN 110.A N MET 94.A O no hydrogen 2.903 N/A TYR 111.A N LEU 119.A O no hydrogen 2.746 N/A ALA 112.A N GLN 92.A O no hydrogen 2.898 N/A PHE 113.A N ARG 116.A O no hydrogen 2.905 N/A ASP 114.A N THR 90.A O no hydrogen 2.884 N/A ARG 116.A N PHE 113.A O no hydrogen 3.013 N/A PHE 118.A N TYR 111.A O no hydrogen 2.858 N/A LEU 119.A N TYR 111.A O no hydrogen 3.398 N/A ALA 120.A N THR 129.A O no hydrogen 2.910 N/A PHE 121.A N ASP 109.A O no hydrogen 2.907 N/A ASP 122.A N THR 127.A O no hydrogen 2.822 N/A THR 125.A N ASP 122.A OD2 no hydrogen 3.151 N/A THR 125.A OG1 ASP 122.A OD2 no hydrogen 2.700 N/A THR 125.A OG1 THR 127.A OG1 no hydrogen 2.654 N/A MET 126.A N MET 123.A O no hydrogen 3.299 N/A THR 127.A N ASP 122.A O no hydrogen 3.254 N/A THR 127.A OG1 THR 125.A OG1 no hydrogen 2.654 N/A THR 129.A N ALA 120.A O no hydrogen 2.894 N/A ALA 131.A N PHE 118.A O no hydrogen 2.921 N/A VAL 134.A N ASP 132.A OD1 no hydrogen 2.855 N/A ALA 135.A N ASP 132.A OD1 no hydrogen 2.916 N/A GLU 136.A N ASP 132.A O no hydrogen 2.948 N/A ILE 137.A N VAL 134.A O no hydrogen 2.987 N/A LYS 139.A N ALA 135.A O no hydrogen 3.031 N/A LYS 139.A NZ GLU 136.A OE2 no hydrogen 3.373 N/A LYS 139.A NZ GLU 143.A OE1 no hydrogen 3.133 N/A LYS 139.A NZ GLU 143.A OE2 no hydrogen 3.153 N/A ARG 140.A N GLU 136.A O no hydrogen 2.917 N/A ARG 141.A N ILE 137.A O no hydrogen 3.002 N/A TRP 142.A N THR 138.A O no hydrogen 2.845 N/A GLU 143.A N LYS 139.A O no hydrogen 2.953 N/A THR 144.A N ARG 140.A O no hydrogen 2.983 N/A THR 144.A OG1 ARG 140.A O no hydrogen 2.841 N/A GLU 145.A N ARG 141.A O no hydrogen 3.191 N/A GLY 146.A N GLU 143.A O no hydrogen 3.096 N/A GLU 150.A N GLY 146.A O no hydrogen 3.437 N/A ARG 151.A N THR 147.A O no hydrogen 2.840 N/A TRP 152.A N TYR 148.A O no hydrogen 2.933 N/A LYS 153.A N ALA 149.A O no hydrogen 2.965 N/A HIS 154.A N GLU 150.A O no hydrogen 3.141 N/A GLU 155.A N ARG 151.A O no hydrogen 2.866 N/A LEU 156.A N TRP 152.A O no hydrogen 2.914 N/A GLY 157.A N LYS 153.A O no hydrogen 2.805 N/A THR 158.A N HIS 154.A O no hydrogen 2.963 N/A VAL 159.A N HIS 154.A O no hydrogen 2.957 N/A CYS 160.A N GLU 155.A O no hydrogen 2.785 N/A GLN 162.A N THR 158.A O no hydrogen 3.038 N/A ASN 163.A N VAL 159.A O no hydrogen 2.954 N/A LEU 164.A N CYS 160.A O no hydrogen 2.821 N/A ARG 165.A N VAL 161.A O no hydrogen 2.995 N/A ARG 166.A N GLN 162.A O no hydrogen 2.967 N/A ARG 166.A NE GLU 54.A OE1 no hydrogen 3.366 N/A ARG 166.A NH1 GLU 54.A OE1 no hydrogen 2.841 N/A ARG 166.A NH1 ASP 55.A OD1 no hydrogen 2.670 N/A TYR 167.A N ASN 163.A O no hydrogen 2.829 N/A TYR 167.A OH HIS 58.A NE2 no hydrogen 2.648 N/A LEU 168.A N LEU 164.A O no hydrogen 2.890 N/A GLU 169.A N ARG 165.A O no hydrogen 3.183 N/A HIS 170.A N ARG 166.A O no hydrogen 2.864 N/A HIS 170.A ND1 GLU 54.A OE2 no hydrogen 2.669 N/A GLY 171.A N TYR 167.A O no hydrogen 2.742 N/A LYS 172.A N GLU 169.A O no hydrogen 3.413 N/A LYS 172.A NZ GLU 169.A OE2 no hydrogen 3.331 N/A LEU 175.A N GLY 171.A O no hydrogen 3.029 N/A LYS 176.A N LYS 172.A O no hydrogen 3.030 N/A ARG 177.A N ALA 173.A O no hydrogen 3.069 N/A VAL 179.A N TYR 204.A O no hydrogen 2.784 N/A GLN 180.A NE2 SER 260.A O no hydrogen 3.204 N/A GLU 182.A N HIS 201.A O no hydrogen 2.853 N/A ARG 184.A N HIS 199.A O no hydrogen 2.939 N/A TRP 186.A N SER 197.A O no hydrogen 2.895 N/A LYS 188.A N THR 195.A O no hydrogen 3.024 N/A ALA 190.A N ILE 193.A O no hydrogen 2.979 N/A ILE 193.A N ALA 190.A O no hydrogen 3.213 N/A LEU 194.A N VAL 244.A O no hydrogen 2.949 N/A THR 195.A N LYS 188.A O no hydrogen 2.785 N/A THR 195.A OG1 ASP 243.A OD1 no hydrogen 2.711 N/A LEU 196.A N ILE 242.A O no hydrogen 2.736 N/A SER 197.A N TRP 186.A O no hydrogen 2.846 N/A SER 197.A OG.A TRP 186.A O no hydrogen 3.462 N/A CYS 198.A N ALA 240.A O no hydrogen 2.776 N/A HIS 199.A N ARG 184.A O no hydrogen 2.869 N/A HIS 199.A ND1 HIS 237.A NE2 no hydrogen 2.727 N/A ALA 200.A N ALA 238.A O no hydrogen 2.859 N/A HIS 201.A N GLU 182.A O no hydrogen 2.849 N/A GLY 202.A N TYR 236.A O no hydrogen 2.743 N/A PHE 203.A N TYR 236.A O no hydrogen 3.147 N/A TYR 204.A N VAL 179.A O no hydrogen 2.984 N/A THR 209.A N GLU 257.A O no hydrogen 3.079 N/A THR 209.A OG1.B GLU 257.A OE1 no hydrogen 2.527 N/A SER 211.A N ARG 255.A O no hydrogen 2.865 N/A TRP 212.A NE1 ALA 240.A O no hydrogen 3.081 N/A MET 213.A N TRP 253.A O no hydrogen 2.789 N/A LYS 214.A N MET 217.A O no hydrogen 3.070 N/A LYS 214.A NZ ASP 215.A OD2 no hydrogen 2.814 N/A MET 217.A N LYS 214.A O no hydrogen 3.102 N/A ARG 219.A N TRP 212.A O no hydrogen 2.889 N/A GLU 222.A N ARG 219.A O no hydrogen 3.255 N/A THR 223.A N ASP 220.A O no hydrogen 3.305 N/A THR 223.A OG1 ARG 219.A O no hydrogen 2.759 N/A ARG 224.A N ALA 241.A O no hydrogen 2.848 N/A ARG 224.A NH1 ASP 243.A OD2 no hydrogen 3.234 N/A ARG 224.A NH2 ASP 243.A OD1 no hydrogen 2.933 N/A TRP 225.A NE1 ILE 210.A O no hydrogen 2.858 N/A GLY 226.A N SER 239.A O no hydrogen 3.002 N/A VAL 229.A N HIS 237.A O no hydrogen 2.870 N/A ASN 231.A N THR 235.A O no hydrogen 2.844 N/A ASN 231.A ND2 THR 235.A OG1 no hydrogen 2.888 N/A THR 235.A N ASP 233.A OD1 no hydrogen 3.081 N/A THR 235.A OG1 ASP 233.A OD1 no hydrogen 2.721 N/A TYR 236.A N PHE 203.A O no hydrogen 2.841 N/A TYR 236.A OH ASP 31.A O no hydrogen 2.529 N/A HIS 237.A N VAL 229.A O no hydrogen 2.810 N/A HIS 237.A NE2 HIS 199.A ND1 no hydrogen 2.727 N/A ALA 238.A N ALA 200.A O no hydrogen 3.063 N/A ALA 240.A N CYS 198.A O no hydrogen 2.963 N/A ALA 241.A N ARG 224.A O no hydrogen 2.812 N/A ILE 242.A N LEU 196.A O no hydrogen 2.904 N/A VAL 244.A N LEU 194.A O no hydrogen 2.816 N/A GLU 247.A N GLU 247.A OE1 no hydrogen 2.778 N/A ASP 248.A N LEU 245.A O no hydrogen 2.857 N/A GLY 249.A N PRO 246.A O no hydrogen 3.261 N/A LYS 251.A N ASP 248.A O no hydrogen 3.113 N/A TRP 253.A N MET 213.A O no hydrogen 2.821 N/A CYS 254.A N PHE 267.A O no hydrogen 2.665 N/A ARG 255.A N SER 211.A O no hydrogen 2.778 N/A ARG 255.A NH2 SER 211.A OG no hydrogen 3.009 N/A VAL 256.A N GLY 265.A O no hydrogen 2.940 N/A GLU 257.A N THR 209.A O no hydrogen 3.041 N/A HIS 258.A ND1 SER 260.A OG no hydrogen 2.776 N/A HIS 258.A NE2 PRO 205.A O no hydrogen 2.760 N/A SER 260.A N HIS 258.A ND1 no hydrogen 3.161 N/A SER 260.A OG HIS 258.A ND1 no hydrogen 2.776 N/A LEU 261.A N HIS 258.A O no hydrogen 2.997 N/A GLY 265.A N VAL 256.A O no hydrogen 2.785 N/A PHE 267.A N CYS 254.A O no hydrogen 2.841 N/A