Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5paa_C.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 1.A N GLN 134.A O no hydrogen 2.918 N/A ILE 1.A N ASP 187.A OD1 no hydrogen 3.408 N/A ILE 1.A N ASP 187.A OD2 no hydrogen 2.605 N/A VAL 2.A N ASP 182.A O no hydrogen 2.686 N/A LYS 5.A N VAL 147.A O no hydrogen 3.102 N/A CYS 7.A N LEU 145.A O no hydrogen 2.786 N/A CYS 7.A SG PRO 8.A O no hydrogen 3.885 N/A LYS 9.A NZ ASP 65.A OD1 no hydrogen 3.489 N/A LYS 9.A NZ ASP 65.A OD2 no hydrogen 2.769 N/A LYS 9.A NZ ASP 67.A OD2 no hydrogen 2.787 N/A GLU 11.A N PRO 8.A O no hydrogen 2.790 N/A GLN 15.A N CYS 12.A O no hydrogen 3.071 N/A GLN 15.A NE2 VAL 16.A O no hydrogen 3.020 N/A VAL 16.A N GLY 28.A O no hydrogen 2.954 N/A LEU 17.A N VAL 55.A O no hydrogen 3.054 N/A LEU 18.A N CYS 26.A O no hydrogen 2.841 N/A LEU 19.A N ILE 53.A O no hydrogen 2.790 N/A VAL 20.A N ALA 23.A O no hydrogen 2.875 N/A ASN 21.A N ASN 51.A O no hydrogen 3.400 N/A ALA 23.A N VAL 20.A O no hydrogen 3.038 N/A GLN 24.A NE2 TRP 132.A O no hydrogen 2.914 N/A LEU 25.A N LEU 18.A O no hydrogen 2.898 N/A CYS 26.A N LEU 18.A O no hydrogen 3.397 N/A CYS 26.A SG LEU 25.A O no hydrogen 3.012 N/A CYS 26.A SG SER 188.A O no hydrogen 3.481 N/A GLY 27.A N SER 188.A O no hydrogen 2.738 N/A GLY 28.A N VAL 16.A O no hydrogen 3.070 N/A THR 29.A N VAL 37.A O no hydrogen 2.728 N/A LEU 30.A N TRP 14.A O no hydrogen 2.983 N/A ILE 31.A N TRP 35.A O no hydrogen 2.988 N/A ILE 34.A N ASN 32.A OD1 no hydrogen 3.084 N/A TRP 35.A N ASN 32.A OD1 no hydrogen 3.004 N/A VAL 36.A N LEU 94.A O no hydrogen 2.925 N/A VAL 37.A N THR 29.A O no hydrogen 2.697 N/A SER 38.A N ALA 92.A O no hydrogen 2.834 N/A SER 38.A OG GLY 27.A O no hydrogen 2.725 N/A HIS 41.A N ASP 90.A OD1 no hydrogen 2.817 N/A HIS 41.A ND1 ASP 90.A OD2 no hydrogen 2.647 N/A HIS 41.A NE2 SER 188.A OG no hydrogen 2.840 N/A CYS 42.A N ALA 39.A O no hydrogen 3.194 N/A CYS 42.A SG SER 188.A O no hydrogen 3.778 N/A PHE 43.A N ALA 40.A O no hydrogen 3.067 N/A ASP 44.A N HIS 41.A O no hydrogen 3.256 N/A ILE 46.A N PHE 43.A O no hydrogen 3.328 N/A ARG 50.A N ASN 48.A OD1 no hydrogen 2.987 N/A ASN 51.A N ASN 48.A O no hydrogen 3.334 N/A ILE 53.A N LEU 19.A O no hydrogen 2.908 N/A ALA 54.A N ARG 71.A O no hydrogen 2.910 N/A VAL 55.A N LEU 17.A O no hydrogen 2.769 N/A LEU 56.A N GLN 69.A O no hydrogen 2.770 N/A HIS 59.A N GLU 58.A OE1 no hydrogen 2.867 N/A HIS 59.A NE2 GLU 144.A OE2 no hydrogen 3.163 N/A LEU 61.A N LEU 143.A O no hydrogen 2.767 N/A SER 62.A N ASP 60.A OD1 no hydrogen 2.806 N/A SER 62.A OG ASP 60.A OD1 no hydrogen 2.583 N/A GLU 63.A N ASP 60.A O no hydrogen 3.358 N/A ASP 65.A N GLU 68.A OE2 no hydrogen 3.000 N/A GLY 66.A N GLU 68.A OE1 no hydrogen 2.860 N/A ASP 67.A N ASP 65.A OD1 no hydrogen 3.100 N/A GLU 68.A N GLU 68.A OE1 no hydrogen 2.914 N/A GLN 69.A N LEU 56.A O no hydrogen 2.763 N/A GLN 69.A NE2 VAL 101.A O no hydrogen 2.864 N/A ARG 71.A N ALA 54.A O no hydrogen 2.913 N/A ARG 71.A NE GLN 98.A O no hydrogen 3.234 N/A ARG 71.A NE PRO 99.A O no hydrogen 3.016 N/A ARG 71.A NH1 SER 70.A O no hydrogen 2.870 N/A ARG 71.A NH2 PRO 99.A O no hydrogen 3.014 N/A ARG 72.A N HIS 97.A ND1.A no hydrogen 2.974 N/A ARG 72.A NH2.B ARG 50.A O no hydrogen 2.854 N/A VAL 73.A N LEU 52.A O no hydrogen 3.098 N/A ALA 74.A N ARG 95.A O no hydrogen 2.755 N/A GLN 75.A N ARG 95.A O no hydrogen 3.351 N/A GLN 75.A NE2 ARG 240.A O no hydrogen 3.154 N/A GLN 75.A NE2 VAL 243.A O no hydrogen 3.085 N/A VAL 76.A N VAL 243.A O no hydrogen 2.902 N/A ILE 77.A N LEU 93.A O no hydrogen 2.722 N/A ILE 78.A N LEU 245.A O no hydrogen 2.978 N/A SER 80.A N ALA 247.A O no hydrogen 2.871 N/A TYR 82.A N PRO 79.A O no hydrogen 3.113 N/A TYR 82.A OH ASP 44.A OD1 no hydrogen 2.600 N/A TYR 82.A OH ASP 44.A OD2 no hydrogen 2.938 N/A GLY 85.A N ASP 44.A OD2 no hydrogen 3.026 N/A THR 86.A N VAL 83.A O no hydrogen 3.026 N/A THR 86.A OG1 VAL 83.A O no hydrogen 2.409 N/A HIS 89.A ND1 TYR 227.A OH no hydrogen 2.572 N/A ILE 91.A N HIS 89.A O no hydrogen 2.965 N/A ALA 92.A N SER 38.A O no hydrogen 3.011 N/A LEU 93.A N ILE 77.A O no hydrogen 2.800 N/A LEU 94.A N VAL 36.A O no hydrogen 2.799 N/A ARG 95.A N GLN 75.A O no hydrogen 3.002 N/A ARG 95.A NH2.A SER 237.A O no hydrogen 3.306 N/A LEU 96.A N ILE 34.A O no hydrogen 2.832 N/A HIS 97.A N ARG 72.A O no hydrogen 2.858 N/A VAL 100.A N THR 33.A O no hydrogen 2.967 N/A VAL 101.A N GLN 69.A OE1 no hydrogen 2.787 N/A THR 103.A N VAL 106.A O no hydrogen 3.033 N/A HIS 105.A N THR 103.A OG1 no hydrogen 3.114 N/A VAL 106.A N THR 103.A O no hydrogen 3.145 N/A VAL 107.A N PRO 13.A O no hydrogen 3.162 N/A LEU 109.A N LEU 30.A O no hydrogen 2.756 N/A CYS 110.A N TRP 200.A O no hydrogen 3.394 N/A CYS 110.A SG TRP 200.A O no hydrogen 3.691 N/A ARG 114.A NE.A GLU 229.A OE1.B no hydrogen 2.971 N/A ARG 114.A NE.A GLU 229.A OE2.A no hydrogen 3.424 N/A ARG 114.A NE.B GLU 229.A OE2.A no hydrogen 2.900 N/A ARG 114.A NH1.A GLU 118.A OE2 no hydrogen 3.395 N/A ARG 114.A NH1.B GLU 118.A OE2 no hydrogen 3.477 N/A ARG 114.A NH2.A GLU 229.A OE1.B no hydrogen 2.944 N/A SER 117.A N GLU 113.A O no hydrogen 2.995 N/A GLU 118.A N ARG 114.A O.A no hydrogen 2.710 N/A GLU 118.A N ARG 114.A O.B no hydrogen 2.775 N/A ARG 119.A N THR 115.A O no hydrogen 2.721 N/A THR 120.A N PHE 116.A O no hydrogen 2.991 N/A LEU 121.A N PHE 116.A O no hydrogen 3.213 N/A ALA 122.A N SER 117.A O no hydrogen 2.976 N/A PHE 123.A N THR 120.A O no hydrogen 3.218 N/A VAL 124.A N LEU 121.A O no hydrogen 3.011 N/A SER 127.A N VAL 150.A O no hydrogen 3.089 N/A SER 127.A OG THR 194.A OG1 no hydrogen 2.538 N/A LEU 128.A N ALA 193.A O no hydrogen 2.903 N/A VAL 129.A N LEU 148.A O no hydrogen 2.839 N/A SER 130.A OG GLN 15.A OE1 no hydrogen 2.687 N/A GLY 131.A N MET 146.A O no hydrogen 2.915 N/A TRP 132.A NE1 HIS 59.A O no hydrogen 2.994 N/A GLY 133.A N ASP 187.A OD1 no hydrogen 2.765 N/A GLN 134.A N LYS 185.A O no hydrogen 2.831 N/A LEU 135.A N ALA 140.A O no hydrogen 2.978 N/A GLY 139.A N LEU 136.A O no hydrogen 2.869 N/A ALA 142.A N TRP 132.A O no hydrogen 3.275 N/A ALA 142.A N GLY 133.A O no hydrogen 3.119 N/A LEU 145.A N HIS 59.A O no hydrogen 3.126 N/A MET 146.A N GLY 131.A O no hydrogen 2.992 N/A VAL 147.A N LYS 5.A O no hydrogen 2.886 N/A LEU 148.A N VAL 129.A O no hydrogen 2.719 N/A ASN 149.A ND2 SER 127.A O no hydrogen 2.810 N/A VAL 150.A N SER 127.A O no hydrogen 2.863 N/A ARG 152.A N ARG 125.A O no hydrogen 2.863 N/A LEU 153.A N CYS 173.A O no hydrogen 3.120 N/A CYS 158.A N MET 154.A O no hydrogen 2.829 N/A LEU 159.A N THR 155.A O no hydrogen 2.966 N/A GLN 160.A N GLN 156.A O no hydrogen 2.942 N/A GLN 161.A N ASP 157.A O no hydrogen 2.797 N/A SER 162.A OG CYS 158.A O no hydrogen 2.913 N/A ARG 163.A N GLY 216.A O no hydrogen 2.846 N/A SER 164.A OG GLN 210.A OE1 no hydrogen 3.254 N/A THR 168.A OG1 ASN 88.A OD1 no hydrogen 2.636 N/A TYR 170.A N THR 168.A OG1 no hydrogen 3.041 N/A MET 171.A N THR 168.A O no hydrogen 3.212 N/A PHE 172.A N TYR 221.A O no hydrogen 2.813 N/A ALA 174.A N GLY 219.A O no hydrogen 2.864 N/A GLY 175.A N PRO 151.A O no hydrogen 2.867 N/A SER 180.A N ASP 178.A OD1 no hydrogen 3.075 N/A SER 180.A OG ASP 178.A OD1 no hydrogen 2.410 N/A SER 180.A OG ASP 178.A OD2 no hydrogen 3.202 N/A LYS 181.A NZ SER 180.A OG no hydrogen 3.007 N/A ASP 182.A N VAL 2.A O no hydrogen 3.026 N/A SER 183.A N ASP 182.A OD1 no hydrogen 2.828 N/A SER 183.A OG TYR 221.A OH no hydrogen 3.117 N/A CYS 184.A N ASP 187.A OD2 no hydrogen 2.823 N/A CYS 184.A SG GLN 134.A OE1 no hydrogen 3.336 N/A CYS 184.A SG LEU 136.A O no hydrogen 4.040 N/A ASP 187.A N CYS 184.A O no hydrogen 2.946 N/A SER 188.A OG HIS 41.A NE2 no hydrogen 2.840 N/A GLY 189.A N VAL 206.A O no hydrogen 2.940 N/A GLY 190.A N ASP 187.A O no hydrogen 3.073 N/A HIS 192.A N GLY 204.A O no hydrogen 2.912 N/A HIS 192.A ND1 THR 203.A OG1 no hydrogen 2.762 N/A ALA 193.A N LEU 128.A O no hydrogen 2.838 N/A THR 194.A N TYR 201.A O no hydrogen 2.833 N/A THR 194.A OG1 SER 127.A OG no hydrogen 2.538 N/A THR 194.A OG1 THR 203.A OG1 no hydrogen 2.582 N/A TYR 196.A N THR 199.A O no hydrogen 2.905 N/A ARG 197.A NE.A TYR 196.A OH no hydrogen 2.934 N/A ARG 197.A NH2.A TYR 196.A OH no hydrogen 3.059 N/A GLY 198.A N HIS 195.A NE2 no hydrogen 3.228 N/A THR 199.A N TYR 196.A O no hydrogen 3.285 N/A TYR 201.A N THR 194.A O no hydrogen 2.875 N/A LEU 202.A N CYS 110.A O no hydrogen 2.950 N/A THR 203.A N HIS 192.A O no hydrogen 3.058 N/A THR 203.A OG1 HIS 192.A ND1 no hydrogen 2.762 N/A THR 203.A OG1 HIS 192.A O no hydrogen 3.076 N/A THR 203.A OG1 THR 194.A OG1 no hydrogen 2.582 N/A GLY 204.A N HIS 192.A O no hydrogen 3.026 N/A ILE 205.A N THR 222.A O no hydrogen 3.364 N/A VAL 206.A N GLY 190.A O no hydrogen 2.954 N/A SER 207.A N VAL 220.A O no hydrogen 3.221 N/A SER 207.A OG ASP 90.A OD2 no hydrogen 2.512 N/A TRP 208.A N VAL 220.A O no hydrogen 3.151 N/A ALA 213.A N ASP 182.A OD2 no hydrogen 2.854 N/A THR 214.A OG1 GLN 210.A O no hydrogen 2.393 N/A GLY 216.A N SER 177.A O no hydrogen 2.619 N/A HIS 217.A N THR 214.A O no hydrogen 3.029 N/A VAL 220.A N TRP 208.A O no hydrogen 2.852 N/A TYR 221.A N PHE 172.A O no hydrogen 2.720 N/A THR 222.A N ILE 205.A O no hydrogen 3.038 N/A THR 222.A OG1 ASP 90.A O no hydrogen 2.716 N/A ARG 223.A N TYR 170.A O no hydrogen 2.918 N/A ARG 223.A NE MET 171.A O no hydrogen 3.034 N/A ARG 223.A NH2 MET 171.A O no hydrogen 2.844 N/A VAL 224.A N THR 203.A O no hydrogen 3.306 N/A GLN 226.A N ARG 223.A O no hydrogen 3.093 N/A GLN 226.A NE2 GLU 169.A O no hydrogen 2.946 N/A TYR 227.A N VAL 224.A O no hydrogen 2.836 N/A TYR 227.A OH HIS 89.A ND1 no hydrogen 2.572 N/A GLU 229.A N.B GLU 229.A OE1.B no hydrogen 2.751 N/A LEU 231.A N TYR 227.A O no hydrogen 2.891 N/A GLN 232.A N ILE 228.A O no hydrogen 2.874 N/A LYS 233.A N GLU 229.A O.A no hydrogen 2.989 N/A LYS 233.A N GLU 229.A O.B no hydrogen 2.991 N/A LEU 234.A N TRP 230.A O no hydrogen 3.279 N/A MET 235.A N LEU 231.A O no hydrogen 2.917 N/A ARG 236.A N LYS 233.A O no hydrogen 3.178 N/A SER 237.A N LEU 234.A O no hydrogen 2.949 N/A SER 237.A OG LEU 234.A O no hydrogen 2.661 N/A ARG 240.A N GLN 75.A OE1 no hydrogen 3.157 N/A LEU 245.A N VAL 76.A O no hydrogen 2.805 N/A ARG 246.A NH2 SER 80.A O no hydrogen 3.120 N/A ALA 247.A N ILE 78.A O no hydrogen 3.081 N/A PHE 249.A N SER 80.A OG no hydrogen 3.134 N/A