Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5quc_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 4.A N THR 23.A OG1 no hydrogen 2.887 N/A ARG 5.A NH2.A LEU 17.A O no hydrogen 2.424 N/A ARG 5.A NH2.A GLY 20.A O no hydrogen 3.015 N/A ILE 6.A N ILE 21.A O no hydrogen 2.853 N/A SER 7.A N GLY 55.A O no hydrogen 2.842 N/A SER 7.A OG ASP 14.A OD2 no hydrogen 2.574 N/A THR 8.A N ASP 14.A OD1 no hydrogen 2.805 N/A THR 8.A OG1 ASP 14.A OD1 no hydrogen 2.866 N/A GLY 9.A N SER 7.A OG no hydrogen 3.164 N/A SER 10.A N THR 8.A OG1 no hydrogen 3.255 N/A SER 10.A OG ASP 222.A OD1 no hydrogen 2.698 N/A SER 12.A N ASP 222.A OD1 no hydrogen 2.939 N/A LEU 13.A N SER 10.A OG no hydrogen 3.089 N/A ASP 14.A N SER 10.A O no hydrogen 2.832 N/A LYS 15.A N LYS 11.A O no hydrogen 2.908 N/A LEU 16.A N SER 12.A O no hydrogen 3.139 N/A LEU 17.A N LEU 13.A O no hydrogen 2.991 N/A GLY 18.A N LYS 15.A O no hydrogen 3.104 N/A GLY 19.A N ASP 14.A O no hydrogen 2.752 N/A ILE 21.A N ILE 6.A O no hydrogen 2.942 N/A THR 23.A N GLY 4.A O no hydrogen 2.853 N/A THR 23.A OG1 ASP 167.A OD1 no hydrogen 2.722 N/A GLN 24.A N ILE 168.A O no hydrogen 2.901 N/A GLN 24.A NE2 ALA 1.A O no hydrogen 3.012 N/A GLN 24.A NE2 ASP 167.A OD1 no hydrogen 2.972 N/A ILE 26.A N THR 189.A OG1 no hydrogen 2.976 N/A THR 27.A N VAL 170.A O no hydrogen 2.832 N/A GLU 28.A N LEU 190.A O no hydrogen 2.878 N/A VAL 29.A N.A VAL 172.A O no hydrogen 2.979 N/A VAL 29.A N.B VAL 172.A O no hydrogen 2.971 N/A PHE 30.A N VAL 192.A O no hydrogen 2.933 N/A GLY 31.A N ASN 174.A O no hydrogen 3.342 N/A PHE 33.A N GLN 177.A OE1 no hydrogen 2.746 N/A SER 35.A N GLU 32.A O no hydrogen 3.095 N/A SER 35.A OG GLU 32.A O no hydrogen 2.867 N/A LYS 37.A NZ GLY 31.A O no hydrogen 3.161 N/A THR 38.A OG1 ASP 131.A OD1 no hydrogen 3.321 N/A THR 38.A OG1 ASP 131.A OD2 no hydrogen 2.752 N/A LEU 40.A N GLY 36.A O no hydrogen 3.044 N/A ALA 41.A N LYS 37.A O no hydrogen 3.077 N/A HIS 42.A N THR 38.A O no hydrogen 2.900 N/A HIS 42.A ND1 THR 38.A O no hydrogen 2.815 N/A THR 43.A N GLN 39.A O no hydrogen 2.997 N/A THR 43.A OG1 GLN 39.A O no hydrogen 2.892 N/A LEU 44.A N LEU 40.A O no hydrogen 2.930 N/A ALA 45.A N ALA 41.A O no hydrogen 3.055 N/A VAL 46.A N THR 43.A O no hydrogen 3.040 N/A MET 47.A N THR 43.A O no hydrogen 2.872 N/A VAL 48.A N LEU 44.A O no hydrogen 3.029 N/A GLN 49.A N VAL 46.A O no hydrogen 2.938 N/A GLN 49.A NE2 ALA 45.A O no hydrogen 3.088 N/A GLN 49.A NE2 VAL 89.A O no hydrogen 2.996 N/A LEU 50.A N MET 47.A O no hydrogen 3.043 N/A GLU 54.A N PRO 51.A O no hydrogen 2.952 N/A GLY 55.A N PRO 52.A O no hydrogen 2.947 N/A GLY 56.A N PRO 51.A O no hydrogen 3.025 N/A LEU 57.A N VAL 48.A O no hydrogen 2.954 N/A ASN 58.A N LEU 50.A O no hydrogen 2.942 N/A GLY 59.A N VAL 48.A O no hydrogen 2.982 N/A SER 60.A N PRO 124.A O no hydrogen 2.773 N/A SER 60.A OG ARG 123.A O no hydrogen 2.661 N/A VAL 61.A N HIS 92.A O no hydrogen 2.860 N/A MET 62.A N LEU 127.A O no hydrogen 2.935 N/A TRP 63.A N ALA 94.A O no hydrogen 2.755 N/A ILE 64.A N ILE 129.A O no hydrogen 2.804 N/A ASP 65.A N ALA 96.A O no hydrogen 2.902 N/A THR 66.A N ASP 131.A O no hydrogen 2.877 N/A THR 66.A OG1 SER 132.A O no hydrogen 2.943 N/A THR 66.A OG1 SER 135.A OG.A no hydrogen 2.858 N/A GLU 67.A N ASP 65.A OD1 no hydrogen 3.053 N/A THR 69.A N ASP 65.A OD1 no hydrogen 3.143 N/A THR 69.A OG1 ASP 65.A OD1 no hydrogen 3.464 N/A PHE 70.A N ASP 65.A OD2 no hydrogen 2.925 N/A ARG 71.A N HIS 42.A NE2 no hydrogen 2.941 N/A ARG 71.A NH1 ASN 68.A O no hydrogen 2.828 N/A ARG 71.A NH1 PHE 70.A O no hydrogen 2.955 N/A ARG 71.A NH2 ASN 68.A O no hydrogen 3.290 N/A ARG 74.A N ARG 71.A O no hydrogen 2.942 N/A ARG 74.A NE GLN 39.A OE1 no hydrogen 2.781 N/A ARG 74.A NH1 GLN 39.A OE1 no hydrogen 2.919 N/A ARG 74.A NH1 THR 216.A O no hydrogen 3.016 N/A ARG 74.A NH1 GLY 219.A O no hydrogen 3.222 N/A ARG 74.A NH2 GLU 77.A OE1 no hydrogen 2.827 N/A ARG 74.A NH2 THR 216.A O no hydrogen 2.907 N/A ILE 75.A N ARG 71.A O no hydrogen 3.111 N/A ARG 76.A N PRO 72.A O no hydrogen 2.877 N/A ARG 76.A NH1 ASP 87.A OD1 no hydrogen 3.026 N/A ARG 76.A NH2 ASP 87.A OD1 no hydrogen 2.814 N/A GLU 77.A N GLU 73.A O no hydrogen 3.076 N/A ILE 78.A N ARG 74.A O no hydrogen 3.004 N/A ALA 79.A N ILE 75.A O no hydrogen 2.873 N/A GLN 80.A N.A ARG 76.A O no hydrogen 2.886 N/A GLN 80.A N.B ARG 76.A O no hydrogen 2.869 N/A ASN 81.A N GLU 77.A O no hydrogen 3.070 N/A ASN 81.A ND2 GLU 77.A O no hydrogen 2.914 N/A ASN 81.A ND2 GLU 217.A O no hydrogen 3.537 N/A ARG 82.A N ALA 79.A O no hydrogen 2.987 N/A ARG 82.A NE LYS 218.A O no hydrogen 2.994 N/A ARG 82.A NH2 GLY 9.A O no hydrogen 3.151 N/A ARG 82.A NH2 LYS 218.A O no hydrogen 3.172 N/A GLY 83.A N GLN 80.A O.B no hydrogen 3.255 N/A LEU 84.A N ALA 79.A O no hydrogen 3.012 N/A GLU 88.A N ASP 85.A OD2 no hydrogen 3.076 N/A VAL 89.A N ASP 85.A O no hydrogen 3.042 N/A LEU 90.A N PRO 86.A O no hydrogen 2.954 N/A LYS 91.A N ASP 87.A O no hydrogen 2.962 N/A HIS 92.A N GLU 88.A O no hydrogen 3.227 N/A HIS 92.A N VAL 89.A O no hydrogen 3.128 N/A HIS 92.A ND1 GLU 88.A O no hydrogen 2.777 N/A ILE 93.A N LEU 90.A O no hydrogen 3.111 N/A ALA 94.A N VAL 61.A O no hydrogen 2.855 N/A TYR 95.A OH ASP 65.A OD2 no hydrogen 2.545 N/A ALA 96.A N TRP 63.A O no hydrogen 3.000 N/A ALA 98.A N ASP 65.A O no hydrogen 2.831 N/A PHE 99.A N HIS 103.A ND1 no hydrogen 2.941 N/A SER 101.A N GLU 140.A OE1 no hydrogen 2.828 N/A SER 101.A OG GLU 140.A OE2 no hydrogen 2.677 N/A HIS 103.A N ASN 100.A OD1 no hydrogen 2.778 N/A GLN 104.A N ASN 100.A O no hydrogen 2.915 N/A GLN 104.A NE2 LEU 133.A O no hydrogen 2.997 N/A GLN 104.A NE2 HIS 155.A NE2 no hydrogen 2.994 N/A MET 105.A N SER 101.A O no hydrogen 3.017 N/A LEU 106.A N ASN 102.A O no hydrogen 3.128 N/A LEU 107.A N HIS 103.A O no hydrogen 2.879 N/A VAL 108.A N GLN 104.A O no hydrogen 3.386 N/A GLN 110.A N LEU 106.A O no hydrogen 2.932 N/A ALA 111.A N LEU 107.A O no hydrogen 2.816 N/A GLU 112.A N GLN 109.A O no hydrogen 3.193 N/A ASP 113.A N GLN 110.A O no hydrogen 2.985 N/A MET 114.A N.A ALA 111.A O no hydrogen 3.082 N/A ILE 115.A N ALA 111.A O no hydrogen 2.897 N/A LYS 116.A N GLU 112.A O no hydrogen 2.900 N/A GLU 117.A N ASP 113.A O no hydrogen 3.076 N/A LEU 118.A N MET 114.A O.A no hydrogen 3.076 N/A LEU 118.A N MET 114.A O.B no hydrogen 3.045 N/A LEU 119.A N LYS 116.A O no hydrogen 3.338 N/A THR 121.A N LEU 118.A O no hydrogen 3.071 N/A THR 121.A OG1 LEU 118.A O no hydrogen 2.766 N/A ARG 123.A N THR 121.A OG1 no hydrogen 3.205 N/A ARG 123.A NE ASN 58.A O no hydrogen 2.888 N/A ARG 123.A NH2 GLN 49.A OE1 no hydrogen 2.952 N/A ARG 123.A NH2 GLY 59.A O no hydrogen 2.878 N/A LYS 126.A N SER 60.A O no hydrogen 2.931 N/A LYS 126.A NZ ASP 167.A O no hydrogen 2.922 N/A LEU 128.A N ALA 169.A O no hydrogen 2.919 N/A ILE 129.A N MET 62.A O no hydrogen 2.869 N/A VAL 130.A N PHE 171.A O no hydrogen 2.979 N/A ASP 131.A N ILE 64.A O no hydrogen 2.959 N/A SER 132.A N THR 66.A OG1 no hydrogen 2.769 N/A LEU 133.A N THR 173.A O no hydrogen 2.969 N/A THR 134.A N SER 132.A OG no hydrogen 3.341 N/A THR 134.A OG1 ASN 174.A OD1 no hydrogen 2.667 N/A SER 135.A N.B SER 132.A OG no hydrogen 3.377 N/A SER 135.A OG.A THR 66.A OG1 no hydrogen 2.858 N/A SER 135.A OG.B GLU 67.A OE2 no hydrogen 3.380 N/A HIS 136.A NE2 ALA 98.A O no hydrogen 2.874 N/A ARG 138.A N THR 134.A O no hydrogen 2.890 N/A ARG 138.A NE HIS 182.A ND1.B no hydrogen 3.330 N/A ARG 138.A NH1 ASN 174.A OD1 no hydrogen 3.041 N/A SER 139.A N.A SER 135.A O.A no hydrogen 3.142 N/A SER 139.A N.A SER 135.A O.B no hydrogen 3.098 N/A SER 139.A N.B SER 135.A O.A no hydrogen 3.133 N/A SER 139.A N.B SER 135.A O.B no hydrogen 3.089 N/A SER 139.A OG.A SER 135.A O.A no hydrogen 3.446 N/A SER 139.A OG.A SER 135.A O.B no hydrogen 3.528 N/A SER 139.A OG.A HIS 136.A O no hydrogen 3.153 N/A GLU 140.A N HIS 136.A O no hydrogen 2.931 N/A TYR 141.A N PHE 137.A O no hydrogen 3.138 N/A ALA 144.A N TYR 141.A O no hydrogen 2.866 N/A ARG 148.A N ALA 144.A O no hydrogen 3.049 N/A ARG 148.A NE GLN 149.A OE1 no hydrogen 2.948 N/A ARG 148.A NH1 GLN 149.A OE1 no hydrogen 3.273 N/A GLN 149.A N LEU 145.A O no hydrogen 2.913 N/A GLN 150.A N ALA 146.A O no hydrogen 3.209 N/A LYS 151.A N GLU 147.A O no hydrogen 3.191 N/A LYS 151.A NZ GLU 147.A OE2 no hydrogen 2.944 N/A LEU 152.A N ARG 148.A O no hydrogen 2.961 N/A ALA 153.A N GLN 149.A O no hydrogen 2.930 N/A LYS 154.A N GLN 150.A O no hydrogen 3.241 N/A LYS 154.A NZ ASP 158.A OD1 no hydrogen 3.331 N/A HIS 155.A N LYS 151.A O no hydrogen 2.991 N/A LEU 156.A N LEU 152.A O no hydrogen 2.828 N/A ALA 157.A N ALA 153.A O no hydrogen 2.973 N/A ASP 158.A N LYS 154.A O no hydrogen 2.919 N/A LEU 159.A N HIS 155.A O no hydrogen 3.103 N/A HIS 160.A N.A LEU 156.A O no hydrogen 2.885 N/A HIS 160.A N.B LEU 156.A O no hydrogen 2.867 N/A HIS 160.A ND1.A LEU 156.A O no hydrogen 2.976 N/A ARG 161.A N.A ALA 157.A O no hydrogen 2.945 N/A ARG 161.A N.B ALA 157.A O no hydrogen 2.974 N/A ARG 161.A NH1.A GLU 112.A OE2 no hydrogen 3.384 N/A ARG 161.A NH1.B GLU 112.A OE1 no hydrogen 3.494 N/A ARG 161.A NH1.B GLU 112.A OE2 no hydrogen 2.678 N/A ARG 161.A NH2.A GLU 112.A OE1 no hydrogen 2.800 N/A ARG 161.A NH2.B GLU 112.A OE1 no hydrogen 2.835 N/A ARG 161.A NH2.B GLU 112.A OE2 no hydrogen 3.128 N/A LEU 162.A N ASP 158.A O no hydrogen 3.125 N/A ALA 163.A N LEU 159.A O no hydrogen 2.982 N/A ASN 164.A N HIS 160.A O.A no hydrogen 3.009 N/A ASN 164.A N HIS 160.A O.B no hydrogen 3.182 N/A ASN 164.A ND2 GLN 24.A O no hydrogen 3.500 N/A LEU 165.A N ARG 161.A O.A no hydrogen 2.925 N/A LEU 165.A N ARG 161.A O.B no hydrogen 2.756 N/A TYR 166.A N LEU 162.A O no hydrogen 3.050 N/A TYR 166.A OH GLU 112.A OE2 no hydrogen 2.559 N/A ILE 168.A N ALA 163.A O no hydrogen 3.109 N/A ALA 169.A N LYS 126.A O no hydrogen 2.902 N/A VAL 170.A N ALA 25.A O no hydrogen 2.995 N/A PHE 171.A N LEU 128.A O no hydrogen 2.849 N/A VAL 172.A N THR 27.A O no hydrogen 2.929 N/A THR 173.A N VAL 130.A O no hydrogen 3.126 N/A THR 173.A OG1 ASP 131.A OD1 no hydrogen 2.718 N/A ASN 174.A N VAL 29.A O.A no hydrogen 3.018 N/A ASN 174.A N VAL 29.A O.B no hydrogen 2.998 N/A ASN 174.A ND2 GLU 28.A OE1 no hydrogen 3.061 N/A ASN 174.A ND2 HIS 182.A O.B no hydrogen 2.734 N/A VAL 176.A N GLY 31.A O no hydrogen 2.971 N/A GLN 177.A N GLY 180.A O.B no hydrogen 2.712 N/A GLN 177.A NE2 ASN 179.A OD1.B no hydrogen 2.942 N/A GLY 180.A N.A GLN 177.A O no hydrogen 2.639 N/A GLY 180.A N.B GLN 177.A O no hydrogen 3.168 N/A LEU 184.A N.A GLU 28.A OE1 no hydrogen 3.195 N/A LEU 184.A N.B GLU 28.A OE1 no hydrogen 3.214 N/A ALA 185.A N HIS 182.A O.A no hydrogen 2.683 N/A ALA 185.A N ILE 183.A O.B no hydrogen 2.759 N/A SER 187.A N LEU 184.A O.A no hydrogen 3.212 N/A SER 187.A N LEU 184.A O.B no hydrogen 3.162 N/A THR 189.A N ILE 26.A O no hydrogen 2.837 N/A LEU 190.A N ILE 26.A O no hydrogen 3.120 N/A ARG 191.A NE ASP 208.A OD2 no hydrogen 2.223 N/A ARG 191.A NH2 ALA 188.A O no hydrogen 3.143 N/A VAL 192.A N GLU 28.A O no hydrogen 2.802 N/A TYR 193.A N ARG 205.A O no hydrogen 2.854 N/A LEU 194.A N PHE 30.A O no hydrogen 2.910 N/A ARG 195.A N ILE 203.A O no hydrogen 3.033 N/A ARG 195.A NH1 GLU 210.A OE1 no hydrogen 3.255 N/A ARG 195.A NH1 GLU 210.A OE2 no hydrogen 3.249 N/A ARG 195.A NH2 GLU 210.A OE2 no hydrogen 2.839 N/A GLY 197.A N LYS 201.A O no hydrogen 2.665 N/A LYS 201.A N LYS 198.A O no hydrogen 3.372 N/A ARG 202.A N PHE 213.A O no hydrogen 2.837 N/A ARG 202.A NE SER 35.A O no hydrogen 2.973 N/A ILE 203.A N ARG 195.A O no hydrogen 2.909 N/A ALA 204.A N ALA 211.A O no hydrogen 2.857 N/A ARG 205.A N TYR 193.A O no hydrogen 2.971 N/A ILE 207.A N ARG 191.A O no hydrogen 3.014 N/A ALA 211.A N ALA 204.A O no hydrogen 2.998 N/A VAL 212.A N SER 12.A OG no hydrogen 3.124 N/A PHE 213.A N ARG 202.A O no hydrogen 2.947 N/A SER 214.A N GLU 221.A O no hydrogen 2.829 N/A THR 216.A N GLY 219.A O no hydrogen 2.971 N/A THR 216.A OG1 GLU 221.A OE1 no hydrogen 2.536 N/A GLU 217.A N GLU 217.A OE2 no hydrogen 2.666 N/A LYS 218.A N THR 216.A OG1 no hydrogen 3.084 N/A LYS 218.A NZ ASN 81.A O no hydrogen 3.139 N/A GLY 219.A N THR 216.A O no hydrogen 2.984 N/A GLU 221.A N SER 214.A O no hydrogen 3.013 N/A