Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4q5k_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 3.A N GLY 1.A O no hydrogen 3.006 N/A SER 5.A N ASP 3.A OD2 no hydrogen 2.884 N/A SER 5.A OG.A GLY 1.A O no hydrogen 2.618 N/A SER 5.A OG.A ASP 3.A O no hydrogen 3.269 N/A SER 5.A OG.A ASP 3.A OD1 no hydrogen 2.652 N/A SER 5.A OG.B ASP 3.A OD1 no hydrogen 2.713 N/A SER 5.A OG.B ASP 3.A OD2 no hydrogen 3.058 N/A ASN 6.A N ASP 3.A O no hydrogen 2.973 N/A ASN 6.A ND2 THR 48.A OG1 no hydrogen 2.927 N/A ILE 8.A N LEU 4.A O no hydrogen 2.907 N/A LYS 9.A N SER 5.A O no hydrogen 3.186 N/A LYS 9.A NZ.A ASN 6.A OD1 no hydrogen 3.293 N/A LYS 9.A NZ.A GLU 47.A OE2 no hydrogen 2.984 N/A TYR 10.A N GLY 7.A O no hydrogen 2.932 N/A LEU 11.A N ILE 8.A O no hydrogen 3.049 N/A ASP 12.A N VAL 205.A O no hydrogen 2.932 N/A VAL 13.A N TYR 10.A O no hydrogen 2.969 N/A TYR 15.A N LYS 203.A O no hydrogen 2.939 N/A VAL 16.A N VAL 35.A O no hydrogen 2.940 N/A GLU 21.A N HIS 18.A O no hydrogen 3.083 N/A ASN 31.A N TYR 43.A OH no hydrogen 3.050 N/A ASN 31.A ND2 GLU 34.A OE1 no hydrogen 2.886 N/A CYS 32.A SG TYR 10.A OH no hydrogen 3.643 N/A ASP 33.A N ASN 31.A OD1 no hydrogen 3.284 N/A VAL 35.A N PRO 14.A O no hydrogen 3.007 N/A ASP 36.A N THR 39.A OG1 no hydrogen 3.061 N/A CYS 37.A SG HIS 183.A ND1 no hydrogen 3.439 N/A THR 38.A N ASP 36.A OD1 no hydrogen 2.981 N/A THR 39.A N ASP 36.A OD1 no hydrogen 2.942 N/A LEU 40.A N ASP 36.A O no hydrogen 2.990 N/A GLU 42.A N THR 38.A O no hydrogen 2.989 N/A TYR 43.A N THR 39.A O no hydrogen 2.894 N/A TYR 43.A OH ASN 31.A O no hydrogen 3.265 N/A VAL 44.A N LEU 40.A O no hydrogen 3.013 N/A LEU 45.A N VAL 41.A O no hydrogen 2.881 N/A ALA 46.A N GLU 42.A O no hydrogen 2.860 N/A GLU 47.A N TYR 43.A O no hydrogen 2.979 N/A THR 48.A N VAL 44.A O no hydrogen 2.982 N/A THR 48.A OG1 VAL 44.A O no hydrogen 2.750 N/A LEU 49.A N LEU 45.A O no hydrogen 2.927 N/A THR 50.A N GLU 47.A O no hydrogen 3.177 N/A THR 50.A OG1 ALA 46.A O no hydrogen 2.697 N/A LEU 53.A N ASP 57.A O no hydrogen 3.044 N/A GLY 56.A N LEU 53.A O no hydrogen 2.879 N/A SER 61.A OG SER 59.A OG no hydrogen 3.168 N/A ALA 62.A N SER 59.A OG no hydrogen 3.060 N/A PHE 63.A N SER 59.A O no hydrogen 2.996 N/A ALA 64.A N GLU 60.A O no hydrogen 3.032 N/A ASP 65.A N SER 61.A O no hydrogen 2.875 N/A ASN 66.A N ALA 62.A O no hydrogen 2.926 N/A ASN 66.A ND2 THR 50.A OG1 no hydrogen 2.947 N/A LEU 67.A N PHE 63.A O no hydrogen 2.838 N/A GLN 68.A N ALA 64.A O no hydrogen 2.914 N/A GLN 68.A NE2 GLY 75.A O no hydrogen 2.929 N/A LYS 69.A N ASP 65.A O no hydrogen 3.219 N/A LYS 69.A NZ.A ASN 66.A OD1 no hydrogen 2.828 N/A ILE 70.A N ASN 66.A O no hydrogen 3.166 N/A ILE 70.A N LEU 67.A O no hydrogen 3.137 N/A ARG 71.A N LEU 67.A O no hydrogen 2.914 N/A ARG 71.A NE GLU 42.A OE1 no hydrogen 2.770 N/A ARG 71.A NH1 VAL 29.A O no hydrogen 2.729 N/A ARG 71.A NH2 GLU 42.A OE1 no hydrogen 2.940 N/A TYR 72.A N GLN 68.A O no hydrogen 3.141 N/A TYR 72.A OH GLU 26.A OE2 no hydrogen 2.600 N/A ARG 73.A N SER 82.A O no hydrogen 3.023 N/A ARG 73.A NH1 THR 81.A O no hydrogen 3.012 N/A ARG 73.A NH2 ASP 89.A OD2 no hydrogen 2.779 N/A ASP 74.A N ASN 93.A OD1 no hydrogen 2.898 N/A GLY 75.A N TYR 72.A O no hydrogen 2.856 N/A LYS 76.A N ARG 73.A O no hydrogen 3.149 N/A ASP 78.A N SER 82.A OG no hydrogen 2.849 N/A SER 82.A N GLY 79.A O no hydrogen 3.049 N/A SER 82.A OG GLY 79.A O no hydrogen 2.691 N/A ARG 83.A N TYR 80.A O no hydrogen 3.223 N/A ARG 83.A NE GLU 26.A OE2 no hydrogen 2.950 N/A ARG 83.A NH1 GLU 21.A OE1 no hydrogen 3.281 N/A ARG 83.A NH1 GLU 21.A OE2 no hydrogen 2.869 N/A ARG 83.A NH2 GLU 21.A OE1 no hydrogen 2.880 N/A ARG 83.A NH2 GLU 26.A OE1 no hydrogen 2.906 N/A ARG 83.A NH2 GLU 26.A OE2 no hydrogen 3.351 N/A LEU 84.A N ARG 71.A O no hydrogen 2.871 N/A HIS 85.A N ARG 83.A O no hydrogen 2.899 N/A HIS 85.A NE2 TYR 80.A O no hydrogen 2.821 N/A TYR 86.A OH GLU 140.A OE2 no hydrogen 2.583 N/A ALA 88.A N ASP 180.A OD2 no hydrogen 2.804 N/A TRP 90.A N TYR 86.A O no hydrogen 2.974 N/A TRP 90.A NE1 GLU 42.A OE2 no hydrogen 2.901 N/A ILE 91.A N ILE 87.A O no hydrogen 2.777 N/A ASN 92.A N ALA 88.A O no hydrogen 3.053 N/A ASN 93.A N ASP 89.A O no hydrogen 2.916 N/A ASN 93.A ND2 LYS 69.A O no hydrogen 2.908 N/A ASN 93.A ND2 ILE 70.A O no hydrogen 3.696 N/A GLY 94.A N TRP 90.A O no hydrogen 3.125 N/A VAL 95.A N ILE 91.A O no hydrogen 2.898 N/A ARG 96.A N ASN 92.A O no hydrogen 2.836 N/A ARG 96.A NE ASP 74.A OD1 no hydrogen 2.974 N/A ARG 96.A NH2 ASP 74.A OD1 no hydrogen 2.916 N/A ASN 97.A N ASN 93.A O no hydrogen 2.985 N/A ASN 97.A ND2 ASP 74.A OD1 no hydrogen 2.933 N/A ASN 97.A ND2 ASN 93.A O no hydrogen 2.961 N/A GLY 98.A N VAL 95.A O no hydrogen 3.175 N/A PHE 99.A N GLY 94.A O no hydrogen 2.984 N/A LEU 100.A N GLY 94.A O no hydrogen 3.124 N/A GLN 101.A N ARG 228.A O no hydrogen 2.838 N/A VAL 103.A N VAL 226.A O no hydrogen 2.832 N/A THR 104.A N VAL 226.A O no hydrogen 3.233 N/A THR 104.A OG1 ASP 102.A OD1 no hydrogen 3.446 N/A THR 104.A OG1 VAL 226.A O no hydrogen 3.409 N/A GLY 105.A N ASP 102.A OD1 no hydrogen 2.843 N/A ALA 106.A N VAL 103.A O no hydrogen 2.908 N/A SER 107.A OG TYR 150.A O no hydrogen 2.637 N/A ASP 109.A N SER 107.A OG no hydrogen 3.183 N/A GLU 111.A N VAL 148.A O no hydrogen 2.905 N/A ARG 112.A NH1.B GLY 145.A O no hydrogen 2.654 N/A LEU 113.A N LYS 146.A O no hydrogen 2.804 N/A ILE 115.A N SER 144.A OG.A no hydrogen 2.911 N/A ILE 115.A N SER 144.A OG.B no hydrogen 3.147 N/A SER 116.A N GLY 178.A O no hydrogen 2.849 N/A TYR 117.A N GLY 178.A O no hydrogen 2.987 N/A SER 118.A OG SER 116.A O no hydrogen 3.503 N/A SER 118.A OG GLU 140.A OE1 no hydrogen 2.581 N/A SER 118.A OG GLU 140.A OE2 no hydrogen 3.485 N/A SER 119.A N SER 116.A O no hydrogen 3.070 N/A SER 119.A OG SER 116.A O no hydrogen 3.048 N/A HIS 120.A N TYR 117.A O no hydrogen 2.968 N/A LEU 123.A N HIS 120.A O no hydrogen 3.077 N/A TYR 124.A N PRO 121.A O no hydrogen 3.102 N/A LYS 125.A NZ GLU 21.A O no hydrogen 2.737 N/A LYS 125.A NZ ASP 23.A OD1 no hydrogen 2.840 N/A GLN 126.A N GLN 126.A OE1 no hydrogen 2.645 N/A GLN 126.A NE2 GLU 21.A OE1 no hydrogen 2.779 N/A LEU 127.A N TYR 124.A O no hydrogen 2.956 N/A ALA 128.A N TYR 124.A O no hydrogen 2.793 N/A SER 130.A N LEU 127.A O no hydrogen 3.209 N/A ASN 133.A N SER 130.A OG no hydrogen 3.067 N/A ASN 133.A ND2 GLN 126.A O no hydrogen 2.940 N/A VAL 134.A N SER 130.A O no hydrogen 3.095 N/A ALA 135.A N PRO 131.A O no hydrogen 2.974 N/A LYS 136.A N GLU 132.A O no hydrogen 3.005 N/A LYS 136.A NZ GLU 132.A OE2 no hydrogen 3.522 N/A LYS 138.A N ALA 135.A O no hydrogen 3.253 N/A ILE 139.A N LYS 136.A O no hydrogen 3.196 N/A GLN 141.A N LYS 137.A O no hydrogen 2.909 N/A SER 142.A N LYS 138.A O no hydrogen 3.033 N/A SER 142.A OG ILE 139.A O no hydrogen 2.707 N/A LEU 143.A N ILE 139.A O no hydrogen 3.037 N/A LEU 143.A N GLU 140.A O no hydrogen 3.162 N/A SER 144.A N GLU 140.A O no hydrogen 2.905 N/A SER 144.A OG.A GLU 140.A O no hydrogen 2.895 N/A SER 144.A OG.B LEU 113.A O no hydrogen 3.362 N/A GLY 145.A N LEU 113.A O no hydrogen 2.837 N/A VAL 148.A N GLU 111.A O no hydrogen 2.889 N/A HIS 149.A ND1 SER 107.A O no hydrogen 2.767 N/A TYR 150.A N ASP 109.A O no hydrogen 2.972 N/A LEU 151.A N ILE 224.A O no hydrogen 2.838 N/A LYS 153.A N THR 222.A O no hydrogen 2.917 N/A LYS 153.A NZ LEU 215.A O no hydrogen 2.800 N/A LYS 153.A NZ TRP 221.A O no hydrogen 2.767 N/A LYS 155.A N PRO 152.A O no hydrogen 2.942 N/A LYS 155.A NZ ASP 109.A OD1 no hydrogen 3.539 N/A LYS 155.A NZ ASP 109.A OD2 no hydrogen 2.727 N/A LEU 156.A N LYS 153.A O no hydrogen 3.066 N/A ASP 159.A N ASP 159.A OD1.B no hydrogen 2.617 N/A GLY 160.A N PRO 157.A O no hydrogen 2.948 N/A ILE 164.A N LEU 161.A O no hydrogen 2.962 N/A LYS 165.A N ASP 168.A OD2 no hydrogen 2.842 N/A GLY 167.A N ALA 186.A O no hydrogen 2.909 N/A ASP 168.A N LYS 165.A O no hydrogen 2.961 N/A ILE 169.A N LEU 227.A O no hydrogen 2.838 N/A ILE 170.A N GLY 184.A O no hydrogen 2.829 N/A ALA 171.A N ARG 225.A O no hydrogen 2.930 N/A ILE 172.A N HIS 183.A O no hydrogen 2.838 N/A THR 173.A N GLY 223.A O no hydrogen 2.942 N/A THR 173.A OG1 THR 222.A OG1 no hydrogen 2.749 N/A THR 174.A OG1 THR 176.A OG1 no hydrogen 3.200 N/A THR 174.A OG1 LYS 220.A O.A no hydrogen 3.031 N/A THR 174.A OG1 LYS 220.A O.B no hydrogen 3.055 N/A ASN 175.A N LYS 220.A O.A no hydrogen 2.832 N/A ASN 175.A N LYS 220.A O.B no hydrogen 2.825 N/A ASN 175.A ND2 ASN 219.A O no hydrogen 2.890 N/A THR 176.A N THR 174.A OG1 no hydrogen 3.044 N/A THR 176.A OG1 THR 174.A OG1 no hydrogen 3.200 N/A LEU 179.A N THR 176.A O no hydrogen 3.183 N/A ASP 180.A N ASP 180.A OD1 no hydrogen 2.710 N/A ALA 182.A N ILE 172.A O no hydrogen 2.895 N/A HIS 183.A NE2 HIS 197.A ND1 no hydrogen 2.832 N/A ILE 185.A N VAL 196.A O no hydrogen 2.841 N/A ALA 186.A N ASP 168.A O no hydrogen 2.827 N/A PHE 187.A N LEU 194.A O no hydrogen 3.066 N/A TYR 188.A N ASP 166.A OD1 no hydrogen 2.792 N/A TYR 188.A OH ILE 164.A O no hydrogen 2.793 N/A ALA 189.A N LYS 192.A O no hydrogen 2.937 N/A LYS 192.A N ALA 189.A O no hydrogen 2.972 N/A LYS 192.A NZ.B ASP 159.A OD1.A no hydrogen 2.664 N/A LYS 192.A NZ.B ASN 191.A O no hydrogen 3.076 N/A LEU 193.A N ALA 158.A O no hydrogen 2.941 N/A LEU 194.A N PHE 187.A O no hydrogen 2.736 N/A LEU 195.A N SER 208.A OG no hydrogen 2.979 N/A VAL 196.A N ILE 185.A O no hydrogen 2.843 N/A HIS 197.A N VAL 206.A O no hydrogen 2.978 N/A HIS 197.A ND1 HIS 183.A NE2 no hydrogen 2.832 N/A SER 199.A N LYS 204.A O no hydrogen 2.976 N/A THR 201.A OG1.B SER 199.A OG no hydrogen 2.978 N/A ASP 202.A N SER 199.A OG no hydrogen 3.003 N/A LYS 203.A NZ.A SER 200.A O no hydrogen 2.741 N/A LYS 204.A N SER 199.A O no hydrogen 3.293 N/A VAL 205.A N VAL 13.A O no hydrogen 2.914 N/A VAL 206.A N HIS 197.A O no hydrogen 2.935 N/A SER 208.A N LEU 195.A O no hydrogen 2.803 N/A SER 208.A OG LEU 195.A O no hydrogen 3.540 N/A SER 208.A OG VAL 210.A O no hydrogen 2.768 N/A LEU 212.A N LEU 193.A O no hydrogen 2.816 N/A GLN 214.A N PRO 211.A O no hydrogen 2.905 N/A GLN 214.A NE2.A ASP 217.A OD1 no hydrogen 2.816 N/A LYS 216.A N SER 213.A O no hydrogen 2.974 N/A ASP 217.A N GLN 214.A O no hydrogen 2.908 N/A ASN 218.A N LEU 215.A O no hydrogen 3.210 N/A LYS 220.A N.A ASN 218.A OD1 no hydrogen 2.914 N/A LYS 220.A N.B ASN 218.A OD1 no hydrogen 2.920 N/A TRP 221.A N ASN 218.A O no hydrogen 3.067 N/A THR 222.A N THR 173.A O no hydrogen 2.886 N/A THR 222.A OG1 THR 173.A OG1 no hydrogen 2.749 N/A ILE 224.A N LEU 151.A O no hydrogen 2.983 N/A ARG 225.A N ALA 171.A O no hydrogen 2.795 N/A ARG 225.A NH2 ASP 102.A OD2 no hydrogen 3.078 N/A VAL 226.A N THR 104.A OG1 no hydrogen 2.857 N/A LEU 227.A N ILE 169.A O no hydrogen 2.823 N/A ARG 228.A N GLN 101.A O no hydrogen 2.913 N/A ARG 228.A NE ASP 168.A OD1 no hydrogen 2.777 N/A ARG 228.A NH2 TRP 163.A O no hydrogen 2.903 N/A ARG 228.A NH2 ASP 168.A OD1 no hydrogen 3.454 N/A ARG 228.A NH2 ASP 168.A OD2 no hydrogen 2.849 N/A LYS 230.A NZ THR 48.A O no hydrogen 2.678 N/A