Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6q4i_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 5.A N ARG 22.A O no hydrogen 2.858 N/A VAL 7.A N LYS 20.A O no hydrogen 2.895 N/A LYS 9.A NZ GLU 12.A OE1 no hydrogen 3.018 N/A ILE 10.A N VAL 18.A O no hydrogen 2.797 N/A GLY 11.A N VAL 18.A O no hydrogen 3.220 N/A GLY 13.A N GLY 16.A O no hydrogen 2.791 N/A GLY 16.A N GLY 13.A O no hydrogen 3.412 N/A VAL 18.A N GLY 11.A O no hydrogen 2.869 N/A TYR 19.A N LEU 32.A O no hydrogen 2.835 N/A LYS 20.A N GLU 8.A O no hydrogen 2.869 N/A ALA 21.A N VAL 30.A O no hydrogen 2.901 N/A ARG 22.A N GLN 5.A O no hydrogen 2.816 N/A ARG 22.A NH1 GLY 27.A O no hydrogen 2.857 N/A ASN 23.A N GLU 28.A O no hydrogen 2.823 N/A LYS 24.A N ASN 3.A O no hydrogen 3.004 N/A THR 26.A N ASN 23.A OD1 no hydrogen 2.969 N/A GLY 27.A N ASN 23.A O no hydrogen 2.816 N/A GLU 28.A N THR 26.A OG1 no hydrogen 3.163 N/A VAL 29.A N GLU 28.A OE1 no hydrogen 2.825 N/A VAL 30.A N ALA 21.A O no hydrogen 2.817 N/A ALA 31.A N PHE 73.A O no hydrogen 2.854 N/A LEU 32.A N TYR 19.A O no hydrogen 2.865 N/A LYS 33.A N LEU 71.A O no hydrogen 2.787 N/A LYS 33.A NZ ASP 138.A OD1 no hydrogen 2.856 N/A LYS 33.A NZ ASP 138.A OD2 no hydrogen 3.352 N/A LYS 34.A N VAL 17.A O.A no hydrogen 2.998 N/A LYS 34.A N VAL 17.A O.B no hydrogen 2.964 N/A ILE 35.A N LEU 69.A O no hydrogen 2.916 N/A ARG 36.A N TYR 15.A O no hydrogen 2.794 N/A ARG 36.A NH1 GLU 12.A OE2 no hydrogen 2.929 N/A ARG 36.A NH2 TYR 149.A O no hydrogen 2.844 N/A THR 40.A OG1 GLU 44.A OE2 no hydrogen 3.310 N/A GLU 44.A N THR 40.A O no hydrogen 3.199 N/A ILE 45.A N ALA 41.A O no hydrogen 2.781 N/A SER 46.A N ILE 42.A O no hydrogen 2.818 N/A SER 46.A OG ILE 42.A O no hydrogen 2.481 N/A LEU 47.A N ARG 43.A O no hydrogen 3.053 N/A LEU 47.A N GLU 44.A O no hydrogen 3.093 N/A LEU 48.A N ILE 45.A O no hydrogen 2.749 N/A LYS 49.A N SER 46.A O no hydrogen 2.951 N/A GLU 50.A N LEU 47.A O no hydrogen 2.981 N/A LEU 51.A N LEU 48.A O no hydrogen 2.963 N/A ASN 52.A ND2 LYS 49.A O no hydrogen 3.324 N/A HIS 53.A NE2 ASN 55.A OD1 no hydrogen 3.255 N/A ASN 55.A ND2 GLN 103.A OE1 no hydrogen 3.059 N/A ASN 55.A ND2 ILE 134.A O no hydrogen 2.857 N/A ILE 56.A N HIS 53.A O no hydrogen 3.076 N/A VAL 57.A N LEU 136.A O no hydrogen 2.925 N/A LYS 58.A N GLU 74.A OE2 no hydrogen 2.874 N/A LEU 60.A N VAL 72.A O no hydrogen 2.690 N/A ASP 61.A N VAL 72.A O no hydrogen 3.248 N/A VAL 62.A N ASP 61.A OD1 no hydrogen 2.958 N/A ILE 63.A N TYR 70.A O no hydrogen 2.925 N/A THR 65.A N LYS 68.A O no hydrogen 3.086 N/A LYS 68.A N THR 65.A O no hydrogen 2.905 N/A TYR 70.A N ILE 63.A O no hydrogen 2.874 N/A LEU 71.A N LYS 33.A O no hydrogen 2.833 N/A VAL 72.A N ASP 61.A O no hydrogen 2.908 N/A PHE 73.A N ALA 31.A O no hydrogen 2.818 N/A GLU 74.A N LYS 58.A O no hydrogen 2.916 N/A LEU 80.A N LEU 126.A O no hydrogen 2.821 N/A LYS 81.A NZ ASP 85.A OD2 no hydrogen 3.247 N/A LYS 82.A N ASP 79.A OD1 no hydrogen 2.820 N/A LYS 82.A NZ ASP 79.A OD2 no hydrogen 3.402 N/A PHE 83.A N ASP 79.A O no hydrogen 2.998 N/A MET 84.A N LEU 80.A O no hydrogen 2.829 N/A ASP 85.A N LYS 81.A O no hydrogen 3.023 N/A ALA 86.A N LYS 82.A O no hydrogen 2.864 N/A SER 87.A N MET 84.A O no hydrogen 3.162 N/A SER 87.A OG PHE 83.A O no hydrogen 2.778 N/A ALA 88.A N ASP 85.A O no hydrogen 3.368 N/A THR 90.A OG1 SER 87.A O no hydrogen 3.308 N/A THR 90.A OG1 GLY 91.A O no hydrogen 3.109 N/A GLY 91.A N SER 87.A O no hydrogen 2.612 N/A ILE 97.A N PRO 93.A O no hydrogen 2.972 N/A LYS 98.A N LEU 94.A O no hydrogen 2.912 N/A LYS 98.A NZ PHE 275.A O no hydrogen 2.854 N/A LYS 98.A NZ ASP 278.A OD1 no hydrogen 2.627 N/A SER 99.A N PRO 95.A O no hydrogen 2.996 N/A TYR 100.A N LEU 96.A O no hydrogen 2.830 N/A LEU 101.A N ILE 97.A O no hydrogen 2.879 N/A PHE 102.A N LYS 98.A O no hydrogen 2.910 N/A GLN 103.A N SER 99.A O no hydrogen 2.942 N/A GLN 103.A NE2 SER 99.A O no hydrogen 3.477 N/A GLN 103.A NE2 SER 99.A OG no hydrogen 3.024 N/A GLN 103.A NE2 GLY 132.A O no hydrogen 2.946 N/A LEU 104.A N TYR 100.A O no hydrogen 2.930 N/A LEU 105.A N LEU 101.A O no hydrogen 2.902 N/A GLN 106.A N PHE 102.A O no hydrogen 2.953 N/A GLN 106.A NE2 PHE 102.A O no hydrogen 3.618 N/A GLY 107.A N GLN 103.A O no hydrogen 2.950 N/A LEU 108.A N.A LEU 104.A O no hydrogen 2.901 N/A LEU 108.A N.B LEU 104.A O no hydrogen 2.883 N/A ALA 109.A N LEU 105.A O no hydrogen 2.812 N/A PHE 110.A N GLN 106.A O no hydrogen 3.030 N/A CYS 111.A N GLY 107.A O no hydrogen 2.994 N/A CYS 111.A SG GLY 107.A O no hydrogen 3.553 N/A HIS 112.A N LEU 108.A O.A no hydrogen 2.821 N/A HIS 112.A N LEU 108.A O.B no hydrogen 2.822 N/A HIS 112.A ND1 VAL 116.A O no hydrogen 3.390 N/A SER 113.A N ALA 109.A O no hydrogen 2.960 N/A SER 113.A OG ALA 109.A O no hydrogen 3.499 N/A SER 113.A OG PHE 110.A O no hydrogen 2.772 N/A SER 113.A OG HIS 114.A ND1 no hydrogen 3.363 N/A HIS 114.A N PHE 110.A O no hydrogen 3.238 N/A HIS 114.A N CYS 111.A O no hydrogen 2.979 N/A HIS 114.A ND1 PHE 110.A O no hydrogen 3.064 N/A ARG 115.A N HIS 112.A O no hydrogen 2.939 N/A VAL 116.A N CYS 111.A O no hydrogen 2.953 N/A HIS 118.A N ASP 175.A OD2 no hydrogen 2.851 N/A ARG 119.A N.A ASP 175.A OD1 no hydrogen 2.827 N/A ARG 119.A N.B ASP 175.A OD1 no hydrogen 2.794 N/A LYS 122.A N ASN 125.A OD1 no hydrogen 3.002 N/A LYS 122.A NZ THR 14.A OG1 no hydrogen 2.825 N/A LYS 122.A NZ ASP 120.A OD2 no hydrogen 2.877 N/A GLN 124.A N.B GLN 124.A OE1.B no hydrogen 2.852 N/A ASN 125.A N LYS 122.A O no hydrogen 2.930 N/A ASN 125.A ND2 ASP 120.A O no hydrogen 2.962 N/A LEU 126.A N PRO 123.A O no hydrogen 3.173 N/A LEU 127.A N LYS 135.A O no hydrogen 2.883 N/A ILE 128.A N GLN 78.A O no hydrogen 2.849 N/A ASN 129.A N ALA 133.A O no hydrogen 3.263 N/A GLU 131.A N ASN 129.A OD1 no hydrogen 3.063 N/A GLY 132.A N ASN 129.A O no hydrogen 3.530 N/A ALA 133.A N ASN 129.A OD1 no hydrogen 3.090 N/A ILE 134.A N GLN 103.A OE1 no hydrogen 3.153 N/A LYS 135.A N LEU 127.A O no hydrogen 2.795 N/A LYS 135.A NZ GLU 74.A OE1 no hydrogen 3.092 N/A LYS 135.A NZ GLU 74.A OE2 no hydrogen 2.862 N/A LEU 136.A N ASN 55.A O no hydrogen 2.847 N/A ALA 137.A N ASN 125.A O no hydrogen 2.845 N/A GLY 140.A N LEU 117.A O no hydrogen 2.981 N/A LEU 141.A N ASP 138.A O no hydrogen 3.375 N/A ALA 144.A N GLY 140.A O no hydrogen 3.379 N/A PHE 145.A N LEU 141.A O no hydrogen 2.828 N/A LEU 146.A N ALA 142.A O no hydrogen 2.745 N/A TYR 149.A OH PHE 145.A O no hydrogen 2.619 N/A GLU 152.A N THR 150.A OG1 no hydrogen 2.844 N/A TYR 158.A OH GLU 185.A OE1 no hydrogen 2.612 N/A ARG 159.A N LEU 156.A O no hydrogen 3.083 N/A ARG 159.A NH1 ASP 120.A OD1 no hydrogen 2.853 N/A GLU 162.A N GLU 162.A OE1 no hydrogen 2.684 N/A ILE 163.A N.A ALA 160.A O no hydrogen 3.012 N/A ILE 163.A N.B ALA 160.A O no hydrogen 3.051 N/A LEU 164.A N ALA 160.A O no hydrogen 3.198 N/A LEU 165.A N PRO 161.A O no hydrogen 2.844 N/A GLY 166.A N ILE 163.A O.A no hydrogen 3.039 N/A GLY 166.A N ILE 163.A O.B no hydrogen 2.930 N/A CYS 167.A N.A GLU 162.A O no hydrogen 3.033 N/A CYS 167.A N.B GLU 162.A O no hydrogen 3.002 N/A CYS 167.A SG.A TYR 169.A OH no hydrogen 3.357 N/A CYS 167.A SG.B TYR 169.A O no hydrogen 3.828 N/A ALA 173.A N SER 171.A OG no hydrogen 3.186 N/A VAL 174.A N SER 171.A O no hydrogen 3.002 N/A ASP 175.A N THR 172.A O no hydrogen 3.087 N/A TRP 177.A N ALA 173.A O no hydrogen 3.054 N/A SER 178.A N VAL 174.A O no hydrogen 3.203 N/A SER 178.A OG TYR 158.A O no hydrogen 2.710 N/A SER 178.A OG VAL 174.A O no hydrogen 3.107 N/A LEU 179.A N.A ASP 175.A O no hydrogen 2.964 N/A LEU 179.A N.B ASP 175.A O no hydrogen 2.959 N/A GLY 180.A N ILE 176.A O no hydrogen 2.861 N/A CYS 181.A N TRP 177.A O no hydrogen 3.008 N/A CYS 181.A SG TRP 177.A O no hydrogen 3.555 N/A ILE 182.A N SER 178.A O no hydrogen 3.016 N/A PHE 183.A N LEU 179.A O.A no hydrogen 2.847 N/A PHE 183.A N LEU 179.A O.B no hydrogen 2.819 N/A ALA 184.A N GLY 180.A O no hydrogen 3.001 N/A GLU 185.A N CYS 181.A O no hydrogen 3.102 N/A MET 186.A N ILE 182.A O no hydrogen 2.915 N/A VAL 187.A N PHE 183.A O no hydrogen 3.126 N/A THR 188.A N ALA 184.A O no hydrogen 2.958 N/A THR 188.A OG1 ALA 184.A O no hydrogen 3.000 N/A ARG 189.A N GLU 185.A O no hydrogen 2.882 N/A ARG 189.A NH1 ALA 88.A O no hydrogen 3.337 N/A ARG 190.A N THR 188.A OG1 no hydrogen 3.356 N/A GLY 195.A N PHE 193.A O no hydrogen 2.954 N/A GLY 195.A N GLN 201.A OE1 no hydrogen 2.852 N/A ASP 196.A N ASP 200.A OD2 no hydrogen 3.155 N/A ASP 200.A N SER 197.A OG no hydrogen 3.111 N/A GLN 201.A N SER 197.A O no hydrogen 2.851 N/A GLN 201.A NE2 TRP 157.A O no hydrogen 3.283 N/A GLN 201.A NE2 PHE 193.A O no hydrogen 2.872 N/A LEU 202.A N.A GLU 198.A O no hydrogen 3.011 N/A LEU 202.A N.B GLU 198.A O no hydrogen 2.988 N/A PHE 203.A N ILE 199.A O no hydrogen 2.916 N/A ARG 204.A N ASP 200.A O no hydrogen 2.835 N/A ARG 204.A NE ASP 200.A OD2 no hydrogen 3.139 N/A ILE 205.A N GLN 201.A O no hydrogen 3.081 N/A PHE 206.A N LEU 202.A O.A no hydrogen 2.916 N/A PHE 206.A N LEU 202.A O.B no hydrogen 2.909 N/A ARG 207.A N PHE 203.A O no hydrogen 2.864 N/A THR 208.A N ARG 204.A O no hydrogen 3.331 N/A THR 208.A N ILE 205.A O no hydrogen 3.136 N/A THR 208.A OG1 ARG 204.A O no hydrogen 3.395 N/A LEU 209.A N ILE 205.A O no hydrogen 2.857 N/A THR 211.A N TRP 233.A O no hydrogen 2.924 N/A THR 211.A OG1 PRO 231.A O no hydrogen 2.720 N/A VAL 216.A N ASP 213.A OD1 no hydrogen 3.009 N/A TRP 217.A N ASP 213.A O no hydrogen 2.848 N/A GLY 219.A N GLU 214.A OE1 no hydrogen 2.757 N/A VAL 220.A N TRP 217.A O no hydrogen 2.969 N/A THR 221.A N GLU 214.A OE2 no hydrogen 2.957 N/A THR 221.A OG1 GLU 214.A OE2 no hydrogen 2.604 N/A SER 222.A N.A GLY 219.A O no hydrogen 3.210 N/A SER 222.A N.B GLY 219.A O no hydrogen 3.199 N/A SER 222.A OG.B GLY 219.A O no hydrogen 3.045 N/A MET 223.A N.A VAL 220.A O no hydrogen 3.183 N/A MET 223.A N.B VAL 220.A O no hydrogen 2.998 N/A ASP 225.A N LEU 165.A O no hydrogen 2.818 N/A TYR 226.A N MET 223.A O.A no hydrogen 3.087 N/A TYR 226.A N MET 223.A O.B no hydrogen 3.235 N/A PHE 230.A N LYS 227.A O no hydrogen 2.977 N/A TRP 233.A N THR 211.A OG1 no hydrogen 2.883 N/A ARG 235.A NH1 LEU 209.A O no hydrogen 2.994 N/A GLN 236.A N THR 208.A O no hydrogen 2.786 N/A LYS 240.A N ASP 237.A O no hydrogen 2.861 N/A VAL 241.A N ASP 237.A O no hydrogen 3.356 N/A VAL 242.A N PHE 238.A O no hydrogen 2.911 N/A LEU 245.A N VAL 242.A O no hydrogen 2.941 N/A GLY 249.A N ASP 246.A OD1 no hydrogen 2.891 N/A ARG 250.A N ASP 246.A O no hydrogen 2.874 N/A ARG 250.A NH1 LEU 245.A O no hydrogen 2.861 N/A SER 251.A N GLU 247.A O.A no hydrogen 2.932 N/A SER 251.A N GLU 247.A O.B no hydrogen 2.991 N/A SER 251.A OG HIS 273.A NE2 no hydrogen 3.335 N/A LEU 252.A N ASP 248.A O no hydrogen 3.016 N/A LEU 253.A N GLY 249.A O no hydrogen 2.862 N/A SER 254.A N ARG 250.A O no hydrogen 2.928 N/A SER 254.A OG ARG 250.A O no hydrogen 3.527 N/A SER 254.A OG SER 251.A O no hydrogen 2.693 N/A GLN 255.A N SER 251.A O no hydrogen 3.160 N/A MET 256.A N LEU 252.A O no hydrogen 3.052 N/A LEU 257.A N SER 254.A O no hydrogen 3.336 N/A HIS 258.A ND1 LYS 263.A O.A no hydrogen 3.301 N/A HIS 258.A ND1 LYS 263.A O.B no hydrogen 3.233 N/A TYR 259.A OH GLY 210.A O no hydrogen 2.615 N/A ASN 262.A N ASP 260.A OD1 no hydrogen 2.989 N/A LYS 263.A N.A ASP 260.A O no hydrogen 2.886 N/A LYS 263.A N.B ASP 260.A O no hydrogen 2.881 N/A LYS 263.A NZ.A VAL 216.A O no hydrogen 2.910 N/A LYS 263.A NZ.A ASP 260.A OD2 no hydrogen 3.115 N/A ARG 264.A N PRO 261.A O no hydrogen 3.105 N/A ARG 264.A NE HIS 258.A O no hydrogen 2.763 N/A ARG 264.A NH1 GLU 162.A OE1 no hydrogen 3.355 N/A ARG 264.A NH1 GLU 162.A OE2 no hydrogen 2.716 N/A ARG 264.A NH1 ALA 173.A O no hydrogen 2.999 N/A ARG 264.A NH2 GLU 162.A OE1 no hydrogen 2.544 N/A ARG 264.A NH2 TYR 259.A O no hydrogen 3.055 N/A ILE 265.A N GLN 255.A O no hydrogen 2.980 N/A ALA 269.A N SER 266.A OG no hydrogen 2.971 N/A ALA 270.A N SER 266.A O no hydrogen 2.878 N/A LEU 271.A N ALA 267.A O no hydrogen 3.074 N/A ALA 272.A N ALA 269.A O no hydrogen 3.045 N/A HIS 273.A N ALA 270.A O no hydrogen 3.000 N/A HIS 273.A NE2 SER 251.A OG no hydrogen 3.335 N/A PHE 275.A N HIS 273.A ND1 no hydrogen 2.933 N/A PHE 276.A N HIS 273.A O no hydrogen 2.961 N/A GLN 277.A N PRO 274.A O no hydrogen 3.032 N/A VAL 279.A N PHE 276.A O no hydrogen 3.108 N/A