Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2r3q_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N GLU 2.A OE1 no hydrogen 3.508 N/A GLU 2.A N GLU 2.A OE1 no hydrogen 2.842 N/A PHE 4.A N MET 1.A O no hydrogen 2.951 N/A GLN 5.A N ARG 22.A O no hydrogen 2.861 N/A VAL 7.A N LYS 20.A O no hydrogen 2.715 N/A GLU 8.A N LYS 20.A O no hydrogen 3.280 N/A ILE 10.A N VAL 18.A O no hydrogen 2.800 N/A GLY 13.A N GLY 16.A O no hydrogen 2.839 N/A TYR 15.A OH GLY 144.A O no hydrogen 2.627 N/A VAL 18.A N GLY 11.A O no hydrogen 3.009 N/A TYR 19.A N LEU 32.A O no hydrogen 2.887 N/A LYS 20.A N GLU 8.A O no hydrogen 2.783 N/A ALA 21.A N VAL 30.A O no hydrogen 2.900 N/A ARG 22.A N GLN 5.A O no hydrogen 2.754 N/A ASN 23.A N GLU 28.A O no hydrogen 2.754 N/A LYS 24.A N ASN 3.A O no hydrogen 2.653 N/A LYS 24.A NZ GLU 2.A O no hydrogen 2.860 N/A LEU 25.A N ASN 23.A OD1 no hydrogen 2.526 N/A THR 26.A N ASN 23.A OD1 no hydrogen 2.944 N/A GLY 27.A N ASN 23.A O no hydrogen 3.026 N/A GLU 28.A N THR 26.A OG1 no hydrogen 3.313 N/A VAL 30.A N ALA 21.A O no hydrogen 2.829 N/A ALA 31.A N PHE 71.A O no hydrogen 2.889 N/A LEU 32.A N TYR 19.A O no hydrogen 2.762 N/A LYS 33.A N LEU 69.A O no hydrogen 2.821 N/A LYS 33.A NZ ASP 136.A OD1 no hydrogen 2.722 N/A LYS 33.A NZ ASP 136.A OD2 no hydrogen 3.351 N/A LYS 34.A N VAL 17.A O no hydrogen 3.165 N/A ILE 35.A N LEU 67.A O no hydrogen 2.877 N/A ARG 36.A N TYR 15.A O no hydrogen 2.839 N/A THR 38.A N SER 37.A O no hydrogen 2.250 N/A ARG 41.A N SER 37.A O no hydrogen 3.058 N/A GLU 42.A N THR 38.A O no hydrogen 3.116 N/A ILE 43.A N ALA 39.A O no hydrogen 2.956 N/A SER 44.A N ILE 40.A O no hydrogen 2.866 N/A SER 44.A OG ILE 40.A O no hydrogen 3.247 N/A SER 44.A OG ARG 41.A O no hydrogen 2.601 N/A LEU 45.A N ARG 41.A O no hydrogen 3.078 N/A LEU 46.A N GLU 42.A O no hydrogen 3.341 N/A LEU 46.A N ILE 43.A O no hydrogen 2.946 N/A LYS 47.A N SER 44.A O no hydrogen 3.173 N/A GLU 48.A N LEU 45.A O no hydrogen 3.135 N/A LEU 49.A N LEU 46.A O no hydrogen 3.100 N/A ASN 50.A N GLU 48.A O no hydrogen 2.947 N/A ASN 50.A ND2 LYS 47.A O no hydrogen 3.450 N/A HIS 51.A NE2 ASN 53.A OD1 no hydrogen 3.257 N/A ASN 53.A ND2 GLN 101.A OE1 no hydrogen 3.148 N/A ASN 53.A ND2 ILE 132.A O no hydrogen 2.900 N/A ILE 54.A N HIS 51.A O no hydrogen 3.029 N/A VAL 55.A N LEU 134.A O no hydrogen 2.907 N/A LYS 56.A N GLU 72.A OE1 no hydrogen 2.919 N/A LEU 58.A N VAL 70.A O no hydrogen 2.746 N/A ASP 59.A N VAL 70.A O no hydrogen 3.272 N/A ILE 61.A N TYR 68.A O no hydrogen 2.864 N/A HIS 62.A ND1 LYS 66.A O no hydrogen 2.823 N/A THR 63.A N LYS 66.A O no hydrogen 2.946 N/A LYS 66.A N THR 63.A O no hydrogen 2.681 N/A LYS 66.A NZ TYR 68.A OH no hydrogen 3.327 N/A TYR 68.A N ILE 61.A O no hydrogen 2.799 N/A LEU 69.A N LYS 33.A O no hydrogen 2.879 N/A VAL 70.A N ASP 59.A O no hydrogen 2.901 N/A PHE 71.A N ALA 31.A O no hydrogen 2.818 N/A GLU 72.A N LYS 56.A O no hydrogen 2.887 N/A LEU 78.A N LEU 124.A O no hydrogen 2.769 N/A LYS 79.A NZ ASP 83.A OD2 no hydrogen 3.495 N/A LYS 80.A N.A ASP 77.A OD1 no hydrogen 2.679 N/A LYS 80.A N.B ASP 77.A OD1 no hydrogen 2.669 N/A PHE 81.A N ASP 77.A O no hydrogen 3.124 N/A MET 82.A N LEU 78.A O no hydrogen 2.787 N/A ASP 83.A N LYS 79.A O no hydrogen 3.004 N/A ALA 84.A N LYS 80.A O.A no hydrogen 2.878 N/A ALA 84.A N LYS 80.A O.B no hydrogen 2.841 N/A SER 85.A N PHE 81.A O no hydrogen 2.887 N/A SER 85.A N MET 82.A O no hydrogen 3.160 N/A SER 85.A OG PHE 81.A O no hydrogen 2.774 N/A ALA 86.A N ASP 83.A O no hydrogen 3.243 N/A GLY 89.A N SER 85.A O no hydrogen 2.553 N/A LEU 94.A N PRO 91.A O no hydrogen 2.919 N/A ILE 95.A N PRO 91.A O no hydrogen 3.019 N/A LYS 96.A N LEU 92.A O no hydrogen 2.816 N/A LYS 96.A NZ PHE 275.A O no hydrogen 3.006 N/A LYS 96.A NZ ASP 278.A OD1 no hydrogen 2.744 N/A SER 97.A N PRO 93.A O no hydrogen 2.989 N/A TYR 98.A N LEU 94.A O no hydrogen 2.862 N/A LEU 99.A N ILE 95.A O no hydrogen 2.883 N/A PHE 100.A N LYS 96.A O no hydrogen 2.914 N/A GLN 101.A N SER 97.A O no hydrogen 2.942 N/A GLN 101.A NE2 SER 97.A O no hydrogen 3.472 N/A GLN 101.A NE2 SER 97.A OG no hydrogen 3.001 N/A GLN 101.A NE2 GLY 130.A O no hydrogen 2.961 N/A LEU 102.A N TYR 98.A O no hydrogen 2.897 N/A LEU 103.A N LEU 99.A O no hydrogen 2.916 N/A GLN 104.A N PHE 100.A O no hydrogen 3.031 N/A GLN 104.A NE2 PHE 100.A O no hydrogen 3.561 N/A GLY 105.A N GLN 101.A O no hydrogen 3.066 N/A LEU 106.A N LEU 102.A O no hydrogen 2.911 N/A ALA 107.A N LEU 103.A O no hydrogen 2.821 N/A PHE 108.A N GLN 104.A O no hydrogen 3.042 N/A CYS 109.A N GLY 105.A O no hydrogen 3.042 N/A CYS 109.A SG GLY 105.A O no hydrogen 3.602 N/A HIS 110.A N LEU 106.A O no hydrogen 2.767 N/A HIS 110.A NE2 ASP 175.A OD2 no hydrogen 2.876 N/A SER 111.A N ALA 107.A O no hydrogen 2.981 N/A SER 111.A N PHE 108.A O no hydrogen 3.175 N/A SER 111.A OG PHE 108.A O no hydrogen 2.701 N/A HIS 112.A N CYS 109.A O no hydrogen 2.966 N/A HIS 112.A ND1 PHE 108.A O no hydrogen 3.313 N/A ARG 113.A N HIS 110.A O no hydrogen 2.953 N/A VAL 114.A N CYS 109.A O no hydrogen 3.045 N/A HIS 116.A N ASP 175.A OD2 no hydrogen 2.878 N/A HIS 116.A NE2 ALA 135.A O no hydrogen 2.785 N/A ARG 117.A N.A ASP 175.A OD1 no hydrogen 2.787 N/A ARG 117.A N.B ASP 175.A OD1 no hydrogen 2.764 N/A ARG 117.A NE.A ARG 117.A O.A no hydrogen 2.871 N/A ARG 117.A NH1.A TYR 170.A OH no hydrogen 3.461 N/A ASP 118.A N HIS 116.A ND1 no hydrogen 2.968 N/A LYS 120.A N ASN 123.A OD1 no hydrogen 3.032 N/A LYS 120.A NZ ASP 118.A OD2 no hydrogen 2.837 N/A GLN 122.A NE2.B GLN 122.A O.B no hydrogen 2.626 N/A ASN 123.A N LYS 120.A O no hydrogen 2.927 N/A ASN 123.A ND2 ASP 118.A O no hydrogen 2.957 N/A LEU 124.A N PRO 121.A O no hydrogen 3.196 N/A LEU 125.A N LYS 133.A O no hydrogen 2.819 N/A ILE 126.A N GLN 76.A O no hydrogen 2.912 N/A ASN 127.A N ALA 131.A O no hydrogen 3.235 N/A GLU 129.A N ASN 127.A OD1 no hydrogen 2.975 N/A GLY 130.A N ASN 127.A O no hydrogen 3.522 N/A ALA 131.A N ASN 127.A OD1 no hydrogen 3.113 N/A ILE 132.A N GLN 101.A OE1 no hydrogen 3.136 N/A LYS 133.A N LEU 125.A O no hydrogen 2.774 N/A LYS 133.A NZ GLU 72.A OE1 no hydrogen 3.559 N/A LYS 133.A NZ GLU 72.A OE2 no hydrogen 2.778 N/A LEU 134.A N ASN 53.A O no hydrogen 2.870 N/A ALA 135.A N ASN 123.A O no hydrogen 2.857 N/A LEU 139.A N ASP 136.A O no hydrogen 3.315 N/A ALA 142.A N GLY 138.A O no hydrogen 3.437 N/A PHE 143.A N LEU 139.A O no hydrogen 2.763 N/A GLY 144.A N ALA 140.A O no hydrogen 2.590 N/A ARG 148.A NH1 HIS 152.A O no hydrogen 3.451 N/A THR 149.A N GLU 153.A O no hydrogen 2.752 N/A THR 149.A OG1 THR 151.A OG1 no hydrogen 2.884 N/A TYR 150.A N THR 14.A O no hydrogen 3.332 N/A THR 151.A N THR 149.A OG1 no hydrogen 3.150 N/A THR 151.A OG1 GLU 12.A OE2 no hydrogen 3.340 N/A THR 151.A OG1 THR 149.A OG1 no hydrogen 2.884 N/A HIS 152.A N THR 149.A O no hydrogen 2.767 N/A GLU 153.A N THR 149.A OG1 no hydrogen 3.249 N/A VAL 155.A N VAL 147.A O no hydrogen 3.042 N/A TRP 158.A N THR 156.A OG1 no hydrogen 3.241 N/A TYR 159.A OH GLU 185.A OE1 no hydrogen 2.617 N/A ARG 160.A N LEU 157.A O no hydrogen 3.075 N/A GLU 163.A N GLU 163.A OE1 no hydrogen 2.723 N/A ILE 164.A N ALA 161.A O no hydrogen 3.030 N/A LEU 165.A N ALA 161.A O no hydrogen 3.257 N/A LEU 166.A N PRO 162.A O no hydrogen 2.848 N/A GLY 167.A N ILE 164.A O no hydrogen 3.016 N/A ALA 173.A N SER 171.A OG no hydrogen 3.015 N/A VAL 174.A N SER 171.A O no hydrogen 3.004 N/A ASP 175.A N THR 172.A O no hydrogen 3.071 N/A TRP 177.A N ALA 173.A O no hydrogen 3.113 N/A SER 178.A N VAL 174.A O no hydrogen 3.186 N/A SER 178.A OG TYR 159.A O no hydrogen 2.713 N/A SER 178.A OG VAL 174.A O no hydrogen 3.152 N/A LEU 179.A N ASP 175.A O no hydrogen 2.951 N/A GLY 180.A N ILE 176.A O no hydrogen 2.869 N/A CYS 181.A N TRP 177.A O no hydrogen 3.003 N/A CYS 181.A SG TRP 177.A O no hydrogen 3.547 N/A ILE 182.A N SER 178.A O no hydrogen 3.026 N/A PHE 183.A N LEU 179.A O no hydrogen 2.839 N/A ALA 184.A N GLY 180.A O no hydrogen 3.008 N/A GLU 185.A N CYS 181.A O no hydrogen 3.109 N/A MET 186.A N ILE 182.A O no hydrogen 2.900 N/A VAL 187.A N PHE 183.A O no hydrogen 3.127 N/A THR 188.A N ALA 184.A O no hydrogen 2.931 N/A THR 188.A OG1 ALA 184.A O no hydrogen 3.007 N/A THR 188.A OG1 ARG 190.A O.A no hydrogen 3.107 N/A THR 188.A OG1 ARG 190.A O.B no hydrogen 3.117 N/A ARG 189.A N GLU 185.A O no hydrogen 2.813 N/A ARG 189.A NH1 ALA 86.A O no hydrogen 3.189 N/A ARG 190.A N.A THR 188.A OG1 no hydrogen 3.389 N/A GLY 195.A N PHE 193.A O no hydrogen 2.857 N/A ASP 196.A N ASP 200.A OD2 no hydrogen 3.153 N/A ASP 200.A N SER 197.A OG no hydrogen 3.077 N/A GLN 201.A N SER 197.A O no hydrogen 2.885 N/A GLN 201.A NE2 TRP 158.A O no hydrogen 3.240 N/A GLN 201.A NE2 PHE 193.A O no hydrogen 2.944 N/A LEU 202.A N.A GLU 198.A O no hydrogen 3.001 N/A LEU 202.A N.B GLU 198.A O no hydrogen 3.030 N/A PHE 203.A N ILE 199.A O no hydrogen 2.808 N/A ARG 204.A N ASP 200.A O no hydrogen 2.888 N/A ARG 204.A NE ASP 200.A OD2 no hydrogen 3.019 N/A ILE 205.A N GLN 201.A O no hydrogen 3.062 N/A PHE 206.A N LEU 202.A O.A no hydrogen 2.929 N/A PHE 206.A N LEU 202.A O.B no hydrogen 2.807 N/A ARG 207.A N.A PHE 203.A O no hydrogen 2.908 N/A ARG 207.A N.B PHE 203.A O no hydrogen 2.915 N/A THR 208.A N ARG 204.A O no hydrogen 3.356 N/A THR 208.A N ILE 205.A O no hydrogen 3.203 N/A THR 208.A OG1 ARG 204.A O no hydrogen 3.551 N/A LEU 209.A N ILE 205.A O no hydrogen 2.830 N/A GLY 210.A N PHE 206.A O no hydrogen 2.759 N/A THR 211.A N TRP 233.A O no hydrogen 3.013 N/A THR 211.A OG1 PRO 231.A O no hydrogen 2.691 N/A VAL 216.A N ASP 213.A OD1 no hydrogen 3.085 N/A TRP 217.A N ASP 213.A O no hydrogen 2.943 N/A GLY 219.A N GLU 214.A OE1 no hydrogen 2.732 N/A VAL 220.A N TRP 217.A O no hydrogen 2.924 N/A THR 221.A N GLU 214.A OE2 no hydrogen 3.000 N/A THR 221.A OG1 GLU 214.A OE2 no hydrogen 2.627 N/A SER 222.A N.A GLY 219.A O no hydrogen 3.040 N/A SER 222.A N.B GLY 219.A O no hydrogen 3.011 N/A SER 222.A OG.A GLY 219.A O no hydrogen 2.820 N/A MET 223.A N.A VAL 220.A O no hydrogen 3.167 N/A MET 223.A N.B VAL 220.A O no hydrogen 3.084 N/A ASP 225.A N LEU 166.A O no hydrogen 2.914 N/A TYR 226.A N MET 223.A O.A no hydrogen 3.085 N/A TYR 226.A N MET 223.A O.B no hydrogen 3.228 N/A TYR 226.A N MET 223.A O.C no hydrogen 3.035 N/A PHE 230.A N LYS 227.A O no hydrogen 2.928 N/A LYS 232.A NZ PRO 228.A O no hydrogen 3.190 N/A LYS 232.A NZ PHE 230.A O no hydrogen 2.705 N/A TRP 233.A N THR 211.A OG1 no hydrogen 2.906 N/A ARG 235.A NH1 LEU 209.A O no hydrogen 3.038 N/A GLN 236.A N THR 208.A O no hydrogen 2.818 N/A GLN 236.A NE2 ARG 207.A O.B no hydrogen 3.532 N/A LYS 240.A N ASP 237.A O no hydrogen 2.928 N/A VAL 241.A N ASP 237.A O no hydrogen 3.316 N/A VAL 242.A N PHE 238.A O no hydrogen 2.998 N/A LEU 245.A N VAL 242.A O no hydrogen 2.868 N/A GLY 249.A N ASP 246.A OD1 no hydrogen 2.895 N/A ARG 250.A N ASP 246.A O no hydrogen 2.863 N/A ARG 250.A NE GLU 247.A OE1 no hydrogen 3.159 N/A ARG 250.A NH2 GLU 247.A OE1 no hydrogen 2.791 N/A SER 251.A N GLU 247.A O no hydrogen 2.929 N/A SER 251.A OG HIS 273.A NE2 no hydrogen 3.200 N/A LEU 252.A N ASP 248.A O no hydrogen 3.030 N/A LEU 253.A N GLY 249.A O no hydrogen 2.861 N/A SER 254.A N.A ARG 250.A O no hydrogen 2.878 N/A SER 254.A N.B ARG 250.A O no hydrogen 2.937 N/A SER 254.A OG.A SER 251.A O no hydrogen 2.711 N/A GLN 255.A N.A SER 251.A O no hydrogen 3.119 N/A GLN 255.A N.B SER 251.A O no hydrogen 3.195 N/A GLN 255.A NE2.A SER 251.A O no hydrogen 3.121 N/A GLN 255.A NE2.A HIS 273.A NE2 no hydrogen 3.398 N/A MET 256.A N LEU 252.A O no hydrogen 2.973 N/A LEU 257.A N LEU 253.A O no hydrogen 2.967 N/A LEU 257.A N SER 254.A O.B no hydrogen 3.056 N/A HIS 258.A N GLN 255.A O.A no hydrogen 3.492 N/A TYR 259.A OH GLY 210.A O no hydrogen 2.616 N/A ASN 262.A N ASP 260.A OD1 no hydrogen 2.924 N/A LYS 263.A N ASP 260.A O no hydrogen 2.934 N/A ARG 264.A N ASP 260.A O no hydrogen 2.969 N/A ARG 264.A NE HIS 258.A O no hydrogen 2.850 N/A ARG 264.A NH1 GLU 163.A OE1 no hydrogen 3.398 N/A ARG 264.A NH1 GLU 163.A OE2 no hydrogen 2.801 N/A ARG 264.A NH1 ALA 173.A O no hydrogen 2.985 N/A ARG 264.A NH2 GLU 163.A OE1 no hydrogen 2.924 N/A ARG 264.A NH2 HIS 258.A O no hydrogen 3.084 N/A ARG 264.A NH2 TYR 259.A O no hydrogen 2.998 N/A ILE 265.A N GLN 255.A O.A no hydrogen 3.136 N/A ILE 265.A N GLN 255.A O.B no hydrogen 2.885 N/A ALA 269.A N SER 266.A OG no hydrogen 3.025 N/A ALA 270.A N SER 266.A O no hydrogen 2.888 N/A LEU 271.A N ALA 267.A O no hydrogen 3.081 N/A ALA 272.A N ALA 269.A O no hydrogen 3.105 N/A HIS 273.A N ALA 270.A O no hydrogen 2.975 N/A HIS 273.A NE2 SER 251.A OG no hydrogen 3.200 N/A PHE 275.A N HIS 273.A ND1 no hydrogen 2.952 N/A PHE 276.A N HIS 273.A O no hydrogen 2.966 N/A GLN 277.A N PRO 274.A O no hydrogen 3.000 N/A VAL 279.A N PHE 276.A O no hydrogen 3.157 N/A ARG 287.A NH2 LEU 286.A O no hydrogen 3.470 N/A