Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7s84_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 3.A ND2 MET 1.A O no hydrogen 3.230 N/A GLN 5.A N ARG 20.A O no hydrogen 2.946 N/A VAL 7.A N LYS 18.A O no hydrogen 2.751 N/A GLU 8.A N LYS 18.A O no hydrogen 3.260 N/A ILE 10.A N VAL 16.A O no hydrogen 3.065 N/A VAL 16.A N GLY 11.A O no hydrogen 2.962 N/A TYR 17.A N LEU 30.A O no hydrogen 2.870 N/A LYS 18.A N GLU 8.A O no hydrogen 2.652 N/A ALA 19.A N VAL 28.A O no hydrogen 2.890 N/A ARG 20.A N GLN 5.A O no hydrogen 2.815 N/A ARG 20.A NE GLN 5.A OE1 no hydrogen 3.208 N/A ASN 21.A N GLU 26.A O no hydrogen 2.879 N/A LYS 22.A N ASN 3.A O no hydrogen 3.303 N/A LEU 23.A N ASN 21.A OD1 no hydrogen 3.018 N/A THR 24.A N ASN 21.A OD1 no hydrogen 3.126 N/A GLY 25.A N ASN 21.A O no hydrogen 2.858 N/A GLU 26.A N THR 24.A OG1 no hydrogen 3.096 N/A VAL 28.A N ALA 19.A O no hydrogen 2.885 N/A ALA 29.A N PHE 70.A O no hydrogen 2.772 N/A LEU 30.A N TYR 17.A O no hydrogen 2.708 N/A LYS 31.A N LEU 68.A O no hydrogen 2.755 N/A LYS 31.A NZ ASP 135.A OD1 no hydrogen 2.819 N/A LYS 32.A N VAL 15.A O no hydrogen 2.888 N/A ILE 33.A N LEU 66.A O no hydrogen 2.729 N/A LEU 35.A N ASN 64.A O no hydrogen 2.923 N/A ILE 40.A N PRO 36.A O no hydrogen 2.854 N/A ARG 41.A N SER 37.A O no hydrogen 2.791 N/A GLU 42.A N THR 38.A O no hydrogen 2.624 N/A ILE 43.A N ALA 39.A O no hydrogen 2.967 N/A SER 44.A N ILE 40.A O no hydrogen 2.935 N/A SER 44.A OG ILE 40.A O no hydrogen 2.644 N/A LEU 45.A N ARG 41.A O no hydrogen 3.075 N/A LEU 46.A N ILE 43.A O no hydrogen 3.058 N/A LYS 47.A N SER 44.A O no hydrogen 3.226 N/A GLU 48.A N LEU 45.A O no hydrogen 3.123 N/A LEU 49.A N LEU 46.A O no hydrogen 3.115 N/A ASN 50.A ND2 LYS 47.A O no hydrogen 2.932 N/A ASN 53.A N HIS 51.A ND1 no hydrogen 3.068 N/A ASN 53.A ND2 GLN 100.A OE1 no hydrogen 3.041 N/A ASN 53.A ND2 ILE 131.A O no hydrogen 3.011 N/A ILE 54.A N HIS 51.A O no hydrogen 3.118 N/A VAL 55.A N LEU 133.A O no hydrogen 2.953 N/A LYS 56.A N GLU 71.A OE2 no hydrogen 2.733 N/A LYS 56.A NZ LYS 47.A O no hydrogen 3.080 N/A LYS 56.A NZ ASN 50.A OD1 no hydrogen 3.551 N/A LEU 58.A N VAL 69.A O no hydrogen 2.654 N/A ASP 59.A N VAL 69.A O no hydrogen 3.240 N/A ILE 61.A N TYR 67.A O no hydrogen 2.920 N/A THR 63.A N LYS 65.A O no hydrogen 3.032 N/A THR 63.A OG1 ASN 64.A OD1 no hydrogen 3.208 N/A LEU 66.A N ILE 33.A O no hydrogen 2.619 N/A TYR 67.A N ILE 61.A O no hydrogen 2.709 N/A LEU 68.A N LYS 31.A O no hydrogen 2.920 N/A VAL 69.A N ASP 59.A O no hydrogen 2.988 N/A PHE 70.A N ALA 29.A O no hydrogen 2.827 N/A GLU 71.A N LYS 56.A O no hydrogen 3.035 N/A GLN 75.A NE2 ARG 281.A O no hydrogen 3.452 N/A LEU 77.A N LEU 123.A O no hydrogen 2.762 N/A LYS 78.A N PRO 120.A O no hydrogen 3.294 N/A LYS 78.A NZ ASP 82.A OD1 no hydrogen 3.296 N/A LYS 79.A N ASP 76.A OD1 no hydrogen 2.798 N/A PHE 80.A N ASP 76.A O no hydrogen 3.072 N/A MET 81.A N LEU 77.A O no hydrogen 2.729 N/A ASP 82.A N LYS 78.A O no hydrogen 2.978 N/A ALA 83.A N LYS 79.A O no hydrogen 2.874 N/A SER 84.A N PHE 80.A O no hydrogen 2.943 N/A SER 84.A OG PHE 80.A O no hydrogen 2.760 N/A ALA 85.A N ASP 82.A O no hydrogen 3.306 N/A THR 87.A OG1 GLY 88.A O no hydrogen 3.430 N/A GLY 88.A N SER 84.A O no hydrogen 2.492 N/A LEU 93.A N PRO 90.A O no hydrogen 2.826 N/A ILE 94.A N PRO 90.A O no hydrogen 2.968 N/A LYS 95.A N LEU 91.A O no hydrogen 2.781 N/A LYS 95.A NZ PHE 269.A O no hydrogen 3.046 N/A LYS 95.A NZ ASP 272.A OD1 no hydrogen 2.637 N/A SER 96.A N PRO 92.A O no hydrogen 2.942 N/A TYR 97.A N LEU 93.A O no hydrogen 2.803 N/A LEU 98.A N ILE 94.A O no hydrogen 2.885 N/A PHE 99.A N LYS 95.A O no hydrogen 2.931 N/A GLN 100.A N SER 96.A O no hydrogen 2.929 N/A GLN 100.A NE2 SER 96.A O no hydrogen 3.565 N/A GLN 100.A NE2 SER 96.A OG no hydrogen 3.042 N/A GLN 100.A NE2 GLY 129.A O no hydrogen 2.914 N/A LEU 101.A N TYR 97.A O no hydrogen 2.996 N/A LEU 102.A N LEU 98.A O no hydrogen 3.039 N/A GLN 103.A N PHE 99.A O no hydrogen 3.014 N/A GLY 104.A N GLN 100.A O no hydrogen 2.942 N/A LEU 105.A N LEU 101.A O no hydrogen 2.859 N/A ALA 106.A N LEU 102.A O no hydrogen 2.731 N/A PHE 107.A N GLN 103.A O no hydrogen 3.026 N/A CYS 108.A N GLY 104.A O no hydrogen 3.014 N/A CYS 108.A SG GLY 104.A O no hydrogen 3.631 N/A CYS 108.A SG LEU 105.A O no hydrogen 3.660 N/A CYS 108.A SG VAL 113.A O no hydrogen 3.403 N/A HIS 109.A N LEU 105.A O no hydrogen 2.764 N/A HIS 109.A NE2 ASP 169.A OD2 no hydrogen 2.750 N/A SER 110.A N ALA 106.A O no hydrogen 2.962 N/A SER 110.A OG ALA 106.A O no hydrogen 3.327 N/A SER 110.A OG PHE 107.A O no hydrogen 2.481 N/A SER 110.A OG HIS 111.A ND1 no hydrogen 3.364 N/A HIS 111.A N PHE 107.A O no hydrogen 3.264 N/A HIS 111.A N CYS 108.A O no hydrogen 3.012 N/A HIS 111.A ND1 PHE 107.A O no hydrogen 3.195 N/A ARG 112.A N HIS 109.A O no hydrogen 3.030 N/A VAL 113.A N CYS 108.A O no hydrogen 2.831 N/A HIS 115.A N ASP 169.A OD2 no hydrogen 2.860 N/A HIS 115.A NE2 ALA 134.A O no hydrogen 2.751 N/A ARG 116.A N ASP 169.A OD1 no hydrogen 2.826 N/A ASP 117.A N HIS 115.A ND1 no hydrogen 3.022 N/A LYS 119.A NZ ASP 117.A O no hydrogen 3.112 N/A LYS 119.A NZ ASP 117.A OD2 no hydrogen 2.484 N/A LYS 119.A NZ ASN 122.A OD1 no hydrogen 2.646 N/A GLN 121.A N GLN 121.A OE1 no hydrogen 2.919 N/A ASN 122.A N LYS 119.A O no hydrogen 2.940 N/A ASN 122.A ND2 ASP 135.A OD2 no hydrogen 2.966 N/A LEU 123.A N PRO 120.A O no hydrogen 3.158 N/A LEU 124.A N LYS 132.A O no hydrogen 2.952 N/A ILE 125.A N GLN 75.A O no hydrogen 2.861 N/A ASN 126.A N ALA 130.A O no hydrogen 3.306 N/A GLU 128.A N ASN 126.A OD1 no hydrogen 3.005 N/A GLY 129.A N ASN 126.A O no hydrogen 3.472 N/A ALA 130.A N ASN 126.A OD1 no hydrogen 3.067 N/A ILE 131.A N GLN 100.A OE1 no hydrogen 3.196 N/A LYS 132.A N LEU 124.A O no hydrogen 2.723 N/A LYS 132.A NZ GLU 71.A OE1 no hydrogen 3.377 N/A LEU 133.A N ASN 53.A O no hydrogen 2.903 N/A ALA 134.A N ASN 122.A O no hydrogen 2.988 N/A GLY 137.A N HIS 115.A O no hydrogen 2.902 N/A ALA 139.A N TYR 13.A OH no hydrogen 2.894 N/A PHE 142.A N LEU 138.A O no hydrogen 2.889 N/A GLY 143.A N ARG 140.A O no hydrogen 3.064 N/A VAL 144.A N ALA 139.A O no hydrogen 2.843 N/A VAL 146.A N VAL 144.A O no hydrogen 2.839 N/A TYR 152.A OH GLU 179.A OE1 no hydrogen 2.603 N/A TYR 152.A OH GLU 179.A OE2 no hydrogen 3.421 N/A ARG 153.A N LEU 150.A O no hydrogen 3.075 N/A ARG 153.A NH1 ASP 117.A OD1 no hydrogen 3.041 N/A GLU 156.A N GLU 156.A OE1 no hydrogen 2.734 N/A ILE 157.A N ALA 154.A O no hydrogen 3.069 N/A LEU 158.A N ALA 154.A O no hydrogen 3.247 N/A LEU 159.A N PRO 155.A O no hydrogen 3.014 N/A GLY 160.A N ILE 157.A O no hydrogen 3.113 N/A CYS 161.A N GLU 156.A O no hydrogen 3.006 N/A CYS 161.A SG TYR 163.A O no hydrogen 3.393 N/A ALA 167.A N SER 165.A OG no hydrogen 3.063 N/A VAL 168.A N SER 165.A O no hydrogen 3.159 N/A ASP 169.A N THR 166.A O no hydrogen 3.105 N/A TRP 171.A N ALA 167.A O no hydrogen 3.091 N/A SER 172.A N VAL 168.A O no hydrogen 3.216 N/A SER 172.A OG TYR 152.A O no hydrogen 2.654 N/A SER 172.A OG VAL 168.A O no hydrogen 3.051 N/A LEU 173.A N ASP 169.A O no hydrogen 2.914 N/A GLY 174.A N ILE 170.A O no hydrogen 2.790 N/A CYS 175.A N TRP 171.A O no hydrogen 2.942 N/A CYS 175.A SG TRP 171.A O no hydrogen 3.619 N/A ILE 176.A N SER 172.A O no hydrogen 2.999 N/A PHE 177.A N LEU 173.A O no hydrogen 2.918 N/A ALA 178.A N GLY 174.A O no hydrogen 3.071 N/A GLU 179.A N CYS 175.A O no hydrogen 3.080 N/A MET 180.A N ILE 176.A O no hydrogen 2.868 N/A VAL 181.A N PHE 177.A O no hydrogen 3.137 N/A THR 182.A N ALA 178.A O no hydrogen 2.947 N/A THR 182.A OG1 ALA 178.A O no hydrogen 3.061 N/A ARG 183.A N GLU 179.A O no hydrogen 2.853 N/A ARG 183.A NE ALA 85.A O no hydrogen 3.155 N/A ARG 183.A NH2 ALA 85.A O no hydrogen 3.109 N/A ARG 184.A N THR 182.A OG1 no hydrogen 3.187 N/A GLY 189.A N PHE 187.A O no hydrogen 2.996 N/A GLY 189.A N GLN 195.A OE1 no hydrogen 2.892 N/A ASP 190.A N ASP 194.A OD2 no hydrogen 3.018 N/A ASP 194.A N SER 191.A OG no hydrogen 2.909 N/A GLN 195.A N SER 191.A O no hydrogen 2.634 N/A GLN 195.A NE2 PHE 187.A O no hydrogen 2.820 N/A LEU 196.A N GLU 192.A O no hydrogen 2.911 N/A PHE 197.A N ILE 193.A O no hydrogen 2.956 N/A ARG 198.A N ASP 194.A O no hydrogen 2.929 N/A ARG 198.A NE ASP 194.A OD2 no hydrogen 3.134 N/A ILE 199.A N GLN 195.A O no hydrogen 3.068 N/A PHE 200.A N LEU 196.A O no hydrogen 2.831 N/A ARG 201.A N PHE 197.A O no hydrogen 2.742 N/A THR 202.A N ARG 198.A O no hydrogen 3.346 N/A THR 202.A N ILE 199.A O no hydrogen 3.154 N/A THR 202.A OG1 ARG 198.A O no hydrogen 3.404 N/A LEU 203.A N ILE 199.A O no hydrogen 2.886 N/A GLY 204.A N PHE 200.A O no hydrogen 2.723 N/A THR 205.A N TRP 227.A O no hydrogen 2.838 N/A THR 205.A OG1 PRO 225.A O no hydrogen 2.712 N/A VAL 210.A N ASP 207.A OD1 no hydrogen 3.130 N/A TRP 211.A N ASP 207.A O no hydrogen 2.747 N/A GLY 213.A N GLU 208.A OE1 no hydrogen 2.820 N/A VAL 214.A N TRP 211.A O no hydrogen 2.986 N/A THR 215.A N GLU 208.A OE2 no hydrogen 2.993 N/A THR 215.A OG1 GLU 208.A OE2 no hydrogen 2.272 N/A SER 216.A N GLY 213.A O no hydrogen 3.046 N/A MET 217.A N.A VAL 214.A O no hydrogen 3.046 N/A MET 217.A N.B VAL 214.A O no hydrogen 3.049 N/A ASP 219.A N LEU 159.A O no hydrogen 2.951 N/A TYR 220.A N MET 217.A O.A no hydrogen 3.165 N/A TYR 220.A N MET 217.A O.B no hydrogen 3.127 N/A PHE 224.A N LYS 221.A O no hydrogen 2.967 N/A TRP 227.A N THR 205.A OG1 no hydrogen 2.822 N/A ARG 229.A NH1 LEU 203.A O no hydrogen 3.135 N/A GLN 230.A N THR 202.A O no hydrogen 2.841 N/A SER 233.A N ASP 231.A OD1 no hydrogen 3.209 N/A SER 233.A OG ASP 231.A OD1 no hydrogen 2.833 N/A LYS 234.A N ASP 231.A O no hydrogen 2.925 N/A VAL 235.A N PHE 232.A O no hydrogen 3.224 N/A LEU 239.A N VAL 236.A O no hydrogen 2.871 N/A GLY 243.A N ASP 240.A OD1 no hydrogen 2.865 N/A ARG 244.A N ASP 240.A O no hydrogen 2.832 N/A ARG 244.A NH1 LEU 239.A O no hydrogen 2.877 N/A SER 245.A N GLU 241.A O no hydrogen 2.820 N/A SER 245.A OG HIS 267.A NE2 no hydrogen 3.167 N/A LEU 246.A N ASP 242.A O no hydrogen 3.060 N/A LEU 247.A N GLY 243.A O no hydrogen 2.854 N/A SER 248.A N ARG 244.A O no hydrogen 2.865 N/A SER 248.A OG SER 245.A O no hydrogen 2.847 N/A GLN 249.A N SER 245.A O no hydrogen 3.180 N/A MET 250.A N LEU 246.A O no hydrogen 3.022 N/A LEU 251.A N LEU 247.A O no hydrogen 3.006 N/A LEU 251.A N SER 248.A O no hydrogen 3.355 N/A TYR 253.A OH GLY 204.A O no hydrogen 2.681 N/A ASN 256.A N ASP 254.A OD1 no hydrogen 3.010 N/A LYS 257.A N ASP 254.A O no hydrogen 2.830 N/A LYS 257.A NZ VAL 210.A O no hydrogen 3.230 N/A LYS 257.A NZ ASP 254.A OD2 no hydrogen 2.892 N/A ARG 258.A N ASP 254.A O no hydrogen 3.073 N/A ARG 258.A NE HIS 252.A O no hydrogen 2.837 N/A ARG 258.A NH1 GLU 156.A OE1 no hydrogen 3.357 N/A ARG 258.A NH1 GLU 156.A OE2 no hydrogen 2.868 N/A ARG 258.A NH1 ALA 167.A O no hydrogen 2.841 N/A ARG 258.A NH2 GLU 156.A OE1 no hydrogen 2.932 N/A ARG 258.A NH2 HIS 252.A O no hydrogen 3.076 N/A ARG 258.A NH2 TYR 253.A O no hydrogen 2.961 N/A ILE 259.A N GLN 249.A O no hydrogen 3.135 N/A ALA 263.A N SER 260.A OG no hydrogen 2.967 N/A ALA 264.A N SER 260.A O no hydrogen 2.870 N/A LEU 265.A N ALA 261.A O no hydrogen 3.081 N/A ALA 266.A N ALA 263.A O no hydrogen 3.047 N/A HIS 267.A N ALA 264.A O no hydrogen 3.000 N/A HIS 267.A NE2 SER 245.A OG no hydrogen 3.167 N/A PHE 269.A N HIS 267.A ND1 no hydrogen 2.912 N/A PHE 270.A N HIS 267.A O no hydrogen 2.949 N/A GLN 271.A N PRO 268.A O no hydrogen 3.191 N/A VAL 273.A N PHE 270.A O no hydrogen 3.164 N/A