Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3et5_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 4.A N GLN 1.A O no hydrogen 3.258 N/A GLN 5.A N GLN 1.A O no hydrogen 3.368 N/A LEU 6.A N ALA 2.A O no hydrogen 2.880 N/A GLN 7.A N ASN 3.A O no hydrogen 3.245 N/A GLN 8.A N MET 4.A O no hydrogen 2.965 N/A ALA 10.A N GLN 7.A O no hydrogen 3.211 N/A VAL 11.A N GLN 8.A O no hydrogen 3.058 N/A LEU 14.A N ALA 10.A O no hydrogen 2.940 N/A ASN 15.A N VAL 11.A O no hydrogen 2.878 N/A TRP 16.A N LEU 12.A O no hydrogen 2.993 N/A MET 17.A N GLY 13.A O no hydrogen 3.010 N/A GLN 18.A N LEU 14.A O no hydrogen 2.852 N/A GLN 18.A NE2 SER 63.A OG no hydrogen 2.952 N/A ASP 19.A N ASN 15.A O no hydrogen 2.774 N/A SER 20.A N TRP 16.A O no hydrogen 3.123 N/A SER 20.A OG TRP 16.A O no hydrogen 2.583 N/A GLU 22.A N GLU 22.A OE1 no hydrogen 2.732 N/A TYR 23.A N SER 20.A OG no hydrogen 2.930 N/A ALA 25.A N GLY 21.A O no hydrogen 2.842 N/A LEU 26.A N GLU 22.A O no hydrogen 3.020 N/A ALA 27.A N TYR 23.A O no hydrogen 3.002 N/A TYR 28.A N LYS 24.A O no hydrogen 2.935 N/A GLN 29.A N ALA 25.A O no hydrogen 2.805 N/A ALA 30.A N LEU 26.A O no hydrogen 3.011 N/A TYR 31.A N ALA 27.A O no hydrogen 3.059 N/A TYR 31.A OH THR 58.A O no hydrogen 2.728 N/A ASN 32.A N TYR 28.A O no hydrogen 2.752 N/A ALA 33.A N GLN 29.A O no hydrogen 3.014 N/A ALA 34.A N ALA 30.A O no hydrogen 2.816 N/A LYS 35.A N TYR 31.A O no hydrogen 3.051 N/A VAL 36.A N ASN 32.A O no hydrogen 3.238 N/A ALA 37.A N ALA 33.A O no hydrogen 2.967 N/A PHE 38.A N ALA 34.A O no hydrogen 2.910 N/A ASP 39.A N LYS 35.A O no hydrogen 2.882 N/A HIS 40.A N VAL 36.A O no hydrogen 3.055 N/A ALA 41.A N PHE 38.A O no hydrogen 3.389 N/A ALA 44.A N GLU 164.A OE1 no hydrogen 3.092 N/A LYS 47.A N ALA 44.A O no hydrogen 2.985 N/A LYS 48.A N GLY 162.A O no hydrogen 3.148 N/A LYS 48.A NZ GLN 161.A O no hydrogen 3.258 N/A LYS 49.A NZ PHE 38.A O no hydrogen 2.704 N/A ALA 50.A N GLU 164.A O no hydrogen 2.955 N/A VAL 51.A N LYS 109.A O no hydrogen 2.788 N/A VAL 52.A N LEU 167.A O no hydrogen 3.079 N/A ALA 53.A N PHE 111.A O no hydrogen 2.853 N/A ASP 54.A N VAL 169.A O no hydrogen 2.989 N/A GLU 57.A N LEU 60.A O no hydrogen 2.672 N/A THR 58.A N LEU 55.A O no hydrogen 2.959 N/A THR 58.A OG1 ASP 54.A OD2 no hydrogen 2.781 N/A THR 58.A OG1 ASP 171.A OD1 no hydrogen 3.118 N/A MET 59.A N LEU 55.A O no hydrogen 2.803 N/A LEU 60.A N LEU 55.A O no hydrogen 2.904 N/A ASP 61.A N ARG 91.A O no hydrogen 2.739 N/A ASN 62.A N GLU 57.A OE1 no hydrogen 2.760 N/A ASN 62.A ND2 ASP 56.A OD1 no hydrogen 2.842 N/A ASN 62.A ND2 GLU 57.A OE1 no hydrogen 3.515 N/A ASN 62.A ND2 GLU 57.A OE2 no hydrogen 3.143 N/A SER 63.A N ASP 61.A OD1 no hydrogen 2.887 N/A SER 63.A OG ASP 61.A OD1 no hydrogen 2.895 N/A TYR 65.A N ASN 62.A O no hydrogen 2.971 N/A GLY 67.A N SER 63.A O no hydrogen 2.868 N/A TRP 68.A N PRO 64.A O no hydrogen 2.972 N/A GLN 69.A N TYR 65.A O no hydrogen 2.961 N/A VAL 70.A N ALA 66.A O no hydrogen 3.067 N/A GLN 71.A N GLY 67.A O no hydrogen 3.149 N/A ASN 72.A N GLN 69.A O no hydrogen 3.268 N/A ASN 72.A ND2 TRP 68.A O no hydrogen 2.893 N/A ASN 73.A N VAL 70.A O no hydrogen 3.491 N/A LYS 74.A N GLN 69.A O no hydrogen 3.036 N/A LYS 79.A N ASP 77.A OD1 no hydrogen 3.015 N/A ASP 80.A N ASP 77.A OD1 no hydrogen 3.338 N/A TRP 81.A N ASP 77.A O no hydrogen 3.023 N/A THR 82.A N GLY 78.A O no hydrogen 3.316 N/A THR 82.A OG1 GLY 78.A O no hydrogen 3.360 N/A THR 82.A OG1 GLU 121.A OE2 no hydrogen 2.743 N/A ARG 83.A N LYS 79.A O no hydrogen 3.254 N/A ARG 83.A NH1 ASP 80.A OD1 no hydrogen 2.550 N/A TRP 84.A N ASP 80.A O no hydrogen 2.993 N/A TRP 84.A NE1 ASN 62.A OD1 no hydrogen 2.874 N/A VAL 85.A N TRP 81.A O no hydrogen 2.889 N/A ASP 86.A N THR 82.A O no hydrogen 2.787 N/A ALA 87.A N ARG 83.A O no hydrogen 2.794 N/A ALA 87.A N TRP 84.A O no hydrogen 3.001 N/A ARG 88.A N VAL 85.A O no hydrogen 3.219 N/A ARG 88.A NE ASP 127.A OD2 no hydrogen 2.765 N/A ARG 88.A NH1 ASP 86.A O no hydrogen 2.806 N/A SER 90.A N ASP 128.A OD2 no hydrogen 3.082 N/A SER 90.A OG ASP 128.A OD2 no hydrogen 2.895 N/A ARG 91.A N ASP 61.A O no hydrogen 3.148 N/A ARG 91.A NE ASP 61.A OD2 no hydrogen 2.907 N/A ARG 91.A NH2 ASP 61.A OD2 no hydrogen 3.126 N/A VAL 93.A N MET 59.A O no hydrogen 2.969 N/A ALA 96.A N VAL 93.A O no hydrogen 3.089 N/A GLU 98.A N GLU 98.A OE2 no hydrogen 2.816 N/A PHE 99.A N GLY 95.A O no hydrogen 3.010 N/A ASN 100.A N ALA 96.A O no hydrogen 2.872 N/A ASN 100.A ND2 ASN 101.A OD1 no hydrogen 3.060 N/A ASN 100.A ND2 ASN 135.A O no hydrogen 2.924 N/A ASN 101.A N VAL 97.A O no hydrogen 3.012 N/A ASN 101.A ND2 GLY 133.A O no hydrogen 3.069 N/A TYR 102.A N GLU 98.A O no hydrogen 2.995 N/A TYR 102.A OH ASP 39.A OD1 no hydrogen 2.568 N/A TYR 102.A OH ASP 39.A OD2 no hydrogen 3.233 N/A VAL 103.A N PHE 99.A O no hydrogen 3.064 N/A ASN 104.A N ASN 100.A O no hydrogen 3.150 N/A ASN 104.A ND2 ASN 135.A O no hydrogen 2.971 N/A SER 105.A N ASN 101.A O no hydrogen 3.131 N/A SER 105.A N TYR 102.A O no hydrogen 3.259 N/A SER 105.A OG ASN 101.A O no hydrogen 2.720 N/A SER 105.A OG TYR 102.A O no hydrogen 3.432 N/A HIS 106.A N VAL 103.A O no hydrogen 3.104 N/A HIS 106.A ND1 TYR 102.A O no hydrogen 2.920 N/A GLY 108.A N VAL 103.A O no hydrogen 3.034 N/A LYS 109.A N LYS 49.A O no hydrogen 2.937 N/A LYS 109.A NZ GLY 136.A O no hydrogen 3.163 N/A LYS 109.A NZ GLU 138.A OE2 no hydrogen 2.722 N/A VAL 110.A N ASN 104.A OD1 no hydrogen 2.932 N/A PHE 111.A N VAL 51.A O no hydrogen 2.725 N/A TYR 112.A N ALA 141.A O no hydrogen 2.810 N/A TYR 112.A OH ASN 100.A OD1 no hydrogen 2.682 N/A VAL 113.A N ALA 53.A O no hydrogen 2.854 N/A THR 114.A N TYR 143.A O no hydrogen 3.273 N/A ASN 115.A ND2 SER 149.A O no hydrogen 2.972 N/A ARG 116.A N THR 114.A OG1 no hydrogen 3.199 N/A ARG 116.A NE ASP 56.A OD1 no hydrogen 2.761 N/A ARG 116.A NH1 THR 125.A OG1 no hydrogen 2.895 N/A ARG 116.A NH2 ASP 56.A OD1 no hydrogen 3.338 N/A ARG 116.A NH2 ASN 62.A OD1 no hydrogen 2.778 N/A ARG 116.A NH2 SER 90.A OG no hydrogen 3.040 N/A LYS 117.A N GLU 121.A OE1 no hydrogen 2.879 N/A ASP 118.A N LYS 145.A O no hydrogen 2.868 N/A GLU 121.A N LYS 117.A O no hydrogen 2.972 N/A LYS 122.A NZ GLU 139.A OE2 no hydrogen 3.549 N/A THR 125.A N GLU 121.A O no hydrogen 3.176 N/A THR 125.A OG1 GLU 121.A O no hydrogen 2.469 N/A ILE 126.A N LYS 122.A O no hydrogen 2.876 N/A ASP 127.A N ALA 123.A O no hydrogen 2.924 N/A ASP 128.A N GLY 124.A O no hydrogen 2.944 N/A MET 129.A N THR 125.A O no hydrogen 3.030 N/A LYS 130.A N ILE 126.A O no hydrogen 3.039 N/A ARG 131.A N ASP 127.A O no hydrogen 2.985 N/A ARG 131.A NH1 SER 90.A O no hydrogen 2.708 N/A ARG 131.A NH1 ASP 128.A OD1 no hydrogen 3.015 N/A LEU 132.A N ASP 128.A O no hydrogen 2.749 N/A GLY 133.A N MET 129.A O no hydrogen 3.088 N/A GLY 133.A N LYS 130.A O no hydrogen 3.120 N/A PHE 134.A N MET 129.A O no hydrogen 2.935 N/A ASN 135.A N ASN 101.A OD1 no hydrogen 2.762 N/A ALA 141.A N GLU 138.A O no hydrogen 3.111 N/A PHE 142.A N GLU 139.A O no hydrogen 3.016 N/A TYR 143.A N TYR 112.A O no hydrogen 2.839 N/A LYS 145.A N ARG 116.A O no hydrogen 3.064 N/A LYS 145.A NZ SER 149.A OG no hydrogen 2.821 N/A LYS 151.A NZ ASP 54.A OD1 no hydrogen 2.801 N/A LYS 151.A NZ VAL 113.A O no hydrogen 2.948 N/A LYS 151.A NZ ASP 175.A OD1 no hydrogen 2.884 N/A ALA 152.A N ASN 178.A OD1 no hydrogen 3.112 N/A ARG 154.A NH1 THR 114.A O no hydrogen 2.924 N/A ARG 154.A NH1 ASN 115.A OD1 no hydrogen 3.249 N/A ARG 154.A NH1 TYR 143.A O no hydrogen 3.164 N/A ARG 154.A NH2 ASN 115.A OD1 no hydrogen 2.885 N/A ARG 154.A NH2 ALA 150.A O no hydrogen 3.146 N/A PHE 155.A N LYS 151.A O no hydrogen 3.162 N/A ALA 156.A N ALA 152.A O no hydrogen 2.878 N/A GLU 157.A N ALA 153.A O no hydrogen 2.963 N/A ILE 158.A N ARG 154.A O no hydrogen 3.156 N/A GLU 159.A N PHE 155.A O no hydrogen 3.091 N/A LYS 160.A N ALA 156.A O no hydrogen 2.953 N/A GLN 161.A N ILE 158.A O no hydrogen 3.188 N/A GLN 161.A NE2 TYR 143.A OH no hydrogen 2.438 N/A GLN 161.A NE2 GLU 157.A O no hydrogen 3.110 N/A GLY 162.A N GLU 159.A O no hydrogen 3.364 N/A GLU 164.A N LYS 48.A O no hydrogen 2.864 N/A ILE 165.A N GLU 159.A OE2.B no hydrogen 2.938 N/A VAL 166.A N ALA 50.A O no hydrogen 2.831 N/A TYR 168.A N THR 202.A O no hydrogen 2.876 N/A VAL 169.A N VAL 52.A O no hydrogen 2.894 N/A GLY 170.A N ILE 204.A O no hydrogen 2.860 N/A ASP 171.A N ASP 175.A OD2 no hydrogen 3.105 N/A ASN 172.A N ASP 175.A OD2 no hydrogen 3.111 N/A ASP 174.A N ASN 172.A OD1 no hydrogen 2.914 N/A ASP 175.A N ASN 172.A O no hydrogen 2.910 N/A PHE 176.A N LEU 173.A O no hydrogen 3.001 N/A TYR 181.A N ASN 178.A O no hydrogen 3.310 N/A LYS 183.A N VAL 180.A O no hydrogen 3.080 N/A LYS 183.A NZ THR 179.A O no hydrogen 3.458 N/A ASN 185.A N GLY 217.A O no hydrogen 2.975 N/A ASN 185.A ND2 TRP 214.A O no hydrogen 2.840 N/A ARG 188.A N LEU 184.A O no hydrogen 3.143 N/A ARG 188.A NH1 ASP 174.A OD1 no hydrogen 2.945 N/A ARG 188.A NH1 ASP 174.A OD2 no hydrogen 3.293 N/A ARG 188.A NH1 VAL 180.A O no hydrogen 2.919 N/A ARG 188.A NH2 ASN 172.A OD1 no hydrogen 2.810 N/A ARG 189.A N ASN 185.A O no hydrogen 2.700 N/A ALA 190.A N ALA 186.A O no hydrogen 2.924 N/A PHE 191.A N ASP 187.A O no hydrogen 3.018 N/A VAL 192.A N ARG 188.A O no hydrogen 3.270 N/A ASP 193.A N ARG 189.A O no hydrogen 3.051 N/A GLN 194.A N ALA 190.A O no hydrogen 3.009 N/A ASN 195.A N VAL 192.A O no hydrogen 3.132 N/A ASN 195.A ND2 PHE 191.A O no hydrogen 2.777 N/A GLN 196.A N ASP 193.A O no hydrogen 3.414 N/A LYS 198.A N ASN 195.A O no hydrogen 2.919 N/A LYS 198.A NZ ASN 195.A OD1 no hydrogen 2.870 N/A GLY 200.A N PHE 203.A O no hydrogen 3.011 N/A LYS 201.A N LYS 198.A O no hydrogen 2.905 N/A PHE 203.A N LYS 198.A O no hydrogen 2.987 N/A ILE 204.A N TYR 168.A O no hydrogen 2.809 N/A LEU 206.A N GLY 170.A O no hydrogen 2.803 N/A ASN 208.A ND2 ASP 171.A OD2 no hydrogen 2.797 N/A ASN 210.A N ASN 208.A OD1 no hydrogen 2.918 N/A TYR 211.A N ASN 208.A OD1 no hydrogen 3.337 N/A TYR 211.A OH GLU 57.A OE2 no hydrogen 2.540 N/A GLU 215.A N GLY 212.A O no hydrogen 2.919 N/A GLY 217.A N GLY 213.A O no hydrogen 2.913 N/A LEU 218.A N GLU 215.A O no hydrogen 3.177 N/A TYR 222.A N ALA 219.A O no hydrogen 3.088 N/A TYR 222.A OH GLU 215.A OE2 no hydrogen 2.564 N/A LYS 224.A N GLY 221.A O no hydrogen 3.079 N/A LYS 225.A N GLY 221.A O no hydrogen 3.282 N/A LYS 225.A N TYR 222.A O no hydrogen 3.069 N/A GLY 229.A N ASP 226.A OD2 no hydrogen 3.032 N/A GLN 230.A N ASP 226.A O no hydrogen 3.025 N/A GLN 230.A NE2 TYR 222.A O no hydrogen 3.098 N/A ILE 231.A N THR 227.A O no hydrogen 3.015 N/A LYS 232.A N GLN 228.A O no hydrogen 2.943 N/A LYS 232.A NZ ASP 236.A OD1 no hydrogen 3.468 N/A LYS 232.A NZ ASP 236.A OD2 no hydrogen 2.526 N/A ALA 233.A N GLY 229.A O no hydrogen 3.062 N/A ARG 234.A N GLN 230.A O no hydrogen 2.949 N/A ARG 234.A NE TYR 222.A OH no hydrogen 3.056 N/A ARG 234.A NH1 LEU 6.A O no hydrogen 2.686 N/A ARG 234.A NH1 GLN 9.A OE1 no hydrogen 2.899 N/A ARG 234.A NH2 GLU 215.A OE2 no hydrogen 2.970 N/A LEU 235.A N ILE 231.A O no hydrogen 2.862 N/A ASP 236.A N LYS 232.A O no hydrogen 2.716 N/A ALA 237.A N ALA 233.A O no hydrogen 3.063 N/A ALA 237.A N ARG 234.A O no hydrogen 3.105 N/A VAL 238.A N LEU 235.A O no hydrogen 3.098 N/A TRP 241.A NE1 LYS 244.A O no hydrogen 2.866 N/A LYS 244.A N ASP 242.A OD2 no hydrogen 3.097 N/A