Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3qpb_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 4.A N ILE 9.A O no hydrogen 2.814 N/A HIS 6.A ND1 GLU 76.A OE2 no hydrogen 2.777 N/A LEU 7.A N GLU 76.A OE1 no hydrogen 2.886 N/A GLN 8.A N GLN 4.A O no hydrogen 2.775 N/A GLN 8.A NE2 TYR 5.A O no hydrogen 2.843 N/A ARG 10.A N ASP 13.A OD2 no hydrogen 2.791 N/A ASP 13.A N ARG 10.A O no hydrogen 2.939 N/A GLY 15.A N SER 59.A OG no hydrogen 3.004 N/A ARG 16.A NE ASP 83.A OD1 no hydrogen 2.974 N/A ARG 16.A NE ASP 83.A OD2 no hydrogen 3.478 N/A ARG 16.A NH2 ASP 83.A OD1 no hydrogen 3.428 N/A ARG 16.A NH2 ASP 83.A OD2 no hydrogen 3.406 N/A ARG 16.A NH2 ASP 249.A OD2 no hydrogen 3.430 N/A TYR 17.A OH ASP 249.A OD2 no hydrogen 2.531 N/A VAL 18.A N THR 84.A O no hydrogen 2.879 N/A ILE 19.A N SER 59.A O no hydrogen 2.943 N/A MET 20.A N ILE 86.A O no hydrogen 2.809 N/A LYS 25.A N ASP 23.A OD1 no hydrogen 2.876 N/A ARG 26.A N ASP 23.A O no hydrogen 2.958 N/A ARG 26.A NH1 VAL 88.A O no hydrogen 3.090 N/A CYS 27.A N PRO 24.A O no hydrogen 3.404 N/A CYS 27.A SG VAL 47.A O no hydrogen 3.462 N/A LYS 29.A NZ GLU 232.A OE2 no hydrogen 2.674 N/A ILE 30.A N ARG 26.A O no hydrogen 3.129 N/A ALA 31.A N CYS 27.A O no hydrogen 2.808 N/A GLU 32.A N ALA 28.A O no hydrogen 3.309 N/A HIS 33.A N ILE 30.A O no hydrogen 2.820 N/A PHE 34.A N ALA 31.A O no hydrogen 2.967 N/A ASP 35.A N THR 52.A O no hydrogen 2.801 N/A ASN 36.A ND2 ASN 36.A O no hydrogen 2.927 N/A VAL 38.A N THR 50.A O no hydrogen 2.852 N/A VAL 40.A N THR 48.A O no hydrogen 2.747 N/A ALA 41.A N THR 48.A O no hydrogen 3.324 N/A SER 43.A N TYR 46.A O no hydrogen 2.933 N/A SER 43.A OG HIS 6.A O no hydrogen 2.554 N/A GLU 45.A N GLU 45.A OE2 no hydrogen 2.860 N/A TYR 46.A N SER 43.A O no hydrogen 2.662 N/A TYR 46.A OH SER 69.A O no hydrogen 2.741 N/A VAL 47.A N SER 62.A OG no hydrogen 2.887 N/A THR 48.A N ALA 41.A O no hydrogen 2.868 N/A THR 48.A OG1 THR 61.A OG1 no hydrogen 3.017 N/A TYR 49.A N VAL 60.A O no hydrogen 2.954 N/A THR 50.A N VAL 38.A O no hydrogen 3.015 N/A THR 50.A OG1 ASP 13.A O no hydrogen 2.666 N/A THR 50.A OG1 SER 59.A OG no hydrogen 2.787 N/A GLY 51.A N VAL 58.A O no hydrogen 2.922 N/A THR 52.A N ASP 35.A O no hydrogen 3.026 N/A LEU 53.A N GLU 56.A O no hydrogen 2.802 N/A GLU 56.A N LEU 53.A O no hydrogen 2.903 N/A LYS 57.A NZ GLY 12.A O no hydrogen 2.769 N/A VAL 58.A N GLY 51.A O no hydrogen 2.929 N/A SER 59.A N TYR 17.A O no hydrogen 2.923 N/A SER 59.A OG THR 50.A OG1 no hydrogen 2.787 N/A VAL 60.A N TYR 49.A O no hydrogen 2.918 N/A THR 61.A N ILE 19.A O no hydrogen 3.078 N/A THR 61.A OG1 THR 48.A OG1 no hydrogen 3.017 N/A SER 62.A N VAL 47.A O no hydrogen 3.083 N/A SER 62.A OG GLU 45.A O no hydrogen 2.687 N/A THR 63.A N PRO 21.A O no hydrogen 2.934 N/A THR 63.A OG1 PRO 21.A O no hydrogen 3.536 N/A THR 63.A OG1 GLY 64.A O no hydrogen 2.973 N/A GLY 64.A N GLY 22.A O no hydrogen 2.834 N/A GLY 66.A N GLU 191.A OE2 no hydrogen 2.727 N/A SER 69.A OG THR 63.A O no hydrogen 2.865 N/A SER 69.A OG ILE 65.A O no hydrogen 3.198 N/A SER 69.A OG GLY 66.A O no hydrogen 3.167 N/A ALA 70.A N GLY 66.A O no hydrogen 3.078 N/A SER 71.A N GLY 67.A O no hydrogen 2.835 N/A SER 71.A OG GLY 67.A O no hydrogen 3.128 N/A SER 71.A OG PRO 68.A O no hydrogen 3.073 N/A ILE 72.A N PRO 68.A O no hydrogen 3.434 N/A ALA 73.A N SER 69.A O no hydrogen 3.276 N/A MET 74.A N ALA 70.A O no hydrogen 3.042 N/A GLU 75.A N SER 71.A O no hydrogen 2.918 N/A GLU 76.A N ILE 72.A O no hydrogen 3.026 N/A LEU 77.A N ALA 73.A O no hydrogen 2.865 N/A LYS 78.A N MET 74.A O no hydrogen 2.834 N/A LEU 79.A N GLU 75.A O no hydrogen 3.048 N/A CYS 80.A N GLU 76.A O no hydrogen 3.291 N/A CYS 80.A N LEU 77.A O no hydrogen 2.985 N/A CYS 80.A SG GLU 76.A O no hydrogen 3.524 N/A GLY 81.A N LYS 78.A O no hydrogen 2.994 N/A ALA 82.A N LEU 77.A O no hydrogen 3.028 N/A ASP 83.A N ARG 16.A O no hydrogen 2.904 N/A THR 84.A N ARG 16.A O no hydrogen 3.010 N/A THR 84.A OG1 ASP 83.A OD2 no hydrogen 2.811 N/A PHE 85.A N ARG 205.A O no hydrogen 2.762 N/A ILE 86.A N VAL 18.A O no hydrogen 2.958 N/A ARG 87.A N GLY 207.A O no hydrogen 2.958 N/A ARG 87.A NE GLU 189.A OE1 no hydrogen 2.849 N/A ARG 87.A NH2 GLU 189.A OE1 no hydrogen 2.913 N/A VAL 88.A N MET 20.A O no hydrogen 3.236 N/A GLY 89.A N ASP 209.A O no hydrogen 3.184 N/A CYS 91.A N LEU 211.A O no hydrogen 2.962 N/A CYS 91.A SG LEU 211.A O no hydrogen 3.897 N/A GLY 92.A N SER 188.A O no hydrogen 2.976 N/A GLY 93.A N GLY 214.A O no hydrogen 2.686 N/A ILE 94.A N LYS 186.A O no hydrogen 2.967 N/A GLU 95.A N LYS 186.A O no hydrogen 3.308 N/A ASP 97.A N GLU 95.A OE2 no hydrogen 2.995 N/A VAL 98.A N GLU 95.A O no hydrogen 2.923 N/A LYS 99.A N ASP 102.A OD2 no hydrogen 3.283 N/A GLY 101.A N VAL 212.A O no hydrogen 2.871 N/A ASP 102.A N LYS 99.A O no hydrogen 2.929 N/A ILE 103.A N THR 146.A O no hydrogen 3.006 N/A VAL 104.A N PHE 210.A O no hydrogen 2.994 N/A ILE 105.A N HIS 148.A O no hydrogen 2.831 N/A ALA 106.A N SER 208.A O no hydrogen 2.983 N/A THR 107.A N GLY 150.A O no hydrogen 2.927 N/A ALA 109.A N ALA 126.A O no hydrogen 2.889 N/A ILE 110.A N VAL 152.A O no hydrogen 2.840 N/A ARG 111.A NE SER 116.A OG no hydrogen 2.771 N/A ARG 111.A NH1 PRO 121.A O no hydrogen 2.921 N/A ARG 111.A NH1 PHE 124.A O no hydrogen 2.712 N/A ARG 111.A NH2 SER 116.A OG no hydrogen 3.100 N/A ARG 111.A NH2 ALA 120.A O no hydrogen 2.918 N/A MET 112.A N ILE 110.A O no hydrogen 2.987 N/A GLY 114.A N ASP 156.A OD2 no hydrogen 2.801 N/A SER 116.A N GLU 113.A OE1 no hydrogen 2.935 N/A SER 116.A OG GLU 113.A OE1 no hydrogen 3.303 N/A SER 116.A OG GLU 113.A OE2 no hydrogen 2.473 N/A LYS 117.A N GLY 114.A O no hydrogen 3.135 N/A LYS 117.A NZ ARG 111.A O no hydrogen 3.240 N/A LYS 117.A NZ GLU 113.A O no hydrogen 2.822 N/A GLU 118.A N THR 115.A O no hydrogen 3.000 N/A TYR 119.A N SER 116.A O no hydrogen 2.971 N/A TYR 119.A OH GLU 75.A OE1 no hydrogen 2.620 N/A ALA 120.A N SER 116.A O no hydrogen 2.824 N/A GLU 123.A N GLU 123.A OE2 no hydrogen 2.764 N/A PHE 124.A N PRO 121.A O no hydrogen 3.007 N/A ALA 128.A N THR 107.A O no hydrogen 3.057 N/A ASP 129.A N CYS 206.A O no hydrogen 2.917 N/A VAL 132.A N ASP 129.A OD2 no hydrogen 2.975 N/A THR 133.A N ASP 129.A O no hydrogen 2.996 N/A THR 133.A OG1 ASP 129.A O no hydrogen 2.959 N/A ASN 134.A N LEU 130.A O no hydrogen 2.949 N/A ALA 135.A N GLU 131.A O no hydrogen 3.020 N/A LEU 136.A N VAL 132.A O no hydrogen 2.941 N/A VAL 137.A N THR 133.A O no hydrogen 2.914 N/A ASN 138.A N ASN 134.A O no hydrogen 2.844 N/A ALA 139.A N ALA 135.A O no hydrogen 3.007 N/A ALA 140.A N LEU 136.A O no hydrogen 2.959 N/A LYS 141.A N VAL 137.A O no hydrogen 3.117 N/A LYS 142.A N ASN 138.A O no hydrogen 2.950 N/A LYS 142.A NZ GLU 240.A OE1 no hydrogen 3.332 N/A LEU 143.A N ALA 139.A O no hydrogen 2.880 N/A GLY 144.A N LYS 141.A O no hydrogen 3.206 N/A TYR 145.A N ALA 140.A O no hydrogen 3.050 N/A TYR 145.A OH GLN 236.A OE1 no hydrogen 3.132 N/A HIS 148.A N ILE 103.A O no hydrogen 2.871 N/A HIS 148.A NE2 ASP 102.A OD2 no hydrogen 2.874 N/A GLY 150.A N ILE 105.A O no hydrogen 3.029 N/A VAL 152.A N GLY 108.A O no hydrogen 3.138 N/A GLN 153.A N ALA 187.A O no hydrogen 2.753 N/A CYS 154.A N ILE 110.A O no hydrogen 3.184 N/A CYS 154.A SG GLU 189.A OE2 no hydrogen 3.090 N/A LYS 155.A NZ GLN 161.A OE1 no hydrogen 2.863 N/A LYS 155.A NZ SER 188.A OG no hydrogen 2.845 N/A LYS 155.A NZ GLU 189.A O no hydrogen 3.017 N/A GLY 160.A N ALA 157.A O no hydrogen 2.877 N/A GLN 161.A N PHE 158.A O no hydrogen 2.976 N/A GLN 161.A NE2 GLN 216.A OE1 no hydrogen 2.573 N/A GLU 163.A N TYR 159.A O no hydrogen 2.986 N/A ARG 166.A N GLU 163.A O no hydrogen 3.201 N/A MET 167.A N PRO 164.A O no hydrogen 3.097 N/A SER 170.A N MET 167.A O no hydrogen 2.933 N/A SER 170.A OG MET 167.A O no hydrogen 3.309 N/A GLU 172.A N VAL 169.A O no hydrogen 2.946 N/A LEU 173.A N VAL 169.A O no hydrogen 3.115 N/A LEU 174.A N SER 170.A O no hydrogen 2.819 N/A ASN 175.A N TYR 171.A O no hydrogen 3.108 N/A LYS 176.A N GLU 172.A O no hydrogen 2.977 N/A TRP 177.A N LEU 173.A O no hydrogen 2.906 N/A TRP 177.A NE1 GLU 217.A OE2 no hydrogen 2.944 N/A GLU 178.A N LEU 174.A O no hydrogen 3.135 N/A ALA 179.A N ASN 175.A O no hydrogen 3.118 N/A TRP 180.A N LYS 176.A O no hydrogen 2.880 N/A LYS 181.A N TRP 177.A O no hydrogen 3.141 N/A LYS 181.A NZ GLU 178.A OE2 no hydrogen 3.411 N/A LYS 181.A NZ GLU 217.A OE1 no hydrogen 3.019 N/A ARG 182.A N GLU 178.A O no hydrogen 3.022 N/A ARG 182.A NE GLU 178.A OE1 no hydrogen 2.980 N/A LEU 183.A N TRP 180.A O no hydrogen 3.167 N/A GLY 184.A N LYS 181.A O no hydrogen 3.410 N/A THR 185.A N TRP 180.A O no hydrogen 3.243 N/A THR 185.A OG1 TRP 180.A O no hydrogen 2.687 N/A LYS 186.A N VAL 151.A O no hydrogen 2.873 N/A SER 188.A N GLY 92.A O no hydrogen 2.715 N/A SER 188.A OG GLN 153.A OE1 no hydrogen 2.529 N/A GLU 189.A N GLN 153.A O no hydrogen 2.786 N/A GLU 191.A N GLU 189.A OE1 no hydrogen 3.028 N/A SER 192.A N GLU 189.A OE2 no hydrogen 2.720 N/A SER 192.A OG GLU 189.A OE2 no hydrogen 2.683 N/A SER 192.A OG SER 208.A OG no hydrogen 3.054 N/A LEU 195.A N GLU 191.A O no hydrogen 3.103 N/A PHE 196.A N SER 192.A O no hydrogen 2.736 N/A VAL 197.A N ALA 193.A O no hydrogen 3.156 N/A ALA 198.A N ALA 194.A O no hydrogen 3.026 N/A ALA 199.A N LEU 195.A O no hydrogen 2.923 N/A SER 200.A N PHE 196.A O no hydrogen 3.059 N/A SER 200.A OG PHE 196.A O no hydrogen 3.170 N/A HIS 201.A N VAL 197.A O no hydrogen 3.138 N/A LEU 202.A N ALA 198.A O no hydrogen 2.822 N/A VAL 204.A N ALA 199.A O no hydrogen 3.077 N/A ARG 205.A N ASP 83.A O no hydrogen 3.007 N/A ARG 205.A NE THR 84.A OG1 no hydrogen 3.394 N/A ARG 205.A NH1 GLU 131.A OE1 no hydrogen 2.925 N/A ARG 205.A NH2 THR 84.A OG1 no hydrogen 2.870 N/A ARG 205.A NH2 ASP 249.A OD2 no hydrogen 3.012 N/A CYS 206.A SG PHE 85.A O no hydrogen 3.931 N/A CYS 206.A SG GLY 207.A O no hydrogen 3.840 N/A GLY 207.A N PHE 85.A O no hydrogen 3.004 N/A SER 208.A OG SER 192.A OG no hydrogen 3.054 N/A ASP 209.A N ARG 87.A O no hydrogen 3.005 N/A PHE 210.A N VAL 104.A O no hydrogen 2.762 N/A LEU 211.A N GLY 89.A O no hydrogen 2.839 N/A VAL 212.A N ASP 102.A O no hydrogen 2.970 N/A VAL 213.A N CYS 91.A O no hydrogen 2.961 N/A ASN 215.A N ASN 225.A OD1 no hydrogen 2.823 N/A GLN 216.A NE2 GLN 161.A O no hydrogen 3.510 N/A ARG 218.A NE ASP 224.A O no hydrogen 2.937 N/A ARG 218.A NH1 LEU 96.A O no hydrogen 2.833 N/A ARG 218.A NH2 ASP 224.A O no hydrogen 2.814 N/A ARG 218.A NH2 ASP 224.A OD1 no hydrogen 2.701 N/A ASN 219.A N ASN 215.A O no hydrogen 3.112 N/A ALA 220.A N GLN 216.A O no hydrogen 2.845 N/A LEU 221.A N GLU 217.A O no hydrogen 3.284 N/A LEU 221.A N ARG 218.A O no hydrogen 3.182 N/A GLY 222.A N ASN 219.A O no hydrogen 3.254 N/A MET 223.A N ARG 218.A O no hydrogen 2.852 N/A ALA 228.A N VAL 213.A O no hydrogen 3.056 N/A GLU 232.A N ASP 230.A OD1 no hydrogen 2.945 N/A ILE 235.A N THR 231.A O no hydrogen 2.890 N/A GLN 236.A N GLU 232.A O no hydrogen 2.807 N/A GLN 236.A NE2 GLU 232.A OE1 no hydrogen 3.044 N/A VAL 237.A N ALA 233.A O no hydrogen 3.060 N/A ALA 238.A N ALA 234.A O no hydrogen 3.105 N/A VAL 239.A N ILE 235.A O no hydrogen 2.875 N/A GLU 240.A N GLN 236.A O no hydrogen 2.961 N/A ALA 241.A N VAL 237.A O no hydrogen 2.935 N/A LEU 242.A N ALA 238.A O no hydrogen 2.869 N/A ARG 243.A N VAL 239.A O no hydrogen 2.916 N/A ARG 243.A NE GLU 240.A OE2 no hydrogen 3.028 N/A ARG 243.A NH1 GLU 240.A OE1 no hydrogen 2.982 N/A THR 244.A N GLU 240.A O no hydrogen 3.106 N/A THR 244.A OG1 ALA 241.A O no hydrogen 3.180 N/A LEU 245.A N ALA 241.A O no hydrogen 2.976 N/A ILE 246.A N LEU 242.A O no hydrogen 2.856 N/A GLU 247.A N ARG 243.A O no hydrogen 3.005 N/A ASN 248.A N THR 244.A O no hydrogen 2.958 N/A ASP 249.A N LEU 245.A O no hydrogen 3.026 N/A LYS 250.A N ILE 246.A O no hydrogen 3.149 N/A LYS 250.A N GLU 247.A O no hydrogen 3.180 N/A LYS 250.A NZ ASN 54.A O no hydrogen 3.273 N/A LYS 250.A NZ GLU 247.A OE2 no hydrogen 2.936 N/A