Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1qqe_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 5.A N ASP 3.A OD1 no hydrogen 3.033 N/A LEU 7.A N ASP 3.A O no hydrogen 2.814 N/A LEU 8.A N PRO 4.A O no hydrogen 2.687 N/A LYS 9.A N VAL 5.A O no hydrogen 2.874 N/A ARG 10.A N GLU 6.A O no hydrogen 2.726 N/A ARG 10.A NE GLU 6.A OE2 no hydrogen 2.914 N/A ALA 11.A N LEU 7.A O no hydrogen 2.792 N/A GLU 12.A N LEU 8.A O no hydrogen 3.140 N/A GLU 12.A N LYS 9.A O no hydrogen 3.271 N/A LYS 13.A N LYS 9.A O no hydrogen 3.373 N/A LYS 14.A N ARG 10.A O no hydrogen 2.941 N/A LYS 14.A NZ GLU 35.A OE2 no hydrogen 2.809 N/A GLY 15.A N ALA 11.A O no hydrogen 3.234 N/A VAL 16.A N LYS 14.A O no hydrogen 2.456 N/A SER 18.A OG ASP 29.A OD1 no hydrogen 2.602 N/A LEU 24.A N GLY 20.A O no hydrogen 3.103 N/A PHE 25.A N PHE 21.A O no hydrogen 2.673 N/A SER 26.A N MET 22.A O no hydrogen 2.718 N/A SER 26.A OG MET 22.A O no hydrogen 2.792 N/A SER 30.A OG ALA 70.A O no hydrogen 3.414 N/A LYS 32.A N ASP 29.A O no hydrogen 2.461 N/A LYS 32.A NZ SER 18.A OG no hydrogen 3.030 N/A LYS 32.A NZ GLY 27.A O no hydrogen 2.550 N/A LYS 32.A NZ SER 28.A O no hydrogen 2.834 N/A LYS 32.A NZ ASP 29.A OD1 no hydrogen 3.050 N/A PHE 33.A N ASP 29.A O no hydrogen 3.006 N/A GLU 34.A N SER 30.A O no hydrogen 2.839 N/A GLU 35.A N TYR 31.A O no hydrogen 3.128 N/A ALA 36.A N LYS 32.A O no hydrogen 2.746 N/A ALA 37.A N PHE 33.A O no hydrogen 2.681 N/A ASP 38.A N GLU 34.A O no hydrogen 2.683 N/A LEU 39.A N GLU 35.A O no hydrogen 3.229 N/A LEU 39.A N ALA 36.A O no hydrogen 2.746 N/A CYS 40.A N ALA 36.A O no hydrogen 3.014 N/A CYS 40.A SG ALA 36.A O no hydrogen 3.597 N/A VAL 41.A N ALA 37.A O no hydrogen 2.973 N/A GLN 42.A N ASP 38.A O no hydrogen 3.189 N/A ALA 43.A N LEU 39.A O no hydrogen 3.022 N/A ALA 44.A N CYS 40.A O no hydrogen 2.515 N/A THR 45.A N VAL 41.A O no hydrogen 2.853 N/A THR 45.A OG1 VAL 41.A O no hydrogen 3.473 N/A ILE 46.A N GLN 42.A O no hydrogen 3.231 N/A TYR 47.A N ALA 43.A O no hydrogen 2.840 N/A ARG 48.A N ALA 44.A O no hydrogen 2.696 N/A ARG 48.A NH1 GLU 82.A OE1 no hydrogen 2.922 N/A LEU 49.A N THR 45.A O no hydrogen 2.819 N/A ARG 50.A N ILE 46.A O no hydrogen 2.912 N/A LYS 51.A N ARG 48.A O no hydrogen 2.803 N/A GLU 52.A N TYR 47.A O no hydrogen 2.981 N/A LEU 55.A N GLU 52.A O no hydrogen 2.832 N/A GLY 57.A N LEU 53.A O no hydrogen 2.586 N/A ASP 58.A N ASN 54.A O no hydrogen 2.880 N/A SER 59.A N LEU 55.A O no hydrogen 2.858 N/A SER 59.A OG LEU 55.A O no hydrogen 2.347 N/A PHE 60.A N ALA 56.A O no hydrogen 2.816 N/A LEU 61.A N GLY 57.A O no hydrogen 2.966 N/A LYS 62.A N ASP 58.A O no hydrogen 3.485 N/A LYS 62.A NZ ASP 58.A O no hydrogen 3.402 N/A ALA 63.A N SER 59.A O no hydrogen 3.044 N/A ALA 64.A N PHE 60.A O no hydrogen 2.621 N/A ASP 65.A N LEU 61.A O no hydrogen 2.903 N/A TYR 66.A N LYS 62.A O no hydrogen 2.843 N/A GLN 67.A N ALA 63.A O no hydrogen 2.749 N/A LYS 68.A N ALA 64.A O no hydrogen 2.948 N/A LYS 68.A NZ TYR 80.A OH no hydrogen 2.667 N/A LYS 69.A N ASP 65.A O no hydrogen 3.073 N/A ALA 70.A N TYR 66.A O no hydrogen 2.941 N/A GLY 71.A N LYS 68.A O no hydrogen 2.921 N/A ASN 72.A N GLN 67.A O no hydrogen 3.044 N/A ALA 76.A N ASN 72.A O no hydrogen 2.864 N/A GLY 77.A N GLU 73.A O no hydrogen 3.117 N/A ASN 78.A N ASP 74.A O no hydrogen 2.972 N/A ASN 78.A ND2 ASP 74.A O no hydrogen 2.384 N/A THR 79.A N GLU 75.A O no hydrogen 3.131 N/A THR 79.A OG1 GLN 67.A OE1 no hydrogen 2.860 N/A THR 79.A OG1 GLU 75.A O no hydrogen 2.779 N/A TYR 80.A N ALA 76.A O no hydrogen 2.936 N/A VAL 81.A N GLY 77.A O no hydrogen 2.860 N/A GLU 82.A N ASN 78.A O no hydrogen 3.303 N/A ALA 83.A N THR 79.A O no hydrogen 2.875 N/A TYR 84.A N TYR 80.A O no hydrogen 2.778 N/A TYR 84.A OH GLU 122.A OE1 no hydrogen 2.449 N/A LYS 85.A N VAL 81.A O no hydrogen 2.740 N/A LYS 85.A NZ GLU 82.A OE2 no hydrogen 3.255 N/A CYS 86.A N GLU 82.A O no hydrogen 3.270 N/A CYS 86.A SG GLU 82.A O no hydrogen 3.602 N/A PHE 87.A N ALA 83.A O no hydrogen 2.933 N/A LYS 88.A N TYR 84.A O no hydrogen 2.705 N/A LYS 88.A NZ TYR 84.A OH no hydrogen 3.181 N/A LYS 88.A NZ GLU 122.A OE1 no hydrogen 3.493 N/A SER 89.A N LYS 85.A O no hydrogen 2.900 N/A GLY 90.A N CYS 86.A O no hydrogen 2.705 N/A GLY 91.A N LYS 88.A O no hydrogen 2.466 N/A ASN 92.A N PHE 87.A O no hydrogen 2.814 N/A ASN 92.A ND2 ASN 54.A OD1 no hydrogen 3.417 N/A SER 93.A OG ASP 130.A OD2 no hydrogen 3.263 N/A ASN 95.A N ASN 92.A OD1 no hydrogen 2.782 N/A ALA 96.A N ASN 92.A O no hydrogen 2.888 N/A VAL 97.A N SER 93.A O no hydrogen 2.848 N/A VAL 97.A N VAL 94.A O no hydrogen 3.155 N/A ASP 98.A N VAL 94.A O no hydrogen 3.159 N/A SER 99.A N ASN 95.A O no hydrogen 2.915 N/A SER 99.A OG ASN 95.A O no hydrogen 3.068 N/A LEU 100.A N ALA 96.A O no hydrogen 3.250 N/A GLU 101.A N VAL 97.A O no hydrogen 3.046 N/A ASN 102.A N ASP 98.A O no hydrogen 3.186 N/A ASN 102.A N SER 99.A O no hydrogen 3.097 N/A ASN 102.A ND2 ASP 98.A OD2 no hydrogen 3.196 N/A ASN 102.A ND2 SER 99.A O no hydrogen 3.350 N/A ALA 103.A N SER 99.A O no hydrogen 3.235 N/A ILE 104.A N LEU 100.A O no hydrogen 2.832 N/A GLN 105.A N GLU 101.A O no hydrogen 3.036 N/A ILE 106.A N ASN 102.A O no hydrogen 2.789 N/A PHE 107.A N ALA 103.A O no hydrogen 2.653 N/A THR 108.A N ILE 104.A O no hydrogen 2.751 N/A HIS 109.A N GLN 105.A O no hydrogen 3.093 N/A ARG 110.A N ILE 106.A O no hydrogen 2.730 N/A GLY 111.A N THR 108.A O no hydrogen 2.805 N/A PHE 113.A N GLY 111.A O no hydrogen 2.886 N/A ARG 115.A NH1 ASN 78.A OD1 no hydrogen 3.161 N/A ARG 115.A NH2 ASN 78.A OD1 no hydrogen 2.813 N/A GLY 116.A N GLN 112.A O no hydrogen 2.902 N/A ALA 117.A N PHE 113.A O no hydrogen 2.788 N/A ASN 118.A N ARG 114.A O no hydrogen 3.187 N/A PHE 119.A N ARG 115.A O no hydrogen 3.364 N/A PHE 119.A N GLY 116.A O no hydrogen 2.686 N/A LYS 120.A N GLY 116.A O no hydrogen 2.811 N/A PHE 121.A N ALA 117.A O no hydrogen 2.802 N/A GLU 122.A N ASN 118.A O no hydrogen 3.482 N/A LEU 123.A N PHE 119.A O no hydrogen 2.761 N/A GLY 124.A N LYS 120.A O no hydrogen 2.893 N/A GLU 125.A N PHE 121.A O no hydrogen 2.772 N/A ILE 126.A N GLU 122.A O no hydrogen 2.851 N/A LEU 127.A N LEU 123.A O no hydrogen 2.781 N/A GLU 128.A N GLY 124.A O no hydrogen 2.632 N/A ASN 129.A N GLU 125.A O no hydrogen 2.723 N/A ASN 129.A ND2 GLU 128.A OE1 no hydrogen 2.759 N/A ASP 130.A N ILE 126.A O no hydrogen 2.816 N/A ASP 133.A N LEU 127.A O no hydrogen 3.023 N/A LYS 136.A N ASP 133.A O no hydrogen 2.809 N/A LYS 136.A NZ GLU 101.A OE2 no hydrogen 3.154 N/A ALA 137.A N ASP 133.A O no hydrogen 2.808 N/A ILE 138.A N TYR 134.A O no hydrogen 2.983 N/A CYS 140.A N LYS 136.A O no hydrogen 3.296 N/A CYS 140.A SG LYS 136.A O no hydrogen 3.710 N/A TYR 141.A N ALA 137.A O no hydrogen 2.934 N/A TYR 141.A OH GLU 128.A OE1 no hydrogen 3.221 N/A LEU 143.A N ASP 139.A O no hydrogen 3.091 N/A ALA 144.A N CYS 140.A O no hydrogen 2.665 N/A GLU 146.A N GLU 142.A O no hydrogen 2.765 N/A TRP 147.A N LEU 143.A O no hydrogen 3.332 N/A TYR 148.A N ALA 144.A O no hydrogen 3.245 N/A TYR 148.A OH ASN 118.A OD1 no hydrogen 2.864 N/A ALA 149.A N GLY 145.A O no hydrogen 3.269 N/A ALA 149.A N GLU 146.A O no hydrogen 3.061 N/A ASP 151.A N TRP 147.A O no hydrogen 3.091 N/A GLN 152.A N ALA 149.A O no hydrogen 2.505 N/A SER 153.A N TYR 148.A O no hydrogen 2.962 N/A SER 153.A OG TYR 148.A O no hydrogen 3.161 N/A SER 157.A N SER 153.A O no hydrogen 3.395 N/A SER 157.A OG GLY 145.A O no hydrogen 2.627 N/A ASN 158.A N VAL 154.A O no hydrogen 3.044 N/A LYS 159.A N ALA 155.A O no hydrogen 3.360 N/A CYS 160.A N LEU 156.A O no hydrogen 3.139 N/A CYS 160.A N SER 157.A O no hydrogen 3.282 N/A CYS 160.A SG LEU 156.A O no hydrogen 3.991 N/A PHE 161.A N SER 157.A O no hydrogen 3.173 N/A ILE 162.A N ASN 158.A O no hydrogen 2.928 N/A LYS 163.A N LYS 159.A O no hydrogen 3.479 N/A LYS 163.A NZ GLU 128.A OE1 no hydrogen 3.243 N/A LYS 163.A NZ TYR 141.A OH no hydrogen 2.647 N/A CYS 164.A N CYS 160.A O no hydrogen 2.691 N/A CYS 164.A SG GLU 142.A OE1 no hydrogen 3.859 N/A ALA 165.A N PHE 161.A O no hydrogen 2.488 N/A ASP 166.A N ILE 162.A O no hydrogen 2.805 N/A LYS 168.A N CYS 164.A O no hydrogen 3.204 N/A LYS 168.A N ALA 165.A O no hydrogen 2.793 N/A LYS 168.A NZ GLN 173.A OE1 no hydrogen 2.807 N/A LYS 168.A NZ GLU 176.A OE1 no hydrogen 2.948 N/A ALA 169.A N ALA 165.A O no hydrogen 3.115 N/A ASP 171.A N LEU 167.A O no hydrogen 3.429 N/A GLY 172.A N ALA 169.A O no hydrogen 3.280 N/A GLN 173.A N LYS 168.A O no hydrogen 2.828 N/A ALA 177.A N GLN 173.A O no hydrogen 3.203 N/A SER 178.A N TYR 174.A O no hydrogen 3.188 N/A SER 178.A OG ILE 175.A O no hydrogen 2.844 N/A SER 178.A OG ASP 179.A OD1 no hydrogen 3.396 N/A ASP 179.A N ILE 175.A O no hydrogen 2.776 N/A ASP 179.A N GLU 176.A O no hydrogen 3.065 N/A ILE 180.A N GLU 176.A O no hydrogen 2.919 N/A TYR 181.A N ALA 177.A O no hydrogen 2.732 N/A TYR 181.A OH ASP 166.A OD1 no hydrogen 2.620 N/A SER 182.A N SER 178.A O no hydrogen 3.083 N/A SER 182.A OG SER 178.A O no hydrogen 2.801 N/A LYS 183.A N ASP 179.A O no hydrogen 2.889 N/A LEU 184.A N ILE 180.A O no hydrogen 2.916 N/A ILE 185.A N SER 182.A O no hydrogen 2.788 N/A LYS 186.A N SER 182.A O no hydrogen 2.994 N/A SER 187.A N LYS 183.A O no hydrogen 2.943 N/A SER 187.A OG LYS 183.A O no hydrogen 3.048 N/A SER 194.A N ASN 191.A O no hydrogen 2.965 N/A SER 194.A OG ASN 191.A O no hydrogen 3.531 N/A SER 197.A N SER 194.A O no hydrogen 2.819 N/A LEU 198.A N GLN 195.A O no hydrogen 3.270 N/A LYS 199.A NZ GLU 228.A OE1 no hydrogen 2.540 N/A LEU 203.A N LYS 199.A O no hydrogen 2.976 N/A LYS 204.A N ASP 200.A O no hydrogen 2.725 N/A LYS 204.A NZ ASP 166.A OD1 no hydrogen 3.432 N/A LYS 205.A N TYR 201.A O no hydrogen 2.635 N/A LYS 205.A NZ SER 182.A OG no hydrogen 2.809 N/A GLY 206.A N PHE 202.A O no hydrogen 2.819 N/A LEU 207.A N LEU 203.A O no hydrogen 2.742 N/A CYS 208.A N LYS 204.A O no hydrogen 3.111 N/A CYS 208.A SG LYS 204.A O no hydrogen 3.449 N/A GLN 209.A N LYS 205.A O no hydrogen 3.125 N/A LEU 210.A N GLY 206.A O no hydrogen 2.821 N/A ALA 211.A N LEU 207.A O no hydrogen 2.922 N/A ALA 212.A N CYS 208.A O no hydrogen 3.140 N/A ALA 212.A N GLN 209.A O no hydrogen 2.979 N/A THR 213.A N LEU 210.A O no hydrogen 2.696 N/A THR 213.A OG1 ALA 212.A O no hydrogen 2.556 N/A ASP 214.A N GLN 209.A O no hydrogen 3.245 N/A ALA 217.A N ASP 214.A OD1 no hydrogen 2.681 N/A ALA 218.A N ASP 214.A O no hydrogen 3.368 N/A ALA 219.A N ALA 215.A O no hydrogen 3.118 N/A ARG 220.A N VAL 216.A O no hydrogen 2.729 N/A THR 221.A N ALA 217.A O no hydrogen 2.691 N/A THR 221.A OG1 GLN 209.A OE1 no hydrogen 2.708 N/A THR 221.A OG1 ALA 217.A O no hydrogen 2.683 N/A THR 221.A OG1 ALA 218.A O no hydrogen 2.898 N/A LEU 222.A N ALA 218.A O no hydrogen 2.727 N/A LEU 222.A N ALA 219.A O no hydrogen 3.200 N/A GLN 223.A N ALA 219.A O no hydrogen 3.170 N/A GLU 224.A N ARG 220.A O no hydrogen 3.041 N/A GLY 225.A N LEU 222.A O no hydrogen 3.022 N/A SER 227.A OG GLU 224.A O no hydrogen 3.384 N/A PHE 231.A N GLU 228.A O no hydrogen 2.438 N/A LEU 232.A N GLU 228.A O no hydrogen 3.072 N/A SER 234.A N ASN 230.A O no hydrogen 3.478 N/A LEU 235.A N PHE 231.A O no hydrogen 3.236 N/A LEU 235.A N LEU 232.A O no hydrogen 2.986 N/A ILE 236.A N LEU 232.A O no hydrogen 2.786 N/A ASP 237.A N LYS 233.A O no hydrogen 3.116 N/A ALA 238.A N SER 234.A O no hydrogen 3.255 N/A VAL 239.A N LEU 235.A O no hydrogen 3.076 N/A ASN 240.A N ILE 236.A O no hydrogen 3.405 N/A ASP 243.A N ALA 238.A O no hydrogen 2.964 N/A SER 244.A OG GLU 279.A OE1 no hydrogen 3.384 N/A GLU 245.A N ASP 243.A O no hydrogen 2.481 N/A GLN 246.A N ASP 243.A O no hydrogen 3.086 N/A GLN 246.A N ASP 243.A OD1 no hydrogen 3.245 N/A GLN 246.A NE2 GLU 241.A OE1 no hydrogen 3.244 N/A GLN 246.A NE2 ASP 243.A OD2 no hydrogen 2.784 N/A LEU 247.A N ASP 243.A O no hydrogen 3.451 N/A GLU 249.A N GLN 246.A O no hydrogen 3.050 N/A HIS 250.A N GLN 246.A O no hydrogen 2.831 N/A CYS 251.A N LEU 247.A O no hydrogen 3.157 N/A CYS 251.A SG LEU 247.A O no hydrogen 3.642 N/A GLU 253.A N GLU 249.A O no hydrogen 2.776 N/A PHE 254.A N HIS 250.A O no hydrogen 2.763 N/A ASP 255.A N CYS 251.A O no hydrogen 2.932 N/A ASN 256.A N GLU 253.A O no hydrogen 2.612 N/A LEU 260.A N ASP 255.A OD2 no hydrogen 2.547 N/A TRP 263.A NE1 ASP 166.A O no hydrogen 2.622 N/A LYS 264.A NZ ASP 200.A OD2 no hydrogen 3.162 N/A ILE 265.A N ASP 261.A O no hydrogen 3.263 N/A THR 266.A N LYS 262.A O no hydrogen 2.860 N/A THR 266.A OG1 LYS 262.A O no hydrogen 3.037 N/A ILE 267.A N TRP 263.A O no hydrogen 2.929 N/A LEU 268.A N LYS 264.A O no hydrogen 2.620 N/A ASN 269.A N ILE 265.A O no hydrogen 2.944 N/A ASN 269.A N THR 266.A O no hydrogen 2.765 N/A LYS 270.A N THR 266.A O no hydrogen 3.015 N/A ILE 271.A N ILE 267.A O no hydrogen 3.170 N/A ILE 271.A N LEU 268.A O no hydrogen 3.170 N/A LYS 272.A N LEU 268.A O no hydrogen 2.943 N/A LYS 272.A NZ SER 248.A OG no hydrogen 3.191 N/A GLU 273.A N ASN 269.A O no hydrogen 3.003 N/A SER 274.A N LYS 270.A O no hydrogen 3.369 N/A SER 274.A OG ILE 271.A O no hydrogen 2.695 N/A ILE 275.A N ILE 271.A O no hydrogen 3.236 N/A ILE 275.A N LYS 272.A O no hydrogen 3.106 N/A GLN 276.A N LYS 272.A O no hydrogen 3.282 N/A GLN 277.A N GLU 273.A O no hydrogen 2.935 N/A GLN 277.A NE2 ASP 281.A OD2 no hydrogen 2.933 N/A GLN 278.A N ILE 275.A O no hydrogen 2.842 N/A GLU 279.A N ILE 275.A O no hydrogen 2.958 N/A GLU 279.A N GLN 276.A O no hydrogen 2.735 N/A ASP 280.A N GLN 276.A O no hydrogen 2.902 N/A