Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3qu4_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 1.A NE GLU 104.A OE1 no hydrogen 3.056 N/A ARG 1.A NH1 GLU 104.A OE1 no hydrogen 2.885 N/A ARG 1.A NH1 GLU 104.A OE2 no hydrogen 2.912 N/A ARG 1.A NH1 TRP 218.A O no hydrogen 3.565 N/A ARG 1.A NH2 TRP 218.A O no hydrogen 2.851 N/A ARG 1.A NH2 ILE 221.A O no hydrogen 2.591 N/A LYS 3.A NZ ASP 164.A OD1 no hydrogen 3.547 N/A LYS 3.A NZ ASP 164.A OD2 no hydrogen 3.150 N/A LYS 5.A N GLU 165.A O no hydrogen 2.885 N/A ALA 6.A N GLU 165.A O no hydrogen 3.189 N/A VAL 7.A N THR 107.A O no hydrogen 2.987 N/A LEU 8.A N VAL 167.A O no hydrogen 2.836 N/A PHE 9.A N MET 109.A O no hydrogen 2.774 N/A ASP 10.A N ILE 169.A O no hydrogen 3.211 N/A GLY 13.A N PHE 16.A O no hydrogen 2.871 N/A VAL 14.A N MET 11.A O no hydrogen 3.051 N/A LEU 15.A N MET 11.A O no hydrogen 2.779 N/A PHE 16.A N MET 11.A O no hydrogen 3.379 N/A ASN 17.A N GLU 89.A O no hydrogen 2.826 N/A SER 18.A N PHE 16.A O no hydrogen 2.970 N/A TYR 21.A N SER 18.A O no hydrogen 2.974 N/A TYR 21.A OH PRO 86.A O no hydrogen 2.991 N/A HIS 22.A N SER 18.A O no hydrogen 2.965 N/A SER 23.A N MET 19.A O no hydrogen 3.027 N/A SER 23.A OG MET 19.A O no hydrogen 2.904 N/A ALA 25.A N TYR 21.A O no hydrogen 3.012 N/A TRP 26.A N HIS 22.A O no hydrogen 3.068 N/A HIS 27.A N SER 23.A O no hydrogen 3.243 N/A HIS 27.A ND1 LEU 37.A O no hydrogen 2.961 N/A GLN 28.A N GLU 24.A O no hydrogen 2.921 N/A GLN 28.A NE2 GLU 24.A OE2 no hydrogen 3.073 N/A VAL 29.A N ALA 25.A O no hydrogen 2.977 N/A MET 30.A N TRP 26.A O no hydrogen 3.307 N/A LYS 31.A N HIS 27.A O no hydrogen 3.043 N/A THR 32.A N GLN 28.A O no hydrogen 3.141 N/A THR 32.A OG1 GLN 28.A O no hydrogen 2.844 N/A HIS 33.A N VAL 29.A O no hydrogen 3.358 N/A HIS 33.A N MET 30.A O no hydrogen 2.915 N/A HIS 33.A NE2 GLU 77.A OE1 no hydrogen 2.425 N/A GLY 34.A N LYS 31.A O no hydrogen 3.344 N/A LEU 35.A N MET 30.A O no hydrogen 2.809 N/A ASP 36.A N GLU 61.A OE1 no hydrogen 3.043 N/A SER 38.A N GLU 41.A OE1 no hydrogen 3.016 N/A ARG 39.A NE GLU 24.A OE1 no hydrogen 2.480 N/A ARG 39.A NH2 GLU 24.A OE2 no hydrogen 3.436 N/A GLU 41.A N SER 38.A OG no hydrogen 3.119 N/A ALA 42.A N SER 38.A O no hydrogen 2.839 N/A TYR 43.A N ARG 39.A O no hydrogen 2.925 N/A MET 44.A N GLU 40.A O no hydrogen 2.858 N/A HIS 45.A N GLU 41.A O no hydrogen 3.012 N/A HIS 45.A N ALA 42.A O no hydrogen 3.063 N/A GLU 46.A N TYR 43.A O no hydrogen 3.291 N/A ARG 48.A N HIS 45.A O no hydrogen 3.349 N/A ARG 48.A NE HIS 45.A ND1 no hydrogen 3.007 N/A ARG 48.A NH1 SER 52.A OG no hydrogen 3.072 N/A SER 52.A N THR 49.A O no hydrogen 2.986 N/A SER 52.A N THR 49.A OG1 no hydrogen 3.129 N/A THR 53.A N THR 49.A O no hydrogen 3.137 N/A ILE 54.A N GLY 50.A O no hydrogen 3.045 N/A ASN 55.A N ALA 51.A O no hydrogen 3.363 N/A ASN 55.A ND2 ALA 51.A O no hydrogen 2.861 N/A ILE 56.A N SER 52.A O no hydrogen 3.036 N/A VAL 57.A N THR 53.A O no hydrogen 3.188 N/A PHE 58.A N ILE 54.A O no hydrogen 2.866 N/A GLN 59.A N ASN 55.A O no hydrogen 2.864 N/A ARG 60.A N ILE 56.A O no hydrogen 3.189 N/A GLU 61.A N VAL 57.A O no hydrogen 3.160 N/A LEU 62.A N PHE 58.A O no hydrogen 2.883 N/A ALA 66.A N ASN 55.A OD1 no hydrogen 3.103 N/A THR 67.A N GLU 70.A OE1 no hydrogen 3.315 N/A GLU 70.A N THR 67.A OG1 no hydrogen 3.388 N/A ILE 71.A N THR 67.A O no hydrogen 2.878 N/A GLU 72.A N GLN 68.A O no hydrogen 3.231 N/A SER 73.A N GLU 69.A O no hydrogen 3.191 N/A SER 73.A OG.A GLU 69.A O no hydrogen 3.107 N/A SER 73.A OG.B GLU 69.A O no hydrogen 2.875 N/A SER 73.A OG.B GLU 70.A O no hydrogen 3.203 N/A ILE 74.A N GLU 70.A O no hydrogen 3.222 N/A TYR 75.A N ILE 71.A O no hydrogen 2.837 N/A HIS 76.A N GLU 72.A O no hydrogen 2.914 N/A GLU 77.A N SER 73.A O no hydrogen 2.968 N/A LYS 78.A N ILE 74.A O no hydrogen 2.918 N/A LYS 78.A NZ HIS 22.A ND1 no hydrogen 2.935 N/A SER 79.A N TYR 75.A O no hydrogen 2.904 N/A SER 79.A OG.B TYR 75.A O no hydrogen 2.842 N/A ILE 80.A N HIS 76.A O no hydrogen 2.999 N/A LEU 81.A N GLU 77.A O no hydrogen 3.211 N/A PHE 82.A N LYS 78.A O no hydrogen 3.022 N/A ASN 83.A N SER 79.A O no hydrogen 2.905 N/A SER 84.A N ILE 80.A O no hydrogen 3.107 N/A SER 84.A N LEU 81.A O no hydrogen 3.353 N/A SER 84.A OG LEU 81.A O no hydrogen 2.757 N/A TYR 85.A N PHE 82.A O no hydrogen 3.164 N/A ARG 90.A NH1 ASN 126.A OD1 no hydrogen 2.674 N/A MET 91.A N LEU 15.A O no hydrogen 2.821 N/A ALA 94.A N MET 91.A O no hydrogen 3.066 N/A GLU 96.A N GLU 96.A OE2 no hydrogen 2.846 N/A LEU 97.A N GLY 93.A O no hydrogen 2.790 N/A LEU 98.A N ALA 94.A O no hydrogen 2.854 N/A GLN 99.A N TRP 95.A O no hydrogen 3.004 N/A LYS 100.A N GLU 96.A O no hydrogen 3.220 N/A LYS 100.A NZ CYS 215.A O no hydrogen 2.960 N/A VAL 101.A N LEU 97.A O no hydrogen 2.834 N/A LYS 102.A N LEU 98.A O no hydrogen 2.931 N/A LYS 102.A NZ GLY 129.A O no hydrogen 3.087 N/A SER 103.A N GLN 99.A O no hydrogen 3.001 N/A SER 103.A OG.A GLN 99.A O no hydrogen 2.738 N/A SER 103.A OG.B GLN 99.A O no hydrogen 3.047 N/A SER 103.A OG.B LYS 100.A O no hydrogen 2.833 N/A GLU 104.A N LYS 100.A O no hydrogen 2.950 N/A GLY 105.A N LYS 102.A O no hydrogen 2.832 N/A LEU 106.A N VAL 101.A O no hydrogen 3.052 N/A THR 107.A N LYS 5.A O no hydrogen 2.853 N/A THR 107.A OG1 LYS 5.A O no hydrogen 3.551 N/A MET 109.A N VAL 7.A O no hydrogen 2.840 N/A VAL 111.A N PHE 9.A O no hydrogen 2.715 N/A THR 112.A N VAL 137.A O no hydrogen 2.851 N/A SER 114.A N THR 112.A OG1 no hydrogen 3.077 N/A GLN 116.A N SER 114.A OG no hydrogen 3.208 N/A GLN 116.A NE2 SER 114.A OG no hydrogen 2.691 N/A ARG 122.A N SER 118.A O no hydrogen 3.355 N/A ARG 122.A NH1 ALA 88.A O no hydrogen 2.816 N/A LEU 123.A N LEU 119.A O no hydrogen 2.845 N/A GLU 124.A N LEU 120.A O no hydrogen 2.747 N/A HIS 125.A N GLU 121.A O no hydrogen 2.771 N/A ASN 126.A N ARG 122.A O no hydrogen 3.072 N/A ASN 126.A ND2 ARG 122.A O no hydrogen 2.803 N/A PHE 127.A N LEU 123.A O no hydrogen 2.873 N/A GLY 129.A N GLU 124.A OE2 no hydrogen 2.945 N/A MET 130.A N PHE 127.A O no hydrogen 3.319 N/A LEU 135.A N HIS 132.A O no hydrogen 2.985 N/A VAL 137.A N VAL 110.A O no hydrogen 2.971 N/A THR 138.A N ASP 141.A OD2 no hydrogen 3.098 N/A ALA 139.A N SER 114.A O no hydrogen 3.183 N/A ASP 141.A N THR 138.A O no hydrogen 3.060 N/A TYR 144.A N GLU 150.A OE1 no hydrogen 3.238 N/A LYS 146.A N GLY 47.A O no hydrogen 2.835 N/A ASN 148.A N GLY 145.A O no hydrogen 3.085 N/A GLU 150.A N ASN 148.A OD1 no hydrogen 2.983 N/A TYR 152.A OH GLU 170.A OE2 no hydrogen 2.494 N/A LEU 153.A N PRO 149.A O no hydrogen 3.129 N/A MET 154.A N GLU 150.A O no hydrogen 2.845 N/A ALA 155.A N PRO 151.A O no hydrogen 3.016 N/A LEU 156.A N TYR 152.A O no hydrogen 3.082 N/A LYS 157.A N LEU 153.A O no hydrogen 3.090 N/A LYS 158.A N MET 154.A O no hydrogen 2.911 N/A LYS 158.A NZ ASP 141.A OD1 no hydrogen 3.094 N/A GLY 159.A N ALA 155.A O no hydrogen 3.166 N/A GLY 160.A N LYS 157.A O no hydrogen 3.292 N/A LEU 161.A N LEU 156.A O no hydrogen 2.809 N/A LYS 162.A N GLU 165.A OE1 no hydrogen 3.040 N/A GLU 165.A N LYS 162.A O no hydrogen 3.405 N/A VAL 167.A N ALA 6.A O no hydrogen 3.325 N/A VAL 168.A N PHE 185.A O no hydrogen 2.905 N/A ILE 169.A N LEU 8.A O no hydrogen 3.000 N/A GLU 170.A N ILE 187.A O no hydrogen 2.935 N/A ASN 171.A N GLU 170.A OE1 no hydrogen 3.092 N/A ASN 171.A ND2 GLU 46.A OE1 no hydrogen 3.436 N/A ASN 171.A ND2 GLU 46.A OE2 no hydrogen 2.684 N/A ASN 171.A ND2 THR 191.A OG1 no hydrogen 3.355 N/A VAL 176.A N ALA 172.A O no hydrogen 2.831 N/A GLU 177.A N PRO 173.A O no hydrogen 3.015 N/A ALA 178.A N LEU 174.A O no hydrogen 3.047 N/A GLY 179.A N GLY 175.A O no hydrogen 3.086 N/A HIS 180.A N VAL 176.A O no hydrogen 2.932 N/A LYS 181.A N GLU 177.A O no hydrogen 2.840 N/A LYS 181.A NZ.B GLU 177.A OE2 no hydrogen 2.800 N/A ALA 182.A N ALA 178.A O no hydrogen 3.123 N/A GLY 183.A N HIS 180.A O no hydrogen 3.010 N/A ILE 184.A N GLY 179.A O no hydrogen 3.180 N/A THR 186.A N ASP 205.A OD2 no hydrogen 2.893 N/A THR 186.A OG1 ILE 184.A O no hydrogen 2.963 N/A ILE 187.A N VAL 168.A O no hydrogen 2.737 N/A ALA 188.A N LEU 206.A O no hydrogen 2.990 N/A VAL 189.A N GLU 170.A O no hydrogen 2.734 N/A ASN 190.A N PHE 208.A O no hydrogen 2.851 N/A ASN 190.A ND2 LEU 194.A O no hydrogen 3.065 N/A THR 191.A OG1 GLY 13.A O no hydrogen 2.742 N/A GLN 197.A NE2 GLN 197.A O no hydrogen 3.605 N/A GLN 197.A NE2 ASP 201.A OD1 no hydrogen 3.230 N/A VAL 198.A N ASP 195.A O no hydrogen 2.929 N/A LEU 199.A N GLY 196.A O no hydrogen 3.154 N/A LEU 200.A N GLY 196.A O no hydrogen 3.195 N/A ASP 201.A N GLN 197.A O no hydrogen 2.850 N/A ALA 202.A N VAL 198.A O no hydrogen 3.253 N/A GLY 203.A N LEU 200.A O no hydrogen 3.176 N/A ALA 204.A N LEU 199.A O no hydrogen 3.180 N/A ASP 205.A N THR 186.A O no hydrogen 2.923 N/A PHE 208.A N ALA 188.A O no hydrogen 2.954 N/A SER 210.A N THR 213.A OG1 no hydrogen 3.098 N/A SER 210.A OG THR 213.A OG1 no hydrogen 3.167 N/A GLN 212.A NE2 GLU 96.A OE1 no hydrogen 2.790 N/A THR 213.A N SER 210.A OG no hydrogen 3.252 N/A THR 213.A OG1 SER 210.A O no hydrogen 2.544 N/A THR 213.A OG1 SER 210.A OG no hydrogen 3.167 N/A LEU 214.A N SER 210.A O no hydrogen 3.243 N/A CYS 215.A N MET 211.A O no hydrogen 3.040 N/A ASP 216.A N GLN 212.A O no hydrogen 2.835 N/A SER 217.A N THR 213.A O no hydrogen 2.911 N/A SER 217.A OG THR 213.A O no hydrogen 2.982 N/A TRP 218.A N CYS 215.A O no hydrogen 3.312 N/A TRP 218.A NE1 GLU 104.A OE2 no hydrogen 2.820 N/A THR 220.A N SER 217.A O no hydrogen 3.088 N/A THR 220.A OG1 SER 217.A O no hydrogen 2.837 N/A ILE 221.A N TRP 218.A O no hydrogen 3.319 N/A