Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2pqk_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 4.A N ASP 1.A OD1 no hydrogen 3.276 N/A TYR 4.A OH ASP 120.A OD2 no hydrogen 3.397 N/A ARG 5.A N ASP 1.A O no hydrogen 3.062 N/A ARG 5.A NE GLU 2.A OE1 no hydrogen 2.799 N/A ARG 5.A NH1 GLU 2.A OE2 no hydrogen 2.940 N/A ARG 5.A NH1 GLU 9.A OE1 no hydrogen 3.464 N/A ARG 5.A NH2 GLU 9.A OE1 no hydrogen 2.997 N/A GLN 6.A N GLU 2.A O no hydrogen 2.729 N/A GLN 6.A NE2 SER 30.A OG no hydrogen 2.949 N/A SER 7.A N LEU 3.A O no hydrogen 2.918 N/A SER 7.A OG LEU 3.A O no hydrogen 2.819 N/A LEU 8.A N TYR 4.A O no hydrogen 2.838 N/A GLU 9.A N ARG 5.A O no hydrogen 3.069 N/A ILE 10.A N GLN 6.A O no hydrogen 3.042 N/A ILE 11.A N SER 7.A O no hydrogen 3.006 N/A SER 12.A N LEU 8.A O no hydrogen 2.759 N/A SER 12.A OG LEU 8.A O no hydrogen 2.677 N/A ARG 13.A N GLU 9.A O no hydrogen 2.923 N/A ARG 13.A NH2 LYS 26.A O no hydrogen 2.677 N/A TYR 14.A N ILE 10.A O no hydrogen 3.043 N/A TYR 14.A OH ASP 42.A OD1 no hydrogen 3.065 N/A LEU 15.A N ILE 11.A O no hydrogen 2.972 N/A ARG 16.A N SER 12.A O no hydrogen 2.773 N/A ARG 16.A NH2 GLU 112.A OE2 no hydrogen 2.848 N/A GLU 17.A N ARG 13.A O no hydrogen 2.952 N/A GLN 18.A N TYR 14.A O no hydrogen 2.879 N/A ALA 19.A N LEU 15.A O no hydrogen 2.838 N/A THR 20.A N ARG 16.A O no hydrogen 2.878 N/A THR 20.A OG1 ARG 16.A O no hydrogen 2.812 N/A THR 20.A OG1 ALA 22.A O no hydrogen 3.499 N/A GLY 21.A N GLU 17.A O no hydrogen 2.765 N/A ARG 31.A N GLY 27.A O no hydrogen 2.946 N/A LYS 32.A N ALA 28.A O no hydrogen 3.019 N/A ALA 33.A N THR 29.A O no hydrogen 2.686 N/A LEU 34.A N SER 30.A O no hydrogen 2.900 N/A GLU 35.A N ARG 31.A O no hydrogen 2.975 N/A THR 36.A N LYS 32.A O no hydrogen 2.956 N/A THR 36.A OG1 LYS 32.A O no hydrogen 2.907 N/A LEU 37.A N ALA 33.A O no hydrogen 2.830 N/A ARG 38.A N LEU 34.A O no hydrogen 2.884 N/A ARG 38.A NE GLU 17.A OE1 no hydrogen 3.352 N/A ARG 38.A NE GLU 17.A OE2 no hydrogen 2.480 N/A ARG 38.A NH2 GLU 17.A OE1 no hydrogen 2.833 N/A ARG 39.A N GLU 35.A O no hydrogen 3.130 N/A ARG 39.A NH1 PHE 143.A O no hydrogen 3.041 N/A ARG 39.A NH2 PHE 143.A O no hydrogen 3.030 N/A VAL 40.A N THR 36.A O no hydrogen 2.797 N/A GLY 41.A N LEU 37.A O no hydrogen 2.656 N/A ASP 42.A N ARG 38.A O no hydrogen 3.105 N/A GLY 43.A N ARG 39.A O no hydrogen 3.094 N/A VAL 44.A N VAL 40.A O no hydrogen 2.885 N/A GLN 45.A N GLY 41.A O no hydrogen 3.378 N/A GLN 45.A NE2 GLY 41.A O no hydrogen 3.653 N/A GLN 45.A NE2 SER 93.A OG no hydrogen 3.113 N/A ARG 46.A N ASP 42.A O no hydrogen 3.374 N/A ARG 46.A N GLY 43.A O no hydrogen 2.969 N/A ASN 47.A N GLU 49.A OE2 no hydrogen 2.820 N/A HIS 48.A ND1 VAL 44.A O no hydrogen 2.763 N/A PHE 52.A N HIS 48.A O no hydrogen 2.805 N/A GLN 53.A N GLU 49.A O no hydrogen 2.892 N/A GLY 54.A N THR 50.A O no hydrogen 2.968 N/A MET 55.A N ALA 51.A O no hydrogen 2.875 N/A LEU 56.A N PHE 52.A O no hydrogen 2.865 N/A ARG 57.A N GLN 53.A O no hydrogen 3.007 N/A LYS 58.A N GLY 54.A O no hydrogen 3.151 N/A LEU 59.A N MET 55.A O no hydrogen 2.832 N/A ASP 60.A N LEU 56.A O no hydrogen 3.222 N/A LYS 62.A N ASP 66.A OD2 no hydrogen 2.960 N/A LYS 62.A NZ ASP 60.A O no hydrogen 2.761 N/A LYS 62.A NZ ASP 60.A OD2 no hydrogen 2.861 N/A ASP 65.A N ASN 63.A OD1 no hydrogen 2.806 N/A ASP 66.A N ASN 63.A O no hydrogen 3.040 N/A VAL 67.A N ASP 65.A O no hydrogen 2.932 N/A SER 71.A N.A VAL 67.A O no hydrogen 2.980 N/A SER 71.A N.B VAL 67.A O no hydrogen 2.969 N/A SER 71.A OG.B VAL 67.A O no hydrogen 3.065 N/A SER 71.A OG.B SER 117.A OG no hydrogen 2.693 N/A ARG 72.A N LYS 68.A O no hydrogen 3.036 N/A VAL 73.A N SER 69.A O no hydrogen 2.940 N/A MET 74.A N LEU 70.A O no hydrogen 2.960 N/A ILE 75.A N SER 71.A O.A no hydrogen 2.975 N/A ILE 75.A N SER 71.A O.B no hydrogen 3.002 N/A HIS 76.A N ARG 72.A O no hydrogen 2.973 N/A VAL 77.A N VAL 73.A O no hydrogen 2.860 N/A PHE 78.A N MET 74.A O no hydrogen 3.422 N/A SER 79.A N HIS 76.A O no hydrogen 3.003 N/A SER 79.A OG HIS 76.A O no hydrogen 2.832 N/A GLY 81.A N PHE 78.A O no hydrogen 3.028 N/A VAL 82.A N ASP 80.A OD1 no hydrogen 3.072 N/A TRP 85.A NE1 GLN 133.A OE1 no hydrogen 2.887 N/A ARG 87.A N ASN 84.A OD1 no hydrogen 2.874 N/A ARG 87.A NH1 ASP 80.A OD1 no hydrogen 2.798 N/A ARG 87.A NH1 ASP 80.A OD2 no hydrogen 3.371 N/A ARG 87.A NH2 ASP 80.A OD2 no hydrogen 2.780 N/A ILE 88.A N ASN 84.A O no hydrogen 3.255 N/A VAL 89.A N TRP 85.A O no hydrogen 2.907 N/A THR 90.A N GLY 86.A O no hydrogen 3.118 N/A THR 90.A OG1 GLY 86.A O no hydrogen 2.694 N/A LEU 91.A N ARG 87.A O no hydrogen 2.932 N/A ILE 92.A N ILE 88.A O no hydrogen 2.979 N/A SER 93.A N VAL 89.A O no hydrogen 2.768 N/A SER 93.A OG GLY 41.A O no hydrogen 2.987 N/A PHE 94.A N THR 90.A O no hydrogen 2.857 N/A GLY 95.A N LEU 91.A O no hydrogen 2.997 N/A ALA 96.A N ILE 92.A O no hydrogen 2.891 N/A PHE 97.A N SER 93.A O no hydrogen 2.942 N/A VAL 98.A N PHE 94.A O no hydrogen 2.899 N/A ALA 99.A N GLY 95.A O no hydrogen 2.860 N/A LYS 100.A N ALA 96.A O no hydrogen 2.973 N/A HIS 101.A N PHE 97.A O no hydrogen 3.313 N/A LEU 102.A N VAL 98.A O no hydrogen 2.995 N/A LYS 103.A N ALA 99.A O no hydrogen 3.125 N/A LYS 103.A NZ SER 109.A O no hydrogen 2.621 N/A THR 104.A N LYS 100.A O no hydrogen 3.230 N/A THR 104.A OG1 HIS 101.A O no hydrogen 2.607 N/A ILE 105.A N HIS 101.A O no hydrogen 3.400 N/A ASN 106.A N LEU 102.A O no hydrogen 3.013 N/A SER 109.A N ASN 106.A O no hydrogen 3.089 N/A SER 109.A OG GLU 64.A OE1 no hydrogen 3.570 N/A SER 109.A OG ASN 106.A O no hydrogen 3.357 N/A CYS 110.A N GLU 64.A OE1 no hydrogen 3.276 N/A ALA 115.A N ILE 111.A O no hydrogen 3.040 N/A GLU 116.A N GLU 112.A O no hydrogen 2.785 N/A SER 117.A N PRO 113.A O no hydrogen 3.024 N/A SER 117.A OG SER 71.A OG.B no hydrogen 2.693 N/A ILE 118.A N LEU 114.A O no hydrogen 3.114 N/A THR 119.A N ALA 115.A O no hydrogen 2.925 N/A THR 119.A OG1 ALA 115.A O no hydrogen 2.839 N/A ASP 120.A N GLU 116.A O no hydrogen 2.884 N/A VAL 121.A N SER 117.A O no hydrogen 3.252 N/A LEU 122.A N ILE 118.A O no hydrogen 2.957 N/A VAL 123.A N THR 119.A O no hydrogen 2.724 N/A ARG 124.A N ASP 120.A O no hydrogen 2.952 N/A ARG 124.A NE ASP 120.A OD1 no hydrogen 2.850 N/A THR 125.A N VAL 121.A O no hydrogen 3.015 N/A THR 125.A OG1 VAL 121.A O no hydrogen 2.392 N/A LYS 126.A N LEU 122.A O no hydrogen 2.976 N/A LYS 126.A NZ THR 83.A OG1 no hydrogen 2.816 N/A ARG 127.A NH1 ASP 1.A OD1 no hydrogen 2.776 N/A ARG 127.A NH1 ASP 1.A OD2 no hydrogen 3.568 N/A ARG 127.A NH2 ASP 1.A OD2 no hydrogen 2.779 N/A LEU 130.A N LYS 126.A O no hydrogen 2.900 N/A VAL 131.A N ARG 127.A O no hydrogen 2.925 N/A LYS 132.A N ASP 128.A O no hydrogen 3.022 N/A GLN 133.A N LEU 130.A O no hydrogen 3.171 N/A GLN 133.A NE2 TRP 129.A O no hydrogen 2.984 N/A ARG 134.A N VAL 131.A O no hydrogen 3.011 N/A ARG 134.A NH2 ASP 137.A OD2 no hydrogen 2.964 N/A GLY 135.A N LEU 130.A O no hydrogen 2.824 N/A TRP 136.A NE1 SER 7.A OG no hydrogen 2.822 N/A ASP 137.A N ARG 134.A O no hydrogen 3.165 N/A GLY 138.A N GLY 135.A O no hydrogen 3.029 N/A VAL 140.A N TRP 136.A O no hydrogen 2.808 N/A GLU 141.A N ASP 137.A O no hydrogen 2.885 N/A PHE 142.A N GLY 138.A O no hydrogen 2.952 N/A PHE 143.A N PHE 139.A O no hydrogen 3.080 N/A HIS 144.A N GLU 141.A O no hydrogen 3.204 N/A