Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2p1a_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 4.A N GLY 1.A O no hydrogen 3.092 N/A ALA 6.A N PHE 2.A O no hydrogen 3.086 N/A LEU 7.A N VAL 3.A O no hydrogen 2.930 N/A HIS 8.A N GLN 4.A O no hydrogen 2.982 N/A GLN 9.A N SER 5.A O no hydrogen 3.060 N/A GLN 9.A NE2 TYR 125.A OH no hydrogen 3.460 N/A LEU 10.A N ALA 6.A O no hydrogen 3.213 N/A LYS 11.A N LEU 7.A O no hydrogen 2.887 N/A VAL 12.A N HIS 8.A O no hydrogen 2.999 N/A ALA 13.A N GLN 9.A O no hydrogen 3.314 N/A VAL 14.A N LEU 10.A O no hydrogen 2.885 N/A ASP 15.A N LYS 11.A O no hydrogen 2.696 N/A THR 16.A N VAL 12.A O no hydrogen 2.926 N/A THR 16.A OG1.A VAL 12.A O no hydrogen 2.743 N/A THR 16.A OG1.A ALA 13.A O no hydrogen 2.811 N/A THR 16.A OG1.B VAL 12.A O no hydrogen 2.768 N/A SER 17.A N ALA 13.A O no hydrogen 3.002 N/A SER 17.A OG ALA 13.A O no hydrogen 2.921 N/A ILE 18.A N VAL 14.A O no hydrogen 2.936 N/A GLN 19.A N ASP 15.A O no hydrogen 3.337 N/A ASP 21.A N GLN 19.A O no hydrogen 3.178 N/A GLN 22.A NE2 GLN 19.A O no hydrogen 2.988 N/A THR 24.A OG1 ASP 27.A OD2 no hydrogen 2.978 N/A LEU 28.A N THR 24.A O no hydrogen 3.043 N/A LYS 29.A N GLU 25.A O no hydrogen 2.948 N/A ILE 30.A N ILE 26.A O no hydrogen 2.923 N/A ALA 31.A N ASP 27.A O no hydrogen 3.173 N/A SER 35.A OG ARG 37.A O no hydrogen 3.149 N/A ARG 37.A N SER 35.A OG no hydrogen 3.149 N/A LEU 39.A N ALA 31.A O no hydrogen 3.078 N/A PHE 40.A N LEU 28.A O no hydrogen 3.000 N/A GLU 41.A N SER 38.A OG no hydrogen 3.359 N/A ALA 43.A N PHE 40.A O no hydrogen 2.799 N/A HIS 44.A N GLU 41.A O no hydrogen 2.977 N/A SER 46.A N TYR 42.A O no hydrogen 3.057 N/A SER 46.A OG ALA 43.A O no hydrogen 2.570 N/A LEU 47.A N HIS 44.A O no hydrogen 3.275 N/A ILE 48.A N LEU 45.A O no hydrogen 3.244 N/A ALA 51.A N LEU 47.A O no hydrogen 2.769 N/A ASP 52.A N ILE 48.A O no hydrogen 2.777 N/A LEU 53.A N CYS 49.A O no hydrogen 3.183 N/A LEU 54.A N HIS 50.A O no hydrogen 2.945 N/A ILE 55.A N ALA 51.A O no hydrogen 2.974 N/A LEU 56.A N ASP 52.A O no hydrogen 2.983 N/A ASN 57.A N LEU 53.A O no hydrogen 2.906 N/A GLY 58.A N ILE 55.A O no hydrogen 3.150 N/A SER 59.A N LEU 54.A O no hydrogen 2.993 N/A SER 59.A OG LEU 54.A O no hydrogen 3.265 N/A SER 59.A OG GLU 63.A OE1.A no hydrogen 2.696 N/A GLU 63.A N THR 60.A OG1 no hydrogen 3.102 N/A LEU 64.A N THR 60.A O no hydrogen 3.267 N/A HIS 65.A N GLU 61.A O no hydrogen 2.916 N/A THR 66.A N LYS 62.A O no hydrogen 2.802 N/A THR 66.A OG1 LYS 62.A O no hydrogen 2.798 N/A PHE 67.A N GLU 63.A O no hydrogen 2.750 N/A TYR 68.A N LEU 64.A O no hydrogen 3.041 N/A LYS 69.A N HIS 65.A O no hydrogen 2.929 N/A LYS 69.A NZ GLU 70.A OE2 no hydrogen 3.183 N/A GLU 70.A N THR 66.A O no hydrogen 2.815 N/A GLN 71.A N PHE 67.A O no hydrogen 2.757 N/A THR 72.A OG1 TYR 68.A O no hydrogen 2.585 N/A GLN 78.A N THR 75.A OG1 no hydrogen 3.230 N/A GLN 79.A NE2 ILE 18.A O no hydrogen 2.760 N/A GLN 79.A NE2 ASP 21.A OD1 no hydrogen 3.004 N/A LYS 80.A N ALA 77.A O no hydrogen 2.921 N/A THR 81.A N GLN 78.A O no hydrogen 2.905 N/A THR 81.A OG1 GLN 78.A O no hydrogen 2.504 N/A GLN 83.A N LYS 80.A O no hydrogen 3.011 N/A GLY 84.A N THR 81.A O no hydrogen 2.882 N/A TYR 85.A OH LEU 7.A O no hydrogen 3.283 N/A ASP 86.A N ILE 82.A O no hydrogen 2.838 N/A LEU 87.A N GLN 83.A O no hydrogen 2.972 N/A LEU 88.A N GLY 84.A O no hydrogen 2.943 N/A SER 89.A N TYR 85.A O no hydrogen 2.781 N/A SER 89.A OG.A TYR 85.A O no hydrogen 2.607 N/A LYS 90.A N ASP 86.A O no hydrogen 2.904 N/A THR 91.A N LEU 87.A O no hydrogen 2.948 N/A THR 91.A OG1 LEU 87.A O no hydrogen 2.655 N/A PHE 92.A N LEU 88.A O no hydrogen 2.848 N/A LEU 93.A N SER 89.A O no hydrogen 2.762 N/A SER 94.A N THR 91.A O no hydrogen 2.946 N/A SER 94.A OG THR 91.A O no hydrogen 2.634 N/A SER 96.A N GLN 99.A OE1 no hydrogen 3.065 N/A SER 96.A OG GLN 99.A OE1 no hydrogen 3.379 N/A GLN 99.A N SER 96.A OG no hydrogen 3.248 N/A LEU 100.A N SER 96.A O no hydrogen 2.788 N/A ALA 101.A N ASN 97.A O no hydrogen 2.914 N/A GLU 102.A N GLN 99.A O no hydrogen 3.195 N/A ALA 105.A N ILE 109.A O no hydrogen 2.903 N/A GLY 108.A N ALA 105.A O no hydrogen 2.920 N/A TYR 111.A N LYS 103.A O no hydrogen 3.111 N/A ARG 113.A N GLU 102.A O no hydrogen 2.943 N/A ARG 113.A NH1 GLN 99.A O no hydrogen 3.028 N/A PHE 114.A N LEU 100.A O no hydrogen 2.877 N/A GLU 115.A N SER 112.A OG no hydrogen 3.027 N/A TRP 116.A N SER 112.A O no hydrogen 2.992 N/A TRP 116.A NE1 LYS 103.A O no hydrogen 3.280 N/A LEU 117.A N ARG 113.A O no hydrogen 3.092 N/A LEU 118.A N PHE 114.A O no hydrogen 3.223 N/A GLU 119.A N GLU 115.A O no hydrogen 2.736 N/A ILE 120.A N TRP 116.A O no hydrogen 2.857 N/A VAL 121.A N LEU 117.A O no hydrogen 3.165 N/A ALA 122.A N LEU 118.A O no hydrogen 2.880 N/A HIS 123.A N GLU 119.A O no hydrogen 2.731 N/A HIS 123.A ND1 ASP 52.A OD2 no hydrogen 2.713 N/A PHE 124.A N ILE 120.A O no hydrogen 2.836 N/A TYR 125.A N VAL 121.A O no hydrogen 2.982 N/A TYR 125.A OH GLN 9.A O no hydrogen 3.331 N/A HIS 126.A N ALA 122.A O no hydrogen 2.770 N/A HIS 127.A N HIS 123.A O no hydrogen 3.099 N/A HIS 127.A ND1.B GLN 130.A OE1 no hydrogen 2.745 N/A ARG 128.A N PHE 124.A O no hydrogen 2.915 N/A GLY 129.A N TYR 125.A O no hydrogen 2.815 N/A GLN 130.A N HIS 126.A O no hydrogen 3.044 N/A ILE 131.A N HIS 127.A O no hydrogen 3.137 N/A HIS 132.A N ARG 128.A O no hydrogen 2.936 N/A ILE 133.A N GLY 129.A O no hydrogen 3.255 N/A LEU 134.A N GLN 130.A O no hydrogen 3.388 N/A LEU 135.A N ILE 131.A O no hydrogen 2.895 N/A LEU 135.A N HIS 132.A O no hydrogen 3.185 N/A CYS 136.A N ILE 133.A O no hydrogen 3.143 N/A CYS 136.A SG HIS 132.A O no hydrogen 3.472 N/A