Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1shm_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 2.A N SER 24.A O no hydrogen 2.825 N/A GLN 4.A N ALA 22.A O no hydrogen 3.059 N/A GLU 5.A N GLU 5.A OE1 no hydrogen 2.636 N/A SER 6.A N SER 20.A O no hydrogen 2.832 N/A VAL 11.A N THR 115.A O no hydrogen 3.002 N/A ALA 13.A N SER 117.A O no hydrogen 3.028 N/A GLY 14.A N LEU 85C.A O no hydrogen 2.792 N/A GLY 15.A N GLN 12.A O no hydrogen 3.053 N/A SER 16.A OG ASN 83A.A OD1 no hydrogen 2.619 N/A LEU 17.A N MET 82.A O no hydrogen 2.986 N/A LEU 19.A N LEU 80.A O no hydrogen 2.865 N/A SER 20.A N SER 6.A O no hydrogen 2.854 N/A CYS 21.A N VAL 78.A O no hydrogen 2.793 N/A ALA 22.A N GLN 4.A O no hydrogen 2.964 N/A ALA 23.A N LYS 76.A O no hydrogen 3.012 N/A SER 24.A N GLN 2.A O no hydrogen 2.819 N/A THR 27.A N GLY 25.A O no hydrogen 2.952 N/A SER 29.A OG ALA 26.A O no hydrogen 3.086 N/A ASP 32.A N GLY 98.A O no hydrogen 2.885 N/A MET 33.A N ILE 50.A O no hydrogen 3.142 N/A GLY 34.A N GLY 96.A O no hydrogen 2.835 N/A TRP 35.A N ALA 48.A O no hydrogen 2.838 N/A PHE 36.A N THR 94.A O no hydrogen 2.800 N/A ARG 37.A N GLU 45.A O no hydrogen 2.934 N/A ARG 37.A NE GLU 45.A OE2 no hydrogen 2.780 N/A ARG 37.A NH1 ASP 89.A OD1 no hydrogen 3.080 N/A ARG 37.A NH1 TYR 93.A OH no hydrogen 3.048 N/A ARG 37.A NH2 GLU 45.A OE2 no hydrogen 3.229 N/A GLN 38.A N VAL 92.A O no hydrogen 2.810 N/A GLN 38.A NE2 LYS 42.A O no hydrogen 2.783 N/A LYS 42.A N ALA 39.A O no hydrogen 2.938 N/A ARG 44.A NE GLU 102I.A OE2 no hydrogen 2.913 N/A ARG 44.A NH2 GLU 102I.A OE1 no hydrogen 3.057 N/A GLU 45.A N ARG 37.A O no hydrogen 2.955 N/A VAL 47.A N TRP 35.A O no hydrogen 2.988 N/A ALA 48.A N TRP 35.A O no hydrogen 3.402 N/A ALA 49.A N TYR 58.A O no hydrogen 2.936 N/A ILE 50.A N MET 33.A O no hydrogen 2.934 N/A ASN 51.A N GLY 56.A O no hydrogen 2.875 N/A SER 54.A N ASN 51.A OD1 no hydrogen 3.221 N/A GLY 56.A N SER 54.A OG no hydrogen 3.065 N/A TYR 58.A N ALA 49.A O no hydrogen 2.860 N/A ALA 60.A N VAL 47.A O no hydrogen 2.882 N/A VAL 63.A N ALA 60.A O no hydrogen 3.271 N/A ARG 64.A N SER 61.A O no hydrogen 3.449 N/A ARG 64.A NE TYR 59.A O no hydrogen 3.386 N/A ARG 64.A NH2 TYR 59.A O no hydrogen 3.037 N/A ARG 66.A N VAL 63.A O no hydrogen 3.130 N/A ARG 66.A NH1 SER 62.A O no hydrogen 2.863 N/A ARG 66.A NH1 ASP 89.A OD1 no hydrogen 3.499 N/A ARG 66.A NH2 ASP 89.A OD1 no hydrogen 3.404 N/A ARG 66.A NH2 ASP 89.A OD2 no hydrogen 2.570 N/A ARG 66.A NH2 SER 84B.A O no hydrogen 3.055 N/A PHE 67.A N VAL 63.A O no hydrogen 3.115 N/A THR 68.A N GLN 81.A O no hydrogen 2.905 N/A ILE 69.A N TYR 59.A OH no hydrogen 2.913 N/A SER 70.A N TYR 79.A O no hydrogen 3.129 N/A ARG 71.A NE TRP 52A.A O no hydrogen 2.703 N/A ARG 71.A NH1 ARG 71.A O no hydrogen 3.107 N/A ARG 71.A NH2 GLY 53.A O no hydrogen 3.473 N/A ARG 71.A NH2 TRP 52A.A O no hydrogen 3.073 N/A ASP 72.A N THR 77.A O no hydrogen 3.012 N/A LYS 75.A N ASP 72.A OD1 no hydrogen 3.058 N/A LYS 76.A N ASN 73.A O no hydrogen 3.247 N/A LYS 76.A NZ THR 27.A O no hydrogen 3.187 N/A LYS 76.A NZ ASN 73.A OD1 no hydrogen 2.823 N/A THR 77.A N ASP 72.A O no hydrogen 3.352 N/A THR 77.A OG1 LYS 75.A O no hydrogen 2.853 N/A VAL 78.A N CYS 21.A O no hydrogen 3.075 N/A TYR 79.A N SER 70.A O no hydrogen 2.928 N/A LEU 80.A N LEU 19.A O no hydrogen 2.830 N/A GLN 81.A N THR 68.A O no hydrogen 2.896 N/A GLN 81.A NE2 ASN 83A.A OD1 no hydrogen 3.402 N/A MET 82.A N LEU 17.A O no hydrogen 2.830 N/A LYS 86.A N ASP 89.A OD2 no hydrogen 2.731 N/A GLU 88.A N GLU 88.A OE1 no hydrogen 2.962 N/A ASP 89.A N LYS 86.A O no hydrogen 2.812 N/A THR 90.A N PRO 87.A O no hydrogen 3.053 N/A THR 90.A OG1 PRO 87.A O no hydrogen 2.719 N/A ALA 91.A N VAL 114.A O no hydrogen 3.057 N/A VAL 92.A N GLN 38.A O no hydrogen 3.036 N/A TYR 93.A N THR 112.A O no hydrogen 2.850 N/A TYR 93.A OH ASP 89.A O no hydrogen 2.545 N/A THR 94.A N PHE 36.A O no hydrogen 2.878 N/A CYS 95.A N GLU 5.A OE2 no hydrogen 2.805 N/A CYS 95.A SG GLY 34.A O no hydrogen 3.442 N/A GLY 96.A N GLY 34.A O no hydrogen 2.920 N/A ALA 97.A N TRP 107.A O no hydrogen 2.878 N/A GLY 98.A N ASP 32.A O no hydrogen 3.138 N/A ILE 100.A N ASP 32.A OD2 no hydrogen 3.129 N/A VAL 105.A N GLU 102I.A O no hydrogen 3.206 N/A THR 106.A N ALA 97.A O no hydrogen 2.790 N/A TRP 107.A N ALA 97.A O no hydrogen 3.086 N/A GLY 109.A N CYS 95.A O no hydrogen 2.854 N/A GLN 110.A N GLU 5.A OE1 no hydrogen 2.913 N/A GLN 110.A NE2 LEU 3.A O no hydrogen 2.969 N/A GLY 111.A N GLU 5.A OE1 no hydrogen 3.169 N/A GLY 111.A N GLU 5.A OE2 no hydrogen 3.360 N/A THR 112.A N TYR 93.A O no hydrogen 2.905 N/A VAL 114.A N ALA 91.A O no hydrogen 2.998 N/A THR 115.A N GLY 9.A O no hydrogen 2.855 N/A THR 115.A OG1 GLN 113.A OE1 no hydrogen 3.397 N/A VAL 116.A N THR 90.A OG1 no hydrogen 3.020 N/A SER 117.A N VAL 11.A O no hydrogen 2.987 N/A SER 117.A OG VAL 11.A O no hydrogen 3.568 N/A TRP 52A.A N ASP 32.A OD1 no hydrogen 3.241 N/A TRP 52A.A NE1 ASN 73.A OD1 no hydrogen 3.123 N/A ASN 83A.A N ARG 66.A O no hydrogen 3.051 N/A LEU 85C.A N GLY 15.A O no hydrogen 3.044 N/A