Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2w72_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N LEU 78.A O no hydrogen 2.885 N/A THR 4.A N GLU 7.A OE1.A no hydrogen 2.744 N/A GLU 6.A N GLU 6.A OE1.A no hydrogen 2.845 N/A GLU 7.A N THR 4.A OG1 no hydrogen 2.972 N/A LYS 8.A N THR 4.A O no hydrogen 2.960 N/A LYS 8.A NZ.B ASP 79.A OD1 no hydrogen 2.481 N/A SER 9.A N PRO 5.A O.A no hydrogen 3.042 N/A SER 9.A N PRO 5.A O.B no hydrogen 3.327 N/A SER 9.A OG.B PRO 5.A O.A no hydrogen 2.914 N/A SER 9.A OG.B PRO 5.A O.B no hydrogen 2.863 N/A ALA 10.A N GLU 6.A O no hydrogen 2.881 N/A VAL 11.A N GLU 7.A O no hydrogen 2.943 N/A THR 12.A N LYS 8.A O no hydrogen 2.995 N/A THR 12.A OG1.A LYS 8.A O no hydrogen 3.231 N/A THR 12.A OG1.A SER 9.A O no hydrogen 3.308 N/A THR 12.A OG1.B LYS 8.A O no hydrogen 3.286 N/A ALA 13.A N SER 9.A O no hydrogen 2.934 N/A LEU 14.A N ALA 10.A O no hydrogen 3.144 N/A TRP 15.A N VAL 11.A O no hydrogen 2.997 N/A TRP 15.A NE1 SER 72.A OG.A no hydrogen 2.877 N/A TRP 15.A NE1 SER 72.A OG.B no hydrogen 3.082 N/A GLY 16.A N THR 12.A O no hydrogen 3.132 N/A LYS 17.A N LEU 14.A O no hydrogen 3.039 N/A LYS 17.A NZ GLU 121.A OE2.A no hydrogen 2.699 N/A VAL 18.A N TRP 15.A O no hydrogen 2.982 N/A GLU 22.A N ASN 19.A OD1.A no hydrogen 3.167 N/A VAL 23.A N ASN 19.A O no hydrogen 2.931 N/A GLY 24.A N VAL 20.A O no hydrogen 2.793 N/A GLY 25.A N ASP 21.A O no hydrogen 3.046 N/A GLU 26.A N GLU 22.A O no hydrogen 2.997 N/A ALA 27.A N VAL 23.A O no hydrogen 2.807 N/A TYR 28.A N GLY 24.A O no hydrogen 2.961 N/A GLY 29.A N GLY 25.A O no hydrogen 2.971 N/A ARG 30.A N GLU 26.A O no hydrogen 2.943 N/A ARG 30.A NE GLU 26.A OE2 no hydrogen 2.739 N/A ARG 30.A NH2 GLU 26.A OE2 no hydrogen 3.112 N/A LEU 31.A N ALA 27.A O no hydrogen 2.894 N/A LEU 32.A N TYR 28.A O no hydrogen 3.252 N/A VAL 33.A N GLY 29.A O no hydrogen 3.004 N/A VAL 34.A N ARG 30.A O no hydrogen 2.791 N/A TYR 35.A N LEU 31.A O no hydrogen 2.960 N/A THR 38.A N TYR 35.A O no hydrogen 2.911 N/A THR 38.A OG1 LEU 31.A O no hydrogen 3.397 N/A THR 38.A OG1 TYR 35.A O no hydrogen 2.766 N/A GLN 39.A N PRO 36.A O no hydrogen 3.002 N/A GLN 39.A NE2 LEU 32.A O no hydrogen 2.913 N/A ARG 40.A N TRP 37.A O no hydrogen 3.139 N/A ARG 40.A NH1.B TRP 37.A O no hydrogen 3.066 N/A PHE 42.A N GLN 39.A O no hydrogen 2.916 N/A PHE 45.A N PHE 42.A O no hydrogen 3.012 N/A SER 49.A N ASP 47.A OD1 no hydrogen 3.016 N/A SER 49.A OG.A ASP 47.A OD1 no hydrogen 2.675 N/A SER 49.A OG.B ASP 47.A OD1 no hydrogen 3.323 N/A ALA 53.A N THR 50.A OG1 no hydrogen 3.138 N/A VAL 54.A N THR 50.A O no hydrogen 3.056 N/A MET 55.A N PRO 51.A O no hydrogen 2.941 N/A GLY 56.A N ASP 52.A O no hydrogen 3.015 N/A ASN 57.A N VAL 54.A O no hydrogen 3.225 N/A ASN 57.A ND2 PHE 45.A O no hydrogen 2.875 N/A ASN 57.A ND2 ASP 47.A O no hydrogen 2.980 N/A LYS 59.A N ASN 57.A OD1 no hydrogen 2.832 N/A LYS 59.A NZ SER 44.A O no hydrogen 3.414 N/A VAL 60.A N ASN 57.A OD1 no hydrogen 3.154 N/A LYS 61.A N ASN 57.A O no hydrogen 3.023 N/A ALA 62.A N PRO 58.A O no hydrogen 2.912 N/A GLN 63.A N LYS 59.A O no hydrogen 2.955 N/A GLN 63.A NE2 TYR 28.A OH no hydrogen 3.198 N/A GLY 64.A N VAL 60.A O no hydrogen 2.889 N/A LYS 65.A N LYS 61.A O no hydrogen 2.956 N/A LYS 66.A N ALA 62.A O no hydrogen 3.074 N/A VAL 67.A N GLN 63.A O no hydrogen 2.940 N/A LEU 68.A N GLY 64.A O no hydrogen 2.889 N/A GLY 69.A N LYS 65.A O no hydrogen 2.868 N/A ALA 70.A N LYS 66.A O no hydrogen 3.089 N/A PHE 71.A N VAL 67.A O no hydrogen 2.955 N/A SER 72.A N LEU 68.A O no hydrogen 2.800 N/A SER 72.A OG.B LEU 68.A O no hydrogen 2.956 N/A ASP 73.A N GLY 69.A O no hydrogen 2.964 N/A GLY 74.A N ALA 70.A O no hydrogen 3.053 N/A LEU 75.A N PHE 71.A O no hydrogen 3.174 N/A LEU 75.A N SER 72.A O no hydrogen 3.048 N/A ALA 76.A N ASP 73.A O no hydrogen 3.190 N/A HIS 77.A N GLY 74.A O no hydrogen 2.861 N/A ASN 80.A N HIS 77.A O no hydrogen 2.852 N/A LYS 82.A NZ.B HIS 143.A ND1.B no hydrogen 3.328 N/A GLY 83.A N ASN 80.A OD1.A no hydrogen 2.943 N/A THR 84.A N ASN 80.A O no hydrogen 3.028 N/A THR 84.A OG1.B ASN 80.A O no hydrogen 2.879 N/A PHE 85.A N LEU 81.A O no hydrogen 2.981 N/A ALA 86.A N GLY 83.A O no hydrogen 3.490 N/A SER 89.A N PHE 85.A O no hydrogen 2.777 N/A SER 89.A OG LEU 141.A O no hydrogen 2.664 N/A GLU 90.A N ALA 86.A O no hydrogen 3.014 N/A LEU 91.A N THR 87.A O no hydrogen 3.058 N/A HIS 92.A N LEU 88.A O no hydrogen 2.898 N/A HIS 92.A ND1 LEU 88.A O no hydrogen 2.754 N/A CYS 93.A N SER 89.A O no hydrogen 3.014 N/A CYS 93.A SG.A ASP 94.A OD1 no hydrogen 3.550 N/A CYS 93.A SG.B SER 89.A O no hydrogen 3.459 N/A CYS 93.A SG.B GLU 90.A O no hydrogen 3.217 N/A CYS 93.A SG.B ASP 94.A OD1 no hydrogen 3.282 N/A CYS 93.A SG.B LYS 144.A O no hydrogen 3.698 N/A ASP 94.A N GLU 90.A O no hydrogen 2.801 N/A LYS 95.A N LEU 91.A O no hydrogen 2.967 N/A LEU 96.A N LEU 91.A O no hydrogen 2.987 N/A VAL 98.A N HIS 92.A O no hydrogen 2.977 N/A GLU 101.A N ASP 99.A OD1 no hydrogen 3.023 N/A ASN 102.A N ASP 99.A O no hydrogen 2.975 N/A PHE 103.A N PRO 100.A O no hydrogen 2.897 N/A LEU 105.A N GLU 101.A O no hydrogen 3.069 N/A LEU 106.A N ASN 102.A O no hydrogen 2.966 N/A GLY 107.A N PHE 103.A O no hydrogen 2.973 N/A ASN 108.A N ARG 104.A O no hydrogen 3.050 N/A VAL 109.A N LEU 105.A O no hydrogen 3.032 N/A LEU 110.A N LEU 106.A O no hydrogen 2.805 N/A VAL 111.A N GLY 107.A O no hydrogen 3.024 N/A CYS 112.A N ASN 108.A O no hydrogen 3.077 N/A CYS 112.A SG ASN 108.A O no hydrogen 3.547 N/A VAL 113.A N VAL 109.A O no hydrogen 2.845 N/A LEU 114.A N LEU 110.A O no hydrogen 2.876 N/A ALA 115.A N VAL 111.A O no hydrogen 2.982 N/A HIS 116.A N CYS 112.A O no hydrogen 2.879 N/A HIS 117.A N VAL 113.A O no hydrogen 2.873 N/A PHE 118.A N LEU 114.A O no hydrogen 2.903 N/A GLY 119.A N ALA 115.A O no hydrogen 2.859 N/A LYS 120.A NZ.A GLU 121.A OE2.B no hydrogen 3.304 N/A LYS 120.A NZ.B GLU 121.A OE2.B no hydrogen 3.163 N/A GLU 121.A N PHE 118.A O no hydrogen 3.150 N/A PHE 122.A N GLY 119.A O no hydrogen 2.885 N/A VAL 126.A N THR 123.A OG1 no hydrogen 3.285 N/A GLN 127.A N THR 123.A O no hydrogen 2.830 N/A GLN 127.A NE2 GLN 131.A OE1.A no hydrogen 3.046 N/A GLN 127.A NE2 GLN 131.A OE1.B no hydrogen 3.451 N/A ALA 128.A N PRO 124.A O no hydrogen 2.986 N/A ALA 129.A N PRO 125.A O no hydrogen 3.096 N/A TYR 130.A N VAL 126.A O no hydrogen 3.045 N/A TYR 130.A OH VAL 11.A O no hydrogen 2.743 N/A GLN 131.A N GLN 127.A O no hydrogen 2.747 N/A GLN 131.A NE2.B ASN 108.A OD1.A no hydrogen 2.940 N/A LYS 132.A N ALA 128.A O no hydrogen 3.105 N/A LYS 132.A NZ.A GLU 7.A OE1.A no hydrogen 2.612 N/A LYS 132.A NZ.A GLU 7.A OE2.A no hydrogen 2.393 N/A VAL 133.A N ALA 129.A O no hydrogen 3.025 N/A VAL 134.A N TYR 130.A O no hydrogen 2.859 N/A ALA 135.A N GLN 131.A O no hydrogen 3.051 N/A GLY 136.A N LYS 132.A O no hydrogen 2.872 N/A VAL 137.A N VAL 133.A O no hydrogen 2.835 N/A ALA 138.A N VAL 134.A O no hydrogen 2.920 N/A ASN 139.A N ALA 135.A O no hydrogen 2.898 N/A ALA 140.A N GLY 136.A O no hydrogen 2.902 N/A LEU 141.A N VAL 137.A O no hydrogen 2.849 N/A ALA 142.A N ALA 138.A O no hydrogen 2.911 N/A HIS 143.A N ALA 140.A O no hydrogen 3.185 N/A LYS 144.A N SER 89.A OG no hydrogen 2.895 N/A TYR 145.A N ALA 142.A O no hydrogen 3.160 N/A TYR 145.A OH VAL 98.A O no hydrogen 2.632 N/A HIS 146.A NE2 ASP 94.A OD1 no hydrogen 2.697 N/A