Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ccy_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 5.A N TYR 1.A O no hydrogen 3.392 N/A ARG 5.A NH1 ASP 52.A OD1 no hydrogen 3.348 N/A ARG 5.A NH2 ASP 52.A OD1 no hydrogen 3.423 N/A THR 7.A N ILE 4.A O no hydrogen 3.240 N/A THR 7.A OG1 ASN 3.A O no hydrogen 3.352 N/A ILE 8.A N ILE 4.A O no hydrogen 3.282 N/A ILE 9.A N ARG 5.A O no hydrogen 3.207 N/A GLU 10.A N ASP 6.A O no hydrogen 2.701 N/A ARG 11.A N THR 7.A O no hydrogen 2.735 N/A ARG 11.A NE ALA 31.A O no hydrogen 2.918 N/A ARG 11.A NH2 ALA 31.A O no hydrogen 3.430 N/A ALA 12.A N ILE 8.A O no hydrogen 2.779 N/A ALA 13.A N ILE 9.A O no hydrogen 2.939 N/A ALA 14.A N GLU 10.A O no hydrogen 3.310 N/A ALA 16.A N ALA 13.A O no hydrogen 3.101 N/A ARG 17.A N ALA 14.A O no hydrogen 3.146 N/A ARG 17.A NH1 ASP 94.A OD1 no hydrogen 2.806 N/A ARG 17.A NH2 ASP 94.A OD1 no hydrogen 2.961 N/A ARG 17.A NH2 ASP 94.A OD2 no hydrogen 3.268 N/A GLN 18.A N GLN 18.A OE1 no hydrogen 3.013 N/A THR 23.A N GLY 19.A O no hydrogen 3.228 N/A THR 23.A N TYR 20.A O no hydrogen 3.109 N/A THR 23.A OG1 GLY 19.A O no hydrogen 2.644 N/A SER 24.A N ASP 27.A OD2 no hydrogen 2.938 N/A ASP 27.A N SER 24.A OG no hydrogen 3.211 N/A ILE 28.A N SER 24.A O no hydrogen 3.222 N/A ALA 29.A N ILE 25.A O no hydrogen 2.903 N/A ARG 30.A N GLY 26.A O no hydrogen 3.137 N/A ARG 30.A NE GLY 26.A O no hydrogen 3.234 N/A ALA 31.A N ASP 27.A O no hydrogen 3.037 N/A ALA 31.A N ILE 28.A O no hydrogen 3.005 N/A CYS 32.A N ILE 28.A O no hydrogen 3.117 N/A CYS 32.A SG ILE 28.A O no hydrogen 3.589 N/A GLU 33.A N ARG 30.A O no hydrogen 3.269 N/A CYS 34.A N ALA 29.A O no hydrogen 2.715 N/A CYS 34.A SG SER 35.A O no hydrogen 3.941 N/A ARG 38.A N SER 35.A O no hydrogen 3.313 N/A TYR 40.A N SER 37.A O no hydrogen 3.040 N/A TYR 42.A N LEU 39.A O no hydrogen 3.094 N/A PHE 43.A N LEU 39.A O no hydrogen 2.984 N/A LYS 46.A NZ TYR 20.A O no hydrogen 2.636 N/A LYS 46.A NZ THR 23.A O no hydrogen 2.832 N/A GLU 47.A N SER 45.A OG no hydrogen 2.981 N/A VAL 49.A N SER 45.A O no hydrogen 3.239 N/A LEU 50.A N LYS 46.A O no hydrogen 3.126 N/A ARG 51.A N GLU 47.A O no hydrogen 2.684 N/A ARG 51.A NH2 GLN 109.A OE1 no hydrogen 2.859 N/A ASP 52.A N ALA 48.A O no hydrogen 2.976 N/A THR 54.A N ARG 51.A O no hydrogen 2.907 N/A THR 54.A OG1 ARG 51.A O no hydrogen 2.740 N/A THR 55.A N ASP 52.A O no hydrogen 2.970 N/A VAL 57.A N LEU 53.A O no hydrogen 3.026 N/A ASP 58.A N THR 54.A O no hydrogen 2.914 N/A SER 59.A N THR 55.A O no hydrogen 2.962 N/A LEU 60.A N HIS 56.A O no hydrogen 3.109 N/A LEU 61.A N VAL 57.A O no hydrogen 2.927 N/A GLU 62.A N ASP 58.A O no hydrogen 3.063 N/A ARG 63.A N SER 59.A O no hydrogen 2.966 N/A ARG 63.A NH2.A GLU 87.A OE2 no hydrogen 2.416 N/A ARG 63.A NH2.B GLU 87.A OE1 no hydrogen 3.144 N/A ARG 63.A NH2.B GLU 87.A OE2 no hydrogen 3.275 N/A CYS 64.A N LEU 60.A O no hydrogen 2.953 N/A CYS 64.A SG.B LEU 60.A O no hydrogen 3.386 N/A ARG 65.A N LEU 61.A O no hydrogen 3.109 N/A ARG 65.A NE TYR 123.A OH no hydrogen 2.809 N/A ARG 65.A NH2 GLU 62.A OE2 no hydrogen 3.014 N/A GLN 66.A N GLU 62.A O no hydrogen 3.108 N/A GLN 66.A NE2 GLU 62.A O no hydrogen 3.594 N/A VAL 67.A N ARG 63.A O no hydrogen 3.119 N/A LEU 68.A N CYS 64.A O no hydrogen 2.819 N/A TYR 69.A N ARG 65.A O no hydrogen 2.741 N/A GLY 70.A N VAL 67.A O no hydrogen 3.004 N/A GLU 73.A N SER 71.A OG no hydrogen 3.228 N/A LYS 75.A NZ ASP 178.A OD2 no hydrogen 2.916 N/A ARG 77.A N GLU 73.A O no hydrogen 3.075 N/A ARG 77.A NH1 SER 71.A O no hydrogen 3.190 N/A ARG 77.A NH1 ASN 72.A O no hydrogen 2.796 N/A ARG 77.A NH2 GLN 130.A OE1 no hydrogen 3.088 N/A PHE 78.A N PRO 74.A O no hydrogen 3.129 N/A LEU 79.A N LYS 75.A O no hydrogen 3.176 N/A GLN 80.A N THR 76.A O no hydrogen 2.840 N/A ILE 81.A N ARG 77.A O no hydrogen 2.938 N/A VAL 82.A N PHE 78.A O no hydrogen 3.079 N/A LYS 83.A N LEU 79.A O no hydrogen 2.998 N/A LYS 83.A NZ ASP 166.A OD2 no hydrogen 3.503 N/A LYS 83.A NZ GLU 170.A OE2 no hydrogen 3.038 N/A LEU 84.A N GLN 80.A O no hydrogen 2.907 N/A PHE 85.A N ILE 81.A O no hydrogen 3.096 N/A LEU 86.A N VAL 82.A O no hydrogen 3.131 N/A GLU 87.A N LYS 83.A O no hydrogen 2.864 N/A ILE 88.A N LEU 84.A O no hydrogen 2.969 N/A TYR 89.A N PHE 85.A O no hydrogen 3.146 N/A TYR 89.A OH TYR 157.A O no hydrogen 2.569 N/A ALA 90.A N LEU 86.A O no hydrogen 3.009 N/A THR 91.A N GLU 87.A O no hydrogen 2.885 N/A THR 91.A OG1 GLU 87.A O no hydrogen 3.123 N/A THR 91.A OG1 ILE 88.A O no hydrogen 3.491 N/A SER 92.A N ILE 88.A O no hydrogen 2.580 N/A ARG 93.A NE TYR 89.A OH no hydrogen 3.086 N/A ARG 93.A NH2 TYR 154.A O no hydrogen 2.873 N/A HIS 96.A N SER 92.A O no hydrogen 2.913 N/A VAL 97.A N ARG 93.A O no hydrogen 2.729 N/A VAL 98.A N ASP 94.A O no hydrogen 2.989 N/A THR 100.A N VAL 98.A O no hydrogen 3.348 N/A CYS 101.A N VAL 98.A O no hydrogen 2.815 N/A ALA 104.A N CYS 101.A O no hydrogen 3.050 N/A LEU 105.A N LEU 102.A O no hydrogen 3.376 N/A GLN 109.A NE2 ASP 108.A OD2 no hydrogen 3.462 N/A ARG 110.A NH1 ASP 103.A O no hydrogen 2.959 N/A ARG 110.A NH2 GLU 107.A OE2 no hydrogen 3.514 N/A LYS 111.A N GLU 107.A O no hydrogen 3.116 N/A ALA 112.A N ASP 108.A O no hydrogen 3.041 N/A LEU 113.A N GLN 109.A O no hydrogen 3.028 N/A ILE 114.A N ARG 110.A O no hydrogen 2.689 N/A ALA 115.A N LYS 111.A O no hydrogen 2.910 N/A LYS 116.A N ALA 112.A O no hydrogen 3.282 N/A LYS 116.A NZ ASP 58.A OD1 no hydrogen 2.563 N/A GLN 117.A N LEU 113.A O no hydrogen 3.021 N/A ARG 118.A N ILE 114.A O no hydrogen 3.006 N/A GLU 119.A N ALA 115.A O no hydrogen 3.145 N/A LEU 120.A N LYS 116.A O no hydrogen 3.234 N/A ILE 121.A N GLN 117.A O no hydrogen 3.037 N/A ALA 122.A N ARG 118.A O no hydrogen 2.865 N/A TYR 123.A N GLU 119.A O no hydrogen 3.036 N/A VAL 124.A N LEU 120.A O no hydrogen 3.356 N/A ARG 125.A N ILE 121.A O no hydrogen 2.862 N/A ARG 125.A NE.A ASP 126.A OD1 no hydrogen 3.013 N/A ARG 125.A NH2.A ASP 126.A OD1 no hydrogen 3.122 N/A ASP 126.A N ALA 122.A O no hydrogen 2.873 N/A ALA 127.A N TYR 123.A O no hydrogen 3.056 N/A LEU 128.A N VAL 124.A O no hydrogen 2.959 N/A LEU 129.A N ARG 125.A O no hydrogen 3.007 N/A GLN 130.A N ASP 126.A O no hydrogen 2.986 N/A LEU 131.A N LEU 128.A O no hydrogen 2.923 N/A ARG 132.A N LEU 128.A O no hydrogen 3.044 N/A ARG 132.A NE ASP 134.A OD1 no hydrogen 2.776 N/A ARG 132.A NH2 ASP 134.A OD1 no hydrogen 3.568 N/A ARG 132.A NH2 ASP 134.A OD2 no hydrogen 2.835 N/A LEU 140.A N ASN 137.A OD1 no hydrogen 3.139 N/A ALA 141.A N ASN 137.A O no hydrogen 2.996 N/A HIS 142.A N ARG 138.A O no hydrogen 3.079 N/A VAL 143.A N THR 139.A O no hydrogen 3.131 N/A ASP 144.A N LEU 140.A O no hydrogen 2.801 N/A THR 145.A N ALA 141.A O no hydrogen 3.023 N/A THR 145.A OG1 ALA 141.A O no hydrogen 2.722 N/A PHE 147.A N ASP 144.A O no hydrogen 3.039 N/A PHE 148.A N THR 145.A O no hydrogen 2.915 N/A ASN 151.A N PHE 148.A O no hydrogen 2.636 N/A TRP 152.A N GLY 149.A O no hydrogen 3.029 N/A THR 153.A N ILE 150.A O no hydrogen 3.451 N/A THR 153.A OG1 ILE 150.A O no hydrogen 2.546 N/A THR 155.A N TRP 152.A O no hydrogen 2.968 N/A THR 155.A OG1 TRP 152.A O no hydrogen 2.764 N/A TRP 156.A N THR 153.A O no hydrogen 3.009 N/A TYR 157.A N THR 153.A O no hydrogen 2.775 N/A TYR 157.A OH VAL 163.A O no hydrogen 2.710 N/A GLY 161.A N LYS 158.A O no hydrogen 3.131 N/A ALA 167.A N SER 164.A OG no hydrogen 2.989 N/A LEU 168.A N SER 164.A O no hydrogen 2.829 N/A ALA 169.A N PRO 165.A O no hydrogen 2.990 N/A GLU 170.A N ASP 166.A O no hydrogen 2.966 N/A ARG 171.A N ALA 167.A O no hydrogen 3.000 N/A THR 172.A N LEU 168.A O no hydrogen 2.807 N/A THR 172.A OG1 LEU 168.A O no hydrogen 2.714 N/A VAL 173.A N ALA 169.A O no hydrogen 2.956 N/A GLN 174.A N GLU 170.A O no hydrogen 2.889 N/A LEU 175.A N ARG 171.A O no hydrogen 2.923 N/A PHE 176.A N THR 172.A O no hydrogen 2.895 N/A LEU 177.A N VAL 173.A O no hydrogen 2.856 N/A ASP 178.A N GLN 174.A O no hydrogen 2.883 N/A GLY 179.A N GLN 174.A O no hydrogen 3.291 N/A GLY 179.A N LEU 175.A O no hydrogen 2.777 N/A ASN 182.A N GLY 179.A O no hydrogen 3.125 N/A LEU 183.A N TYR 180.A O no hydrogen 3.461 N/A