Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3upv_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 4.A N SER 1.A OG no hydrogen 3.023 N/A GLU 5.A N SER 1.A O no hydrogen 3.057 N/A GLU 6.A N MET 2.A O no hydrogen 2.874 N/A ALA 7.A N LYS 3.A O no hydrogen 3.021 N/A ARG 8.A N ALA 4.A O no hydrogen 2.882 N/A ARG 8.A NE GLU 5.A OE1 no hydrogen 3.321 N/A ARG 8.A NE GLU 5.A OE2 no hydrogen 2.989 N/A ARG 8.A NH1 GLU 5.A OE1 no hydrogen 2.782 N/A LEU 9.A N GLU 5.A O no hydrogen 3.001 N/A GLU 10.A N GLU 6.A O no hydrogen 2.861 N/A GLY 11.A N ALA 7.A O no hydrogen 2.788 N/A LYS 12.A N ARG 8.A O no hydrogen 2.951 N/A GLU 13.A N LEU 9.A O no hydrogen 2.933 N/A TYR 14.A N GLU 10.A O no hydrogen 2.886 N/A PHE 15.A N GLY 11.A O no hydrogen 2.856 N/A THR 16.A N LYS 12.A O no hydrogen 2.949 N/A THR 16.A OG1 LYS 12.A O no hydrogen 2.773 N/A LYS 17.A N GLU 13.A O no hydrogen 3.177 N/A LYS 17.A N TYR 14.A O no hydrogen 3.075 N/A SER 18.A N PHE 15.A O no hydrogen 2.820 N/A ASP 19.A N TYR 14.A O no hydrogen 2.838 N/A ASN 22.A N ASP 19.A OD2 no hydrogen 3.169 N/A ASN 22.A ND2 ASP 19.A OD1 no hydrogen 2.734 N/A ALA 23.A N ASP 19.A O no hydrogen 3.040 N/A VAL 24.A N TRP 20.A O no hydrogen 2.855 N/A LYS 25.A N PRO 21.A O no hydrogen 3.092 N/A ALA 26.A N ASN 22.A O no hydrogen 2.884 N/A TYR 27.A N ALA 23.A O no hydrogen 2.885 N/A THR 28.A N VAL 24.A O no hydrogen 2.905 N/A THR 28.A OG1 VAL 24.A O no hydrogen 2.843 N/A GLU 29.A N LYS 25.A O no hydrogen 3.086 N/A MET 30.A N ALA 26.A O no hydrogen 2.915 N/A ILE 31.A N TYR 27.A O no hydrogen 2.900 N/A LYS 32.A N THR 28.A O no hydrogen 2.852 N/A ARG 33.A N GLU 29.A O no hydrogen 2.927 N/A ALA 34.A N MET 30.A O no hydrogen 2.774 N/A ASP 37.A N ALA 34.A O no hydrogen 3.041 N/A ARG 39.A N ASP 37.A OD2 no hydrogen 3.015 N/A ARG 39.A NE ASP 37.A OD1 no hydrogen 3.331 N/A ARG 39.A NE ASP 37.A OD2 no hydrogen 3.100 N/A ARG 39.A NH2 ASP 37.A OD1 no hydrogen 2.800 N/A GLY 40.A N ASP 37.A O no hydrogen 3.229 N/A TYR 41.A OH PRO 35.A O no hydrogen 2.539 N/A SER 42.A N ALA 38.A O no hydrogen 3.130 N/A ASN 43.A N ARG 39.A O no hydrogen 2.739 N/A ARG 44.A N GLY 40.A O no hydrogen 2.780 N/A ARG 44.A NE ASP 60.A OD1 no hydrogen 2.713 N/A ARG 44.A NH1 THR 28.A OG1 no hydrogen 3.073 N/A ARG 44.A NH2 ASP 60.A OD1 no hydrogen 3.504 N/A ARG 44.A NH2 ASP 60.A OD2 no hydrogen 2.834 N/A ALA 45.A N TYR 41.A O no hydrogen 2.810 N/A ALA 46.A N SER 42.A O no hydrogen 2.976 N/A ALA 47.A N ASN 43.A O no hydrogen 3.201 N/A LEU 48.A N ARG 44.A O no hydrogen 2.866 N/A ALA 49.A N ALA 45.A O no hydrogen 2.842 N/A LYS 50.A N ALA 46.A O no hydrogen 3.233 N/A LEU 51.A N ALA 47.A O no hydrogen 3.089 N/A MET 52.A N ALA 49.A O no hydrogen 2.875 N/A SER 53.A N LEU 48.A O no hydrogen 2.870 N/A ALA 57.A N SER 53.A O no hydrogen 2.948 N/A ILE 58.A N PHE 54.A O no hydrogen 2.764 N/A ALA 59.A N PRO 55.A O no hydrogen 2.914 N/A ASP 60.A N GLU 56.A O no hydrogen 2.928 N/A CYS 61.A N ALA 57.A O no hydrogen 2.892 N/A CYS 61.A SG ALA 57.A O no hydrogen 3.368 N/A CYS 61.A SG ALA 74.A O no hydrogen 3.912 N/A ASN 62.A N ILE 58.A O no hydrogen 2.874 N/A LYS 63.A N ALA 59.A O no hydrogen 3.026 N/A ALA 64.A N ASP 60.A O no hydrogen 2.857 N/A ILE 65.A N CYS 61.A O no hydrogen 2.921 N/A GLU 66.A N ASN 62.A O no hydrogen 3.006 N/A LYS 67.A N LYS 63.A O no hydrogen 3.029 N/A LYS 67.A NZ GLU 36.A OE1 no hydrogen 2.924 N/A ASP 68.A N ALA 64.A O no hydrogen 2.901 N/A ASN 70.A N ASP 68.A OD2 no hydrogen 2.945 N/A PHE 71.A N ASP 68.A O no hydrogen 3.109 N/A ALA 74.A N PHE 71.A O no hydrogen 3.144 N/A TYR 75.A OH PRO 69.A O no hydrogen 2.595 N/A ILE 76.A N VAL 72.A O no hydrogen 3.104 N/A ARG 77.A N ARG 73.A O no hydrogen 2.772 N/A ARG 77.A NE SER 42.A OG no hydrogen 3.134 N/A LYS 78.A N ALA 74.A O no hydrogen 2.936 N/A ALA 79.A N TYR 75.A O no hydrogen 2.975 N/A THR 80.A N ILE 76.A O no hydrogen 2.958 N/A THR 80.A OG1 ARG 77.A O no hydrogen 2.668 N/A ALA 81.A N ARG 77.A O no hydrogen 3.011 N/A GLN 82.A N LYS 78.A O no hydrogen 2.743 N/A GLN 82.A NE2 THR 94.A OG1 no hydrogen 2.719 N/A ILE 83.A N ALA 79.A O no hydrogen 2.874 N/A ALA 84.A N THR 80.A O no hydrogen 3.100 N/A VAL 85.A N ALA 81.A O no hydrogen 3.099 N/A LYS 86.A N ILE 83.A O no hydrogen 3.013 N/A GLU 87.A N GLN 82.A O no hydrogen 2.908 N/A ALA 91.A N GLU 87.A O no hydrogen 2.901 N/A LEU 92.A N TYR 88.A O no hydrogen 2.941 N/A GLU 93.A N ALA 89.A O no hydrogen 3.298 N/A THR 94.A N SER 90.A O no hydrogen 2.927 N/A THR 94.A OG1 SER 90.A O no hydrogen 2.954 N/A LEU 95.A N ALA 91.A O no hydrogen 2.767 N/A ASP 96.A N LEU 92.A O no hydrogen 2.899 N/A ALA 97.A N GLU 93.A O no hydrogen 3.197 N/A ALA 98.A N THR 94.A O no hydrogen 2.935 N/A ARG 99.A N LEU 95.A O no hydrogen 2.793 N/A ARG 99.A NH1 ASP 96.A OD1 no hydrogen 2.992 N/A ARG 99.A NH2 ASP 96.A OD1 no hydrogen 3.148 N/A THR 100.A N ASP 96.A O no hydrogen 3.225 N/A THR 100.A OG1 ASP 96.A O no hydrogen 3.177 N/A LYS 101.A N ALA 97.A O no hydrogen 3.007 N/A LYS 101.A NZ PRO 69.A O no hydrogen 3.024 N/A LYS 101.A NZ ASN 70.A OD1 no hydrogen 3.220 N/A ASP 102.A N ALA 98.A O no hydrogen 2.809 N/A ALA 103.A N ARG 99.A O no hydrogen 3.069 N/A GLU 104.A N THR 100.A O no hydrogen 3.041 N/A VAL 105.A N LYS 101.A O no hydrogen 2.798 N/A ASN 106.A N ASP 102.A O no hydrogen 2.816 N/A GLY 108.A N ASP 102.A O no hydrogen 3.193 N/A SER 109.A N ASN 106.A O no hydrogen 3.261 N/A SER 109.A OG ASN 106.A O no hydrogen 3.295 N/A SER 110.A N ASP 102.A OD1 no hydrogen 3.196 N/A SER 110.A N ASP 102.A OD2 no hydrogen 2.975 N/A ALA 111.A N GLY 108.A O no hydrogen 3.093 N/A ILE 114.A N SER 110.A O no hydrogen 3.068 N/A ASP 115.A N ALA 111.A O no hydrogen 2.917 N/A GLN 116.A N ARG 112.A O no hydrogen 3.115 N/A GLN 116.A NE2 GLU 113.A O no hydrogen 3.521 N/A LEU 117.A N GLU 113.A O no hydrogen 3.047 N/A TYR 118.A N ILE 114.A O no hydrogen 2.880 N/A TYR 119.A N ASP 115.A O no hydrogen 2.981 N/A LYS 120.A N GLN 116.A O no hydrogen 3.052 N/A ALA 121.A N LEU 117.A O no hydrogen 2.821 N/A SER 122.A N TYR 118.A O no hydrogen 2.851 N/A GLN 123.A N TYR 119.A O no hydrogen 3.038 N/A GLN 124.A N LYS 120.A O no hydrogen 3.054 N/A GLN 124.A NE2 TYR 88.A OH no hydrogen 2.519 N/A ARG 125.A N ALA 121.A O no hydrogen 3.045 N/A ARG 125.A N SER 122.A O no hydrogen 3.194 N/A