Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2vmc_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 3.A N ALA 148.A O no hydrogen 2.762 N/A CYS 5.A N LEU 146.A O no hydrogen 2.958 N/A CYS 5.A SG VAL 3.A O no hydrogen 4.010 N/A CYS 5.A SG LEU 146.A O no hydrogen 3.467 N/A LEU 6.A N GLU 145.A OE2 no hydrogen 2.759 N/A ALA 7.A N GLU 145.A OE1 no hydrogen 2.958 N/A ASN 8.A N SER 4.A O.A no hydrogen 3.160 N/A ASN 8.A N SER 4.A O.B no hydrogen 3.176 N/A ASN 8.A ND2 SER 4.A O.A no hydrogen 2.856 N/A ASN 8.A ND2 SER 4.A O.B no hydrogen 2.846 N/A ALA 9.A N LEU 6.A O no hydrogen 2.952 N/A LEU 10.A N CYS 5.A O no hydrogen 2.983 N/A ASN 12.A N GLY 61.A O no hydrogen 2.889 N/A ASN 12.A ND2 GLY 61.A O no hydrogen 3.537 N/A ARG 14.A N VAL 59.A O no hydrogen 2.905 N/A SER 15.A OG ASP 18.A OD1 no hydrogen 2.552 N/A SER 16.A N PHE 57.A O no hydrogen 3.017 N/A SER 16.A OG GLN 56.A OE1 no hydrogen 2.760 N/A SER 16.A OG PHE 57.A O no hydrogen 3.323 N/A THR 17.A OG1 GLN 56.A OE1 no hydrogen 2.746 N/A TYR 19.A N SER 48.A O no hydrogen 2.892 N/A HIS 23.A N ASN 20.A O no hydrogen 2.904 N/A HIS 23.A ND1 ASN 20.A OD1 no hydrogen 2.860 N/A GLY 24.A N ALA 21.A O no hydrogen 3.198 N/A LYS 26.A NZ ASN 27.A OD1 no hydrogen 2.995 N/A ASN 27.A N GLY 24.A O no hydrogen 2.932 N/A ASN 27.A ND2 SER 44.A O no hydrogen 3.024 N/A SER 28.A N VAL 25.A O no hydrogen 2.953 N/A SER 28.A OG VAL 25.A O no hydrogen 2.693 N/A LEU 30.A N TRP 144.A O no hydrogen 2.805 N/A ASN 31.A N GLN 74.A OE1 no hydrogen 2.721 N/A PHE 32.A N ILE 29.A O no hydrogen 2.964 N/A ASN 34.A N GLU 45.A OE2 no hydrogen 2.991 N/A ASN 34.A ND2 GLY 43.A O no hydrogen 3.122 N/A SER 35.A N ASP 42.A OD2 no hydrogen 2.870 N/A LYS 36.A NZ SER 33.A OG.B no hydrogen 2.865 N/A LYS 36.A NZ GLU 45.A OE1 no hydrogen 3.515 N/A LYS 36.A NZ GLU 45.A OE2 no hydrogen 2.839 N/A ASP 37.A N SER 35.A OG no hydrogen 3.245 N/A SER 39.A N ASP 37.A OD1 no hydrogen 2.739 N/A SER 39.A OG ASP 37.A OD1 no hydrogen 2.713 N/A SER 39.A OG ASP 37.A OD2 no hydrogen 3.434 N/A SER 44.A N ASP 22.A O no hydrogen 2.879 N/A SER 44.A OG ASP 22.A O no hydrogen 3.480 N/A SER 44.A OG SER 46.A O no hydrogen 2.748 N/A GLU 45.A N ASP 78.A OD1 no hydrogen 2.845 N/A SER 46.A OG SER 48.A OG no hydrogen 3.047 N/A TRP 47.A N LEU 142.A O no hydrogen 3.083 N/A TRP 47.A NE1 THR 17.A O no hydrogen 2.985 N/A TRP 47.A NE1 ASP 18.A OD1 no hydrogen 2.916 N/A SER 48.A N HIS 23.A O no hydrogen 2.940 N/A SER 48.A OG SER 46.A OG no hydrogen 3.047 N/A SER 48.A OG SER 141.A OG no hydrogen 2.636 N/A SER 49.A N ILE 140.A O no hydrogen 2.998 N/A SER 49.A OG VAL 51.A O no hydrogen 2.835 N/A SER 50.A N THR 17.A OG1 no hydrogen 2.869 N/A VAL 51.A N THR 17.A OG1 no hydrogen 3.215 N/A ASN 55.A N ASP 53.A OD1 no hydrogen 2.955 N/A ASN 55.A ND2 ASP 53.A OD2 no hydrogen 3.099 N/A GLN 56.A NE2 ASP 53.A OD1 no hydrogen 2.916 N/A PHE 57.A N SER 16.A OG no hydrogen 2.993 N/A ILE 58.A N ILE 131.A O no hydrogen 3.152 N/A VAL 59.A N ARG 14.A O no hydrogen 2.814 N/A ALA 60.A N ILE 129.A O no hydrogen 2.746 N/A GLY 61.A N ASN 12.A O no hydrogen 2.951 N/A SER 62.A N ARG 127.A O no hydrogen 3.287 N/A LYS 66.A N ALA 126.A O no hydrogen 2.903 N/A LYS 66.A NZ SER 62.A OG no hydrogen 2.707 N/A LYS 66.A NZ SER 64.A O no hydrogen 2.677 N/A LYS 66.A NZ ARG 127.A O no hydrogen 2.811 N/A PHE 68.A N ILE 124.A O no hydrogen 2.723 N/A VAL 69.A N TYR 147.A O no hydrogen 2.802 N/A ALA 70.A N TYR 147.A O no hydrogen 3.438 N/A ILE 71.A N ILE 118.A O no hydrogen 3.010 N/A SER 72.A N GLU 145.A O no hydrogen 2.992 N/A SER 72.A OG THR 117.A OG1 no hydrogen 2.627 N/A THR 73.A N VAL 116.A O no hydrogen 2.915 N/A THR 73.A OG1 ASN 109.A OD1 no hydrogen 2.679 N/A GLN 74.A N ARG 143.A O no hydrogen 2.797 N/A GLN 74.A NE2 ASN 31.A OD1 no hydrogen 3.028 N/A GLN 74.A NE2 ASN 113.A O no hydrogen 2.938 N/A ARG 76.A N GLN 81.A O no hydrogen 3.005 N/A ARG 76.A NE ASP 78.A OD1 no hydrogen 2.795 N/A ARG 76.A NH1 GLN 81.A OE1 no hydrogen 3.018 N/A ARG 76.A NH2 ASP 78.A OD1 no hydrogen 3.567 N/A ARG 76.A NH2 ASP 78.A OD2 no hydrogen 2.917 N/A GLY 77.A N GLU 45.A O no hydrogen 3.024 N/A GLN 81.A N HIS 79.A O no hydrogen 2.898 N/A TRP 82.A N ASN 137.A O no hydrogen 3.195 N/A THR 84.A N THR 135.A O no hydrogen 2.966 N/A THR 84.A OG1 THR 135.A OG1 no hydrogen 2.640 N/A SER 85.A OG THR 135.A OG1 no hydrogen 2.736 N/A TYR 86.A N ILE 106.A O no hydrogen 3.065 N/A LYS 87.A N HIS 132.A O no hydrogen 2.917 N/A ARG 89.A N ALA 130.A O no hydrogen 3.068 N/A ARG 89.A NE GLU 99.A OE1 no hydrogen 3.389 N/A ARG 89.A NE GLU 99.A OE2 no hydrogen 3.121 N/A ARG 89.A NH2 GLU 99.A OE2 no hydrogen 3.241 N/A TYR 90.A N VAL 98.A O no hydrogen 2.876 N/A THR 91.A N SER 128.A O no hydrogen 3.057 N/A THR 91.A OG1 ASN 96.A O no hydrogen 2.731 N/A ASN 94.A N THR 91.A OG1 no hydrogen 2.870 N/A ASN 94.A ND2 SER 128.A OG no hydrogen 3.029 N/A VAL 95.A N ASP 93.A OD1 no hydrogen 2.913 N/A ASN 96.A N ASP 93.A OD1 no hydrogen 2.689 N/A ASN 96.A ND2 ASP 93.A OD2 no hydrogen 2.914 N/A VAL 98.A N TYR 90.A O no hydrogen 2.693 N/A TYR 100.A N LEU 88.A O no hydrogen 2.892 N/A ASN 101.A ND2 GLU 104.A OE1 no hydrogen 2.823 N/A GLY 103.A N TYR 100.A O no hydrogen 2.986 N/A GLU 104.A N TYR 100.A O no hydrogen 3.271 N/A GLU 104.A N ASN 101.A O no hydrogen 3.159 N/A ILE 106.A N TYR 86.A O no hydrogen 2.799 N/A ALA 108.A N THR 84.A O no hydrogen 2.896 N/A ASN 109.A N VAL 83.A O no hydrogen 2.990 N/A ASN 109.A ND2 THR 73.A O no hydrogen 3.075 N/A ARG 112.A NE ASP 80.A OD1 no hydrogen 2.770 N/A ARG 112.A NH1 GLY 77.A O no hydrogen 3.169 N/A ARG 112.A NH2 ASP 80.A OD1 no hydrogen 3.142 N/A SER 114.A N ASP 111.A OD1 no hydrogen 2.950 N/A SER 114.A OG ASP 111.A OD2 no hydrogen 2.751 N/A VAL 116.A N THR 73.A O no hydrogen 3.018 N/A THR 117.A OG1 SER 72.A OG no hydrogen 2.627 N/A ILE 118.A N ILE 71.A O no hydrogen 2.932 N/A PHE 120.A N VAL 69.A O no hydrogen 2.888 N/A ILE 124.A N PHE 68.A O no hydrogen 2.886 N/A ALA 126.A N LYS 66.A O no hydrogen 2.961 N/A ARG 127.A N THR 91.A O no hydrogen 2.883 N/A ARG 127.A NE ASP 63.A O no hydrogen 2.832 N/A ARG 127.A NH1 LEU 92.A O no hydrogen 2.934 N/A SER 128.A N THR 91.A O no hydrogen 3.298 N/A ILE 129.A N ALA 60.A O no hydrogen 2.883 N/A ALA 130.A N ARG 89.A O no hydrogen 2.820 N/A ILE 131.A N ILE 58.A O no hydrogen 3.086 N/A HIS 132.A N LYS 87.A O no hydrogen 2.868 N/A GLN 134.A N SER 85.A O no hydrogen 2.872 N/A GLN 134.A NE2 LYS 54.A O no hydrogen 3.546 N/A GLN 134.A NE2 HIS 132.A O no hydrogen 3.075 N/A THR 135.A N SER 85.A O no hydrogen 3.423 N/A THR 135.A OG1 THR 84.A OG1 no hydrogen 2.640 N/A THR 135.A OG1 SER 85.A OG no hydrogen 2.736 N/A ASN 137.A N TRP 82.A O no hydrogen 2.790 N/A ASN 138.A ND2 ASP 80.A O no hydrogen 2.925 N/A HIS 139.A N ASN 137.A O no hydrogen 2.833 N/A HIS 139.A NE2 SER 49.A O no hydrogen 2.738 N/A SER 141.A OG SER 48.A OG no hydrogen 2.636 N/A SER 141.A OG GLN 81.A OE1 no hydrogen 2.644 N/A LEU 142.A N TRP 47.A O no hydrogen 3.060 N/A ARG 143.A N GLN 74.A O no hydrogen 2.902 N/A ARG 143.A NE GLY 75.A O no hydrogen 2.857 N/A ARG 143.A NH1 PHE 32.A O no hydrogen 2.915 N/A ARG 143.A NH2 GLY 75.A O no hydrogen 3.127 N/A ARG 143.A NH2 ARG 112.A O no hydrogen 3.023 N/A ARG 143.A NH2 ASN 113.A OD1 no hydrogen 2.856 N/A TRP 144.A N SER 28.A O no hydrogen 2.811 N/A GLU 145.A N SER 72.A O no hydrogen 3.040 N/A LEU 146.A N GLU 145.A OE2 no hydrogen 2.825 N/A TYR 147.A N ALA 70.A O no hydrogen 2.947 N/A ALA 148.A N VAL 3.A O no hydrogen 3.086 N/A LEU 149.A N HIS 67.A O no hydrogen 3.018 N/A SER 155.A N LYS 152.A O no hydrogen 3.217 N/A SER 155.A OG LYS 152.A O no hydrogen 2.539 N/A SER 158.A N GLU 249.A O no hydrogen 2.779 N/A GLN 160.A N ALA 247.A O no hydrogen 2.983 N/A GLN 160.A NE2 VAL 188.A O no hydrogen 2.614 N/A GLY 162.A N TYR 245.A O no hydrogen 3.286 N/A VAL 164.A N PHE 243.A O no hydrogen 2.905 N/A SER 165.A OG THR 242.A OG1 no hydrogen 2.644 N/A ILE 166.A N LEU 241.A O no hydrogen 3.150 N/A GLY 167.A N ASP 240.A OD1 no hydrogen 2.997 N/A ARG 169.A NE TYR 239.A O no hydrogen 3.059 N/A ARG 169.A NH2 TYR 239.A O no hydrogen 3.011 N/A SER 170.A N ASP 168.A OD1 no hydrogen 3.036 N/A SER 170.A OG ASP 168.A OD1 no hydrogen 2.579 N/A SER 170.A OG ASP 168.A OD2 no hydrogen 3.155 N/A ASN 172.A N ARG 169.A O no hydrogen 2.962 N/A THR 175.A OG1 ASN 235.A OD1 no hydrogen 2.541 N/A GLY 176.A N GLY 234.A O no hydrogen 2.773 N/A ARG 178.A N THR 232.A O no hydrogen 2.988 N/A ARG 178.A NE GLY 176.A O no hydrogen 2.768 N/A ARG 178.A NH1 SER 173.A O no hydrogen 3.050 N/A ARG 178.A NH1 ASN 236.A O no hydrogen 2.808 N/A ARG 178.A NH2 GLY 176.A O no hydrogen 3.486 N/A ARG 178.A NH2 GLY 234.A O no hydrogen 3.002 N/A ARG 178.A NH2 ASN 236.A O no hydrogen 2.897 N/A ILE 180.A N PHE 230.A O no hydrogen 3.010 N/A ARG 182.A N LEU 228.A O no hydrogen 2.879 N/A ARG 182.A NE ILE 166.A O no hydrogen 2.961 N/A ARG 182.A NH1 VAL 181.A O no hydrogen 3.007 N/A ARG 182.A NH2 ILE 166.A O no hydrogen 3.086 N/A HIS 183.A ND1.A ASP 227.A OD1 no hydrogen 2.502 N/A HIS 183.A ND1.B ASP 227.A OD1 no hydrogen 2.543 N/A VAL 184.A N PHE 226.A O no hydrogen 2.800 N/A PHE 186.A N LYS 224.A O no hydrogen 2.947 N/A VAL 188.A N GLN 160.A OE1 no hydrogen 2.930 N/A PHE 190.A N THR 223.A O no hydrogen 2.930 N/A SER 192.A N GLU 249.A OE2 no hydrogen 2.685 N/A SER 192.A OG GLU 249.A OE2 no hydrogen 2.671 N/A ILE 195.A N VAL 248.A O no hydrogen 2.884 N/A SER 197.A N VAL 246.A O no hydrogen 2.807 N/A GLY 199.A N ASP 244.A O no hydrogen 3.098 N/A CYS 200.A SG LYS 202.A O no hydrogen 3.240 N/A CYS 200.A SG THR 242.A O no hydrogen 3.550 N/A LYS 201.A N THR 242.A O no hydrogen 2.826 N/A LYS 201.A NZ GLU 163.A OE1 no hydrogen 2.705 N/A LYS 201.A NZ ASP 244.A OD1 no hydrogen 2.894 N/A LYS 202.A NZ ASP 240.A OD2 no hydrogen 2.896 N/A ASP 204.A N ASP 240.A O no hydrogen 3.059 N/A HIS 206.A N ALA 237.A O no hydrogen 2.773 N/A ASP 208.A N GLN 211.A O no hydrogen 2.843 N/A GLN 211.A N ASP 208.A O no hydrogen 3.006 N/A ARG 213.A NH1 ASP 208.A OD2 no hydrogen 2.886 N/A ARG 213.A NH1 ASN 236.A OD1 no hydrogen 2.911 N/A GLU 215.A N ILE 231.A O no hydrogen 2.990 N/A LYS 217.A N THR 229.A O no hydrogen 3.053 N/A SER 218.A OG VAL 196.A O no hydrogen 2.850 N/A GLU 219.A N ASP 227.A O no hydrogen 2.925 N/A ASN 220.A ND2 ASP 227.A OD2 no hydrogen 2.824 N/A THR 222.A N GLY 225.A O no hydrogen 2.702 N/A THR 222.A OG1 GLY 225.A O no hydrogen 3.419 N/A THR 223.A OG1 GLU 189.A OE2 no hydrogen 3.002 N/A LYS 224.A N THR 222.A OG1 no hydrogen 3.103 N/A GLY 225.A N THR 222.A OG1 no hydrogen 3.202 N/A PHE 226.A N VAL 184.A O no hydrogen 3.041 N/A ASP 227.A N GLU 219.A O no hydrogen 2.873 N/A LEU 228.A N ARG 182.A O no hydrogen 2.923 N/A THR 229.A N LYS 217.A O no hydrogen 2.892 N/A THR 229.A OG1 GLU 219.A OE1 no hydrogen 2.652 N/A PHE 230.A N ILE 180.A O no hydrogen 2.847 N/A ILE 231.A N GLU 215.A O no hydrogen 2.858 N/A THR 232.A N ARG 178.A O no hydrogen 2.967 N/A THR 232.A OG1 ARG 213.A O no hydrogen 2.801 N/A ASN 235.A N ASP 208.A OD2 no hydrogen 2.878 N/A ASN 236.A N TRP 233.A O no hydrogen 3.504 N/A ASN 236.A ND2 HIS 206.A O no hydrogen 3.077 N/A ASN 236.A ND2 GLN 211.A O no hydrogen 2.829 N/A VAL 238.A N LEU 171.A O no hydrogen 2.931 N/A TYR 239.A N ASP 204.A O no hydrogen 2.814 N/A ASP 240.A N ASP 204.A O no hydrogen 2.992 N/A LEU 241.A N ASP 240.A OD1 no hydrogen 2.983 N/A THR 242.A N LYS 202.A O no hydrogen 3.159 N/A THR 242.A OG1 SER 165.A OG no hydrogen 2.644 N/A PHE 243.A N VAL 164.A O no hydrogen 2.871 N/A ASP 244.A N GLY 199.A O no hydrogen 3.026 N/A TYR 245.A N GLY 162.A O no hydrogen 2.864 N/A VAL 246.A N SER 197.A O no hydrogen 2.718 N/A ALA 247.A N GLN 160.A O no hydrogen 2.800 N/A VAL 248.A N ILE 195.A O no hydrogen 2.965 N/A GLU 249.A N SER 158.A O no hydrogen 2.759 N/A