Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4nvt_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A NE ASP 37.A OD1 no hydrogen 3.298 N/A ARG 2.A NH1 ARG 34.A O no hydrogen 2.726 N/A ARG 2.A NH2 GLY 33.A O no hydrogen 3.426 N/A ARG 2.A NH2 ARG 34.A O no hydrogen 3.112 N/A LEU 4.A N ASP 226.A O no hydrogen 3.156 N/A VAL 5.A N ASP 37.A O no hydrogen 2.886 N/A ALA 6.A N ALA 228.A O no hydrogen 2.845 N/A GLY 7.A N VAL 39.A O no hydrogen 2.756 N/A ASN 8.A N VAL 230.A O no hydrogen 2.726 N/A TRP 9.A N CYS 41.A O no hydrogen 3.071 N/A TRP 9.A NE1 SER 234.A O no hydrogen 2.867 N/A LYS 10.A N ASN 8.A OD1 no hydrogen 3.003 N/A LYS 10.A NZ GLU 97.A OE2 no hydrogen 2.688 N/A ASN 12.A N LYS 10.A O no hydrogen 2.860 N/A ASN 12.A ND2 TRP 9.A O no hydrogen 2.712 N/A LYS 14.A N SER 17.A OG no hydrogen 3.151 N/A SER 17.A N LYS 14.A O no hydrogen 2.729 N/A LEU 18.A N GLY 15.A O no hydrogen 3.100 N/A GLU 20.A N SER 17.A O no hydrogen 3.039 N/A ARG 22.A N LEU 18.A O no hydrogen 3.131 N/A ALA 23.A N THR 19.A O no hydrogen 2.819 N/A ILE 24.A N GLU 20.A O no hydrogen 2.975 N/A ALA 25.A N LEU 21.A O no hydrogen 2.879 N/A ALA 26.A N ARG 22.A O no hydrogen 3.092 N/A GLY 27.A N ALA 23.A O no hydrogen 2.899 N/A LEU 28.A N ILE 24.A O no hydrogen 3.195 N/A LEU 28.A N ALA 25.A O no hydrogen 3.157 N/A SER 29.A N ALA 26.A O no hydrogen 3.304 N/A ARG 34.A NH2 SER 29.A O no hydrogen 2.763 N/A LYS 35.A N LEU 32.A O no hydrogen 2.879 N/A ASP 37.A N PRO 3.A O no hydrogen 2.834 N/A VAL 39.A N VAL 5.A O no hydrogen 3.196 N/A ILE 40.A N GLY 60.A O no hydrogen 3.092 N/A CYS 41.A N GLY 7.A O no hydrogen 2.694 N/A CYS 41.A SG GLY 63.A O no hydrogen 3.946 N/A VAL 42.A N GLY 62.A O no hydrogen 3.120 N/A LEU 46.A N PRO 43.A O no hydrogen 2.902 N/A LEU 47.A N ALA 44.A O no hydrogen 3.409 N/A ARG 49.A NH2 THR 45.A O no hydrogen 2.749 N/A ALA 50.A N LEU 46.A O no hydrogen 2.822 N/A ALA 51.A N LEU 47.A O no hydrogen 2.763 N/A GLU 52.A N SER 48.A O no hydrogen 2.995 N/A THR 53.A N ARG 49.A O no hydrogen 2.866 N/A THR 53.A OG1 ARG 49.A O no hydrogen 2.862 N/A LEU 54.A N ALA 50.A O no hydrogen 3.000 N/A LEU 54.A N ALA 51.A O no hydrogen 3.299 N/A GLU 55.A N GLU 52.A O no hydrogen 3.497 N/A GLU 57.A N LEU 54.A O no hydrogen 2.869 N/A GLY 60.A N ALA 38.A O no hydrogen 2.790 N/A GLY 62.A N ILE 40.A O no hydrogen 2.860 N/A GLY 63.A N HIS 90.A O no hydrogen 2.880 N/A GLN 64.A NE2 LYS 10.A O no hydrogen 2.929 N/A GLN 64.A NE2 CYS 41.A O no hydrogen 3.016 N/A HIS 67.A N ILE 78.A O no hydrogen 2.773 N/A LYS 69.A N HIS 67.A ND1 no hydrogen 3.163 N/A LYS 69.A NZ HIS 74.A NE2 no hydrogen 2.869 N/A THR 70.A OG1 GLU 81.A OE2 no hydrogen 2.471 N/A HIS 74.A N GLY 72.A O no hydrogen 2.942 N/A ASP 77.A N HIS 74.A O no hydrogen 2.924 N/A SER 79.A OG THR 70.A O no hydrogen 2.950 N/A SER 79.A OG GLU 81.A OE1 no hydrogen 3.511 N/A GLU 81.A N SER 79.A OG no hydrogen 3.268 N/A MET 82.A N SER 79.A O no hydrogen 2.965 N/A MET 82.A N SER 79.A OG no hydrogen 3.417 N/A LEU 83.A N SER 79.A O no hydrogen 3.239 N/A LYS 84.A N PRO 80.A O no hydrogen 2.930 N/A LYS 84.A NZ GLY 120.A O no hydrogen 2.888 N/A GLU 85.A N GLU 81.A O no hydrogen 2.817 N/A ALA 86.A N MET 82.A O no hydrogen 2.868 N/A GLY 87.A N LYS 84.A O no hydrogen 3.022 N/A ALA 88.A N LEU 83.A O no hydrogen 3.153 N/A THR 89.A N LEU 61.A O no hydrogen 2.770 N/A THR 89.A OG1 LEU 61.A O no hydrogen 3.243 N/A THR 89.A OG1 HIS 90.A ND1 no hydrogen 2.875 N/A HIS 90.A N LEU 61.A O no hydrogen 3.127 N/A HIS 90.A ND1 THR 89.A OG1 no hydrogen 2.875 N/A VAL 91.A N VAL 122.A O no hydrogen 3.085 N/A ILE 92.A N GLY 63.A O no hydrogen 2.908 N/A LEU 93.A N ILE 124.A O no hydrogen 2.809 N/A SER 96.A N GLU 165.A OE2 no hydrogen 2.795 N/A SER 96.A OG GLU 165.A OE1 no hydrogen 2.587 N/A SER 96.A OG GLU 165.A OE2 no hydrogen 3.389 N/A GLU 97.A N HIS 95.A ND1 no hydrogen 3.087 N/A ARG 98.A N HIS 95.A O no hydrogen 2.810 N/A ARG 98.A NE GLU 104.A OE2 no hydrogen 2.870 N/A ARG 99.A N HIS 95.A O no hydrogen 2.876 N/A ARG 99.A NE GLY 94.A O no hydrogen 2.734 N/A ARG 99.A NE CYS 126.A O no hydrogen 3.156 N/A ARG 99.A NH1 ASN 106.A OD1 no hydrogen 2.773 N/A ARG 99.A NH2 CYS 126.A O no hydrogen 2.814 N/A ARG 99.A NH2 SER 150.A OG no hydrogen 2.870 N/A THR 100.A N SER 96.A O no hydrogen 2.832 N/A THR 100.A OG1 SER 96.A O no hydrogen 3.174 N/A ASP 101.A N GLU 97.A O no hydrogen 2.832 N/A HIS 102.A N ARG 98.A O no hydrogen 2.876 N/A GLU 104.A N ARG 98.A O no hydrogen 3.328 N/A LEU 108.A N SER 105.A OG no hydrogen 3.058 N/A ILE 109.A N SER 105.A O no hydrogen 3.101 N/A CYS 110.A N ASN 106.A O no hydrogen 2.844 N/A ALA 111.A N LYS 107.A O no hydrogen 3.051 N/A LYS 112.A N LEU 108.A O no hydrogen 2.718 N/A LYS 112.A NZ ASP 65.A OD1 no hydrogen 2.537 N/A LYS 112.A NZ ALA 66.A O no hydrogen 3.244 N/A LYS 112.A NZ GLU 104.A OE2 no hydrogen 3.232 N/A THR 113.A N ILE 109.A O no hydrogen 2.815 N/A THR 113.A OG1 ILE 109.A O no hydrogen 2.761 N/A GLU 114.A N CYS 110.A O no hydrogen 3.158 N/A ALA 115.A N ALA 111.A O no hydrogen 3.210 N/A ALA 116.A N LYS 112.A O no hydrogen 2.889 N/A TRP 117.A N THR 113.A O no hydrogen 2.965 N/A TRP 117.A NE1 THR 160.A OG1 no hydrogen 3.127 N/A ALA 118.A N GLU 114.A O no hydrogen 2.994 N/A ALA 119.A N ALA 115.A O no hydrogen 2.922 N/A ALA 119.A N ALA 116.A O no hydrogen 3.071 N/A GLY 120.A N TRP 117.A O no hydrogen 2.836 N/A LEU 121.A N ALA 116.A O no hydrogen 2.998 N/A VAL 122.A N THR 89.A O no hydrogen 2.996 N/A ALA 123.A N ASN 159.A O no hydrogen 2.925 N/A ILE 124.A N VAL 91.A O no hydrogen 2.799 N/A VAL 125.A N ILE 161.A O no hydrogen 2.783 N/A CYS 126.A N LEU 93.A O no hydrogen 2.834 N/A CYS 126.A SG LEU 93.A O no hydrogen 3.953 N/A CYS 126.A SG ILE 124.A O no hydrogen 4.033 N/A VAL 127.A N ALA 163.A O no hydrogen 2.924 N/A GLY 128.A N GLN 146.A OE1 no hydrogen 2.773 N/A GLU 129.A N GLU 129.A OE1 no hydrogen 2.783 N/A THR 130.A N GLU 133.A OE1 no hydrogen 2.862 N/A THR 130.A OG1 GLU 133.A OE1 no hydrogen 3.222 N/A GLU 133.A N THR 130.A OG1 no hydrogen 2.975 N/A ARG 134.A N THR 130.A O no hydrogen 3.028 N/A ARG 134.A NH1 GLU 129.A OE2 no hydrogen 3.007 N/A ARG 134.A NH2 ASP 180.A OD1 no hydrogen 2.955 N/A LYS 135.A N ALA 131.A O no hydrogen 2.872 N/A ALA 136.A N SER 132.A O no hydrogen 2.876 N/A GLU 137.A N ARG 134.A O no hydrogen 2.821 N/A ARG 138.A N GLU 133.A O no hydrogen 3.038 N/A ARG 138.A NH2 ASP 141.A OD2 no hydrogen 3.185 N/A VAL 142.A N ARG 138.A O no hydrogen 2.780 N/A ILE 143.A N ALA 139.A O no hydrogen 3.066 N/A GLY 144.A N LEU 140.A O no hydrogen 2.909 N/A ASP 145.A N ASP 141.A O no hydrogen 2.992 N/A GLN 146.A N VAL 142.A O no hydrogen 2.843 N/A GLN 146.A NE2 GLY 128.A O no hydrogen 3.597 N/A LEU 147.A N ILE 143.A O no hydrogen 2.877 N/A SER 148.A N GLY 144.A O no hydrogen 3.050 N/A SER 148.A OG GLY 144.A O no hydrogen 3.049 N/A GLY 149.A N ASP 145.A O no hydrogen 2.978 N/A SER 150.A N GLN 146.A O no hydrogen 2.848 N/A SER 150.A OG ASN 106.A OD1 no hydrogen 3.031 N/A SER 150.A OG GLN 146.A O no hydrogen 2.853 N/A LEU 151.A N LEU 147.A O no hydrogen 3.360 N/A THR 156.A N ASN 159.A OD1 no hydrogen 2.748 N/A GLU 158.A N THR 156.A OG1 no hydrogen 3.165 N/A ASN 159.A N THR 156.A O no hydrogen 3.335 N/A ASN 159.A N THR 156.A OG1 no hydrogen 2.871 N/A ASN 159.A ND2 GLY 154.A O no hydrogen 3.247 N/A THR 160.A OG1 ASN 159.A OD1 no hydrogen 2.712 N/A ILE 161.A N ALA 123.A O no hydrogen 2.767 N/A ILE 162.A N ARG 204.A O no hydrogen 2.895 N/A ALA 163.A N VAL 125.A O no hydrogen 3.005 N/A TYR 164.A N LEU 206.A O no hydrogen 2.999 N/A TYR 164.A OH GLU 129.A OE1 no hydrogen 2.636 N/A TYR 164.A OH GLU 129.A OE2 no hydrogen 3.229 N/A GLU 165.A N VAL 127.A O no hydrogen 2.729 N/A TRP 168.A N GLU 129.A O no hydrogen 3.041 N/A TRP 168.A NE1 TYR 164.A OH no hydrogen 3.203 N/A ALA 169.A N PRO 166.A O no hydrogen 3.074 N/A ILE 170.A N VAL 167.A O no hydrogen 3.035 N/A THR 172.A N ALA 169.A O no hydrogen 3.064 N/A THR 172.A OG1 ALA 169.A O no hydrogen 2.709 N/A LEU 174.A N THR 172.A OG1 no hydrogen 3.188 N/A THR 177.A N ASP 180.A OD2 no hydrogen 2.970 N/A THR 177.A OG1 ASP 180.A OD2 no hydrogen 3.112 N/A GLN 179.A N.A GLN 179.A OE1.A no hydrogen 2.941 N/A ASP 180.A N THR 177.A OG1 no hydrogen 3.017 N/A VAL 181.A N THR 177.A O no hydrogen 2.999 N/A ARG 182.A N VAL 178.A O no hydrogen 2.834 N/A ARG 182.A NH1 GLN 179.A OE1.B no hydrogen 3.268 N/A ALA 183.A N GLN 179.A O.A no hydrogen 3.017 N/A ALA 183.A N GLN 179.A O.B no hydrogen 3.057 N/A ALA 184.A N ASP 180.A O no hydrogen 3.045 N/A HIS 185.A N VAL 181.A O no hydrogen 2.889 N/A HIS 185.A ND1 ASP 224.A O no hydrogen 2.846 N/A ALA 186.A N ARG 182.A O no hydrogen 2.778 N/A PHE 187.A N ALA 183.A O no hydrogen 3.165 N/A MET 188.A N ALA 184.A O no hydrogen 2.972 N/A ARG 189.A N HIS 185.A O no hydrogen 2.905 N/A ARG 189.A NE ASP 224.A OD1 no hydrogen 2.644 N/A ARG 189.A NH1 GLY 200.A O no hydrogen 2.776 N/A ARG 189.A NH1 LEU 203.A O no hydrogen 2.957 N/A ARG 189.A NH2 LEU 203.A O no hydrogen 3.324 N/A ARG 189.A NH2 ASP 224.A OD1 no hydrogen 3.512 N/A ARG 189.A NH2 ASP 226.A OD2 no hydrogen 2.969 N/A GLU 190.A N ALA 186.A O no hydrogen 3.094 N/A GLN 191.A N PHE 187.A O no hydrogen 3.007 N/A GLN 191.A NE2 GLU 190.A OE2 no hydrogen 2.766 N/A LEU 192.A N MET 188.A O no hydrogen 3.085 N/A ILE 193.A N ARG 189.A O no hydrogen 2.913 N/A GLU 194.A N GLU 190.A O no hydrogen 2.909 N/A ARG 195.A N GLN 191.A O no hydrogen 3.046 N/A ARG 195.A NH1 LEU 151.A O no hydrogen 2.859 N/A ARG 195.A NH2 LEU 151.A O no hydrogen 3.079 N/A ARG 195.A NH2 ASP 153.A OD1 no hydrogen 2.632 N/A PHE 196.A N LEU 192.A O no hydrogen 2.685 N/A GLY 197.A N ILE 193.A O no hydrogen 2.781 N/A LYS 199.A NZ PHE 196.A O no hydrogen 3.210 N/A GLY 200.A N GLY 197.A O no hydrogen 2.785 N/A ALA 201.A N ALA 198.A O no hydrogen 3.126 N/A HIS 202.A N LYS 199.A O no hydrogen 3.036 N/A HIS 202.A ND1 ALA 198.A O no hydrogen 2.984 N/A LEU 205.A N ASP 226.A OD2 no hydrogen 2.916 N/A LEU 206.A N ILE 162.A O no hydrogen 2.773 N/A TYR 207.A N GLY 227.A O no hydrogen 2.916 N/A GLY 208.A N TYR 164.A O no hydrogen 2.730 N/A LYS 212.A N ASN 215.A OD1 no hydrogen 2.577 N/A ASN 215.A N LYS 212.A O no hydrogen 2.956 N/A ASN 215.A ND2 SER 210.A O no hydrogen 2.903 N/A ALA 216.A N LYS 212.A O no hydrogen 3.107 N/A LEU 219.A N ASN 215.A O no hydrogen 3.322 N/A LEU 220.A N ALA 216.A O no hydrogen 2.955 N/A GLY 221.A N ALA 217.A O no hydrogen 3.167 N/A VAL 222.A N LEU 219.A O no hydrogen 3.179 N/A VAL 225.A N VAL 222.A O no hydrogen 3.172 N/A ASP 226.A N LEU 205.A O no hydrogen 2.797 N/A ALA 228.A N LEU 4.A O no hydrogen 3.086 N/A LEU 229.A N TYR 207.A O no hydrogen 2.924 N/A VAL 230.A N ALA 6.A O no hydrogen 2.702 N/A SER 234.A N GLY 231.A O no hydrogen 2.913 N/A SER 234.A OG ASN 8.A O no hydrogen 3.317 N/A SER 234.A OG VAL 230.A O no hydrogen 3.237 N/A SER 234.A OG GLY 231.A O no hydrogen 2.499 N/A LEU 235.A N GLY 232.A O no hydrogen 3.010 N/A ALA 237.A N GLU 20.A OE1 no hydrogen 2.656 N/A PHE 240.A N LYS 236.A O no hydrogen 2.966 N/A LEU 241.A N ALA 237.A O no hydrogen 2.837 N/A ALA 242.A N ALA 238.A O no hydrogen 2.991 N/A ILE 243.A N ASP 239.A O no hydrogen 3.098 N/A CYS 244.A N PHE 240.A O no hydrogen 3.101 N/A CYS 244.A SG PHE 240.A O no hydrogen 3.413 N/A GLU 245.A N LEU 241.A O no hydrogen 2.778 N/A THR 246.A N ILE 243.A O no hydrogen 3.053 N/A THR 246.A OG1 ILE 243.A O no hydrogen 2.669 N/A TYR 247.A N CYS 244.A O no hydrogen 3.029 N/A ARG 248.A N GLU 245.A O no hydrogen 3.115 N/A