Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3vjt_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 3.A N GLN 6.A OE1 no hydrogen 2.879 N/A GLN 6.A N SER 3.A OG no hydrogen 3.375 N/A GLN 7.A N SER 3.A O no hydrogen 3.044 N/A GLN 7.A NE2 LEU 2.A O no hydrogen 2.929 N/A GLN 7.A NE2 SER 3.A O no hydrogen 3.323 N/A HIS 8.A N GLU 4.A O no hydrogen 2.863 N/A ILE 9.A N GLU 5.A O no hydrogen 2.708 N/A ILE 10.A N GLN 6.A O no hydrogen 3.058 N/A ALA 11.A N GLN 7.A O no hydrogen 3.185 N/A ILE 12.A N HIS 8.A O no hydrogen 2.928 N/A LEU 13.A N ILE 9.A O no hydrogen 3.054 N/A LEU 14.A N ILE 10.A O no hydrogen 2.848 N/A ASP 15.A N ALA 11.A O no hydrogen 3.019 N/A ALA 16.A N ILE 12.A O no hydrogen 2.846 N/A HIS 17.A N LEU 13.A O no hydrogen 2.876 N/A HIS 18.A N LEU 14.A O no hydrogen 2.964 N/A HIS 18.A NE2 GLU 141.A OE1 no hydrogen 3.168 N/A HIS 18.A NE2 GLU 141.A OE2 no hydrogen 2.958 N/A LYS 19.A N ASP 15.A O no hydrogen 2.930 N/A LYS 19.A N ALA 16.A O no hydrogen 3.282 N/A LYS 19.A NZ ASP 15.A OD2 no hydrogen 3.536 N/A THR 20.A N HIS 17.A O no hydrogen 2.846 N/A THR 20.A OG1 ALA 16.A O no hydrogen 2.829 N/A THR 20.A OG1 HIS 17.A O no hydrogen 3.137 N/A TYR 21.A N HIS 17.A O no hydrogen 2.843 N/A TYR 21.A OH TYR 25.A OH no hydrogen 2.542 N/A THR 24.A N ASP 22.A OD1 no hydrogen 3.099 N/A THR 24.A OG1 ASP 22.A OD1 no hydrogen 2.596 N/A THR 24.A OG1 ASP 22.A OD2 no hydrogen 2.983 N/A TYR 25.A N ASP 22.A O no hydrogen 2.838 N/A TYR 25.A OH TYR 21.A OH no hydrogen 2.542 N/A ALA 26.A N ASP 22.A OD2 no hydrogen 3.216 N/A PHE 28.A N TYR 25.A O no hydrogen 3.299 N/A ASP 30.A N ASP 27.A O no hydrogen 2.859 N/A PHE 31.A N PHE 28.A O no hydrogen 3.328 N/A ARG 32.A N ASP 46.A OD1 no hydrogen 2.862 N/A ARG 32.A NE ASP 46.A OD1 no hydrogen 2.860 N/A ARG 32.A NE ASP 46.A OD2 no hydrogen 3.321 N/A ARG 32.A NH1 LYS 227.A O no hydrogen 3.041 N/A ARG 32.A NH2 ASP 46.A OD2 no hydrogen 2.733 N/A ARG 32.A NH2 LYS 227.A O no hydrogen 2.871 N/A ARG 36.A NE ASP 113.A OD2 no hydrogen 3.366 N/A ARG 36.A NH1 ASP 106.A O no hydrogen 3.017 N/A ARG 36.A NH2 ASP 106.A O no hydrogen 2.869 N/A ARG 36.A NH2 LYS 108.A O no hydrogen 3.098 N/A SER 39.A OG VAL 35.A O no hydrogen 2.650 N/A MET 40.A N LYS 116.A O no hydrogen 3.029 N/A LEU 41.A N LEU 38.A O no hydrogen 3.310 N/A HIS 43.A ND1 ARG 32.A O no hydrogen 2.796 N/A HIS 43.A NE2 TYR 109.A OH no hydrogen 2.765 N/A LEU 44.A N MET 40.A O no hydrogen 2.903 N/A ALA 45.A N LEU 41.A O no hydrogen 2.831 N/A ASP 46.A N PRO 42.A O no hydrogen 3.147 N/A LEU 47.A N HIS 43.A O no hydrogen 2.966 N/A VAL 48.A N LEU 44.A O no hydrogen 2.771 N/A SER 49.A N ALA 45.A O no hydrogen 2.931 N/A SER 49.A OG THR 229.A OG1 no hydrogen 2.801 N/A TYR 50.A N ASP 46.A O no hydrogen 2.841 N/A TYR 50.A OH ASP 27.A OD2 no hydrogen 2.501 N/A SER 51.A N LEU 47.A O no hydrogen 2.858 N/A SER 51.A OG LEU 47.A O no hydrogen 2.867 N/A ILE 52.A N VAL 48.A O no hydrogen 2.810 N/A GLN 53.A N SER 49.A O no hydrogen 3.280 N/A LYS 54.A N TYR 50.A O no hydrogen 3.143 N/A VAL 55.A N SER 51.A O no hydrogen 2.879 N/A ILE 56.A N ILE 52.A O no hydrogen 2.985 N/A GLY 57.A N GLN 53.A O no hydrogen 3.108 N/A PHE 58.A N LYS 54.A O no hydrogen 3.036 N/A ALA 59.A N VAL 55.A O no hydrogen 2.903 N/A LYS 60.A N ILE 56.A O no hydrogen 3.045 N/A MET 61.A N PHE 58.A O no hydrogen 2.962 N/A ILE 62.A N ALA 59.A O no hydrogen 2.936 N/A PHE 65.A N ILE 62.A O no hydrogen 2.817 N/A ASP 67.A N GLY 64.A O no hydrogen 3.004 N/A LEU 68.A N PHE 65.A O no hydrogen 3.099 N/A ASP 72.A N THR 69.A OG1 no hydrogen 3.275 N/A GLN 73.A N THR 69.A O no hydrogen 3.073 N/A ILE 74.A N SER 70.A O no hydrogen 3.030 N/A VAL 75.A N ASP 71.A O no hydrogen 2.919 N/A LEU 76.A N ASP 72.A O no hydrogen 2.969 N/A LEU 77.A N GLN 73.A O no hydrogen 3.138 N/A LYS 78.A N ILE 74.A O no hydrogen 3.043 N/A SER 79.A N VAL 75.A O no hydrogen 3.217 N/A SER 79.A OG VAL 75.A O no hydrogen 2.777 N/A SER 79.A OG LEU 76.A O no hydrogen 3.080 N/A SER 80.A N LEU 76.A O no hydrogen 2.960 N/A SER 80.A OG LEU 76.A O no hydrogen 2.766 N/A ALA 81.A N LEU 77.A O no hydrogen 2.800 N/A VAL 84.A N SER 80.A O no hydrogen 2.881 N/A ILE 85.A N ALA 81.A O no hydrogen 3.023 N/A MET 86.A N ILE 82.A O no hydrogen 3.073 N/A LEU 87.A N GLU 83.A O no hydrogen 2.893 N/A ARG 88.A N VAL 84.A O no hydrogen 2.653 N/A ARG 88.A NH2 THR 20.A O no hydrogen 2.870 N/A SER 89.A N ILE 85.A O no hydrogen 2.944 N/A SER 89.A OG MET 86.A O no hydrogen 2.715 N/A ASN 90.A N LEU 87.A O no hydrogen 3.272 N/A ASN 90.A ND2 GLN 131.A O no hydrogen 3.038 N/A ASN 90.A ND2 GLN 131.A OE1 no hydrogen 2.763 N/A GLN 91.A N ARG 88.A O no hydrogen 3.320 N/A GLN 91.A NE2 HIS 17.A NE2 no hydrogen 3.131 N/A SER 92.A N SER 89.A O no hydrogen 2.868 N/A SER 92.A OG SER 89.A O no hydrogen 3.033 N/A PHE 93.A N ASN 90.A O no hydrogen 3.194 N/A THR 94.A N SER 99.A O no hydrogen 2.728 N/A ASP 96.A N THR 94.A OG1 no hydrogen 3.177 N/A SER 99.A N THR 94.A O no hydrogen 3.260 N/A SER 99.A OG ASP 97.A OD1 no hydrogen 3.137 N/A SER 99.A OG ASP 97.A OD2 no hydrogen 2.516 N/A TRP 100.A N TYR 109.A O no hydrogen 2.782 N/A TRP 100.A NE1 SER 89.A OG no hydrogen 3.023 N/A ASP 101.A N SER 92.A O no hydrogen 2.659 N/A CYS 102.A N TYR 107.A O no hydrogen 3.134 N/A CYS 102.A SG SER 92.A OG no hydrogen 3.727 N/A GLY 103.A N ASP 101.A OD1 no hydrogen 3.272 N/A TYR 107.A N SER 104.A O no hydrogen 3.053 N/A LYS 108.A N GLN 105.A O no hydrogen 3.401 N/A LYS 108.A NZ ASP 97.A OD1 no hydrogen 2.571 N/A LYS 108.A NZ SER 99.A OG no hydrogen 2.720 N/A TYR 109.A N TRP 100.A O no hydrogen 2.855 N/A TYR 109.A OH HIS 43.A NE2 no hydrogen 2.765 N/A ASP 110.A N ASP 113.A OD2 no hydrogen 2.883 N/A ASP 113.A N ASP 110.A OD2 no hydrogen 2.931 N/A VAL 114.A N ASP 110.A O no hydrogen 3.124 N/A SER 115.A N VAL 111.A O no hydrogen 3.012 N/A SER 115.A OG VAL 111.A O no hydrogen 3.350 N/A SER 115.A OG THR 112.A O no hydrogen 2.574 N/A LYS 116.A N THR 112.A O no hydrogen 2.836 N/A ALA 117.A N VAL 114.A O no hydrogen 2.984 N/A GLY 118.A N SER 115.A O no hydrogen 2.907 N/A HIS 119.A ND1 GLN 214.A OE1 no hydrogen 2.685 N/A THR 120.A N GLN 214.A OE1 no hydrogen 2.933 N/A LEU 123.A N THR 120.A O no hydrogen 3.016 N/A ILE 124.A N THR 120.A O no hydrogen 3.097 N/A GLU 125.A N LEU 121.A O no hydrogen 2.885 N/A LEU 127.A N LEU 123.A O no hydrogen 2.928 N/A ILE 128.A N ILE 124.A O no hydrogen 2.948 N/A LYS 129.A N GLU 125.A O no hydrogen 3.066 N/A PHE 130.A N PRO 126.A O no hydrogen 2.887 N/A GLN 131.A N LEU 127.A O no hydrogen 2.881 N/A GLN 131.A NE2 MET 86.A O no hydrogen 2.935 N/A VAL 132.A N ILE 128.A O no hydrogen 2.772 N/A GLY 133.A N LYS 129.A O no hydrogen 2.933 N/A LEU 134.A N PHE 130.A O no hydrogen 2.844 N/A LYS 135.A N GLN 131.A O no hydrogen 2.924 N/A LYS 135.A NZ ASN 90.A O no hydrogen 2.846 N/A LYS 135.A NZ PHE 93.A O no hydrogen 2.902 N/A LYS 136.A N VAL 132.A O no hydrogen 2.964 N/A LEU 137.A N LEU 134.A O no hydrogen 2.970 N/A ASN 138.A N LYS 135.A O no hydrogen 2.787 N/A HIS 140.A N GLU 143.A OE2 no hydrogen 2.826 N/A HIS 140.A ND1 TYR 180.A OH no hydrogen 2.884 N/A GLU 142.A N GLU 142.A OE2 no hydrogen 2.579 N/A HIS 144.A N HIS 140.A O no hydrogen 3.057 N/A VAL 145.A N GLU 141.A O no hydrogen 2.997 N/A LEU 146.A N GLU 142.A O no hydrogen 3.192 N/A LEU 147.A N GLU 143.A O no hydrogen 2.931 N/A MET 148.A N HIS 144.A O no hydrogen 3.162 N/A ALA 149.A N VAL 145.A O no hydrogen 3.061 N/A ILE 150.A N LEU 146.A O no hydrogen 2.932 N/A CYS 151.A N LEU 147.A O no hydrogen 2.939 N/A CYS 151.A SG GLU 83.A OE1 no hydrogen 3.384 N/A ILE 152.A N MET 148.A O no hydrogen 3.130 N/A VAL 153.A N ALA 149.A O no hydrogen 3.065 N/A SER 154.A OG ILE 150.A O no hydrogen 3.221 N/A SER 154.A OG CYS 151.A O no hydrogen 2.925 N/A ARG 157.A N SER 154.A O no hydrogen 3.424 N/A ARG 157.A NH1 GLU 83.A OE2 no hydrogen 2.781 N/A ARG 157.A NH2 GLU 83.A OE1 no hydrogen 2.891 N/A ARG 157.A NH2 CYS 151.A O no hydrogen 2.973 N/A VAL 160.A N ARG 157.A O no hydrogen 3.272 N/A GLN 161.A N ASP 72.A OD2 no hydrogen 2.988 N/A ASP 162.A N ASP 72.A OD1 no hydrogen 2.976 N/A LEU 165.A N ASP 162.A OD2 no hydrogen 3.025 N/A VAL 166.A N ASP 162.A O no hydrogen 2.939 N/A GLU 167.A N ALA 163.A O no hydrogen 2.698 N/A ALA 168.A N LYS 164.A O no hydrogen 3.013 N/A ILE 169.A N LEU 165.A O no hydrogen 3.103 N/A GLN 170.A N VAL 166.A O no hydrogen 3.053 N/A GLN 170.A NE2 ILE 150.A O no hydrogen 2.994 N/A ASP 171.A N GLU 167.A O no hydrogen 2.824 N/A ARG 172.A N ALA 168.A O no hydrogen 3.153 N/A ARG 172.A NH1 GLU 5.A OE2 no hydrogen 3.365 N/A LEU 173.A N ILE 169.A O no hydrogen 3.268 N/A SER 174.A N GLN 170.A O no hydrogen 2.701 N/A SER 174.A OG GLN 170.A O no hydrogen 2.857 N/A ASN 175.A N ASP 171.A O no hydrogen 2.831 N/A THR 176.A N ARG 172.A O no hydrogen 3.303 N/A THR 176.A OG1 ARG 172.A O no hydrogen 2.416 N/A LEU 177.A N LEU 173.A O no hydrogen 2.881 N/A GLN 178.A N SER 174.A O no hydrogen 2.760 N/A THR 179.A N ASN 175.A O no hydrogen 2.999 N/A THR 179.A OG1 ASN 175.A O no hydrogen 2.819 N/A TYR 180.A N THR 176.A O no hydrogen 2.920 N/A TYR 180.A OH HIS 140.A ND1 no hydrogen 2.884 N/A ILE 181.A N LEU 177.A O no hydrogen 2.988 N/A ARG 182.A N GLN 178.A O no hydrogen 3.242 N/A CYS 183.A N THR 179.A O no hydrogen 3.032 N/A CYS 183.A SG THR 179.A O no hydrogen 3.327 N/A ARG 184.A N TYR 180.A O no hydrogen 2.673 N/A HIS 185.A N ILE 181.A O no hydrogen 2.935 N/A HIS 185.A ND1 GLU 143.A OE1 no hydrogen 2.593 N/A SER 190.A OG HIS 185.A O no hydrogen 3.372 N/A HIS 191.A N PRO 188.A O no hydrogen 2.832 N/A GLN 192.A NE2 HIS 191.A NE2 no hydrogen 2.980 N/A LEU 193.A N SER 190.A O no hydrogen 2.924 N/A LYS 196.A N GLN 192.A O no hydrogen 2.986 N/A LYS 196.A NZ HIS 191.A O no hydrogen 3.046 N/A MET 197.A N LEU 193.A O no hydrogen 2.919 N/A ILE 198.A N TYR 194.A O no hydrogen 2.918 N/A GLN 199.A N ALA 195.A O no hydrogen 2.969 N/A LYS 200.A N LYS 196.A O no hydrogen 3.213 N/A LYS 200.A N MET 197.A O no hydrogen 3.142 N/A LYS 200.A NZ ASP 203.A OD1 no hydrogen 3.475 N/A LEU 201.A N MET 197.A O no hydrogen 3.337 N/A ALA 202.A N ILE 198.A O no hydrogen 3.118 N/A ASP 203.A N GLN 199.A O no hydrogen 2.821 N/A LEU 204.A N LYS 200.A O no hydrogen 2.832 N/A ARG 205.A N LEU 201.A O no hydrogen 3.140 N/A ARG 205.A NH1 ASP 156.A OD1 no hydrogen 2.653 N/A ARG 205.A NH2 ASP 156.A OD1 no hydrogen 2.976 N/A ARG 205.A NH2 ASP 156.A OD2 no hydrogen 2.749 N/A SER 206.A N ALA 202.A O no hydrogen 3.332 N/A LEU 207.A N ASP 203.A O no hydrogen 3.080 N/A ASN 208.A N LEU 204.A O no hydrogen 2.694 N/A ASN 208.A ND2 SER 79.A O no hydrogen 2.641 N/A ASN 208.A ND2 GLU 83.A OE2 no hydrogen 2.678 N/A GLU 209.A N ARG 205.A O no hydrogen 2.974 N/A GLU 210.A N SER 206.A O no hydrogen 3.007 N/A HIS 211.A N LEU 207.A O no hydrogen 2.810 N/A SER 212.A N ASN 208.A O no hydrogen 2.850 N/A SER 212.A OG ASN 208.A O no hydrogen 3.152 N/A SER 212.A OG ASN 208.A OD1 no hydrogen 3.377 N/A LYS 213.A N GLU 209.A O no hydrogen 3.163 N/A GLN 214.A N GLU 210.A O no hydrogen 3.011 N/A GLN 214.A NE2 GLU 210.A OE1 no hydrogen 2.670 N/A TYR 215.A N HIS 211.A O no hydrogen 2.681 N/A TYR 215.A OH GLY 237.A O no hydrogen 2.976 N/A ARG 216.A N SER 212.A O no hydrogen 2.746 N/A SER 217.A N LYS 213.A O no hydrogen 3.085 N/A LEU 218.A N GLN 214.A O no hydrogen 2.807 N/A SER 219.A N TYR 215.A O no hydrogen 2.755 N/A SER 219.A OG TYR 215.A O no hydrogen 2.800 N/A SER 219.A OG ARG 216.A O no hydrogen 3.559 N/A PHE 220.A N SER 217.A O no hydrogen 3.416 N/A GLN 221.A N LEU 218.A O no hydrogen 3.316 N/A ASN 224.A N GLN 221.A O no hydrogen 2.758 N/A ASN 224.A ND2 LEU 218.A O no hydrogen 3.121 N/A SER 225.A N GLN 221.A O no hydrogen 2.970 N/A MET 226.A N PRO 222.A O no hydrogen 2.896 N/A LYS 227.A N ASN 224.A O no hydrogen 2.865 N/A LEU 228.A N SER 225.A O no hydrogen 3.107 N/A THR 229.A OG1 SER 49.A OG no hydrogen 2.801 N/A VAL 232.A N THR 229.A OG1 no hydrogen 3.068 N/A LEU 233.A N THR 229.A O no hydrogen 3.057 N/A GLU 234.A N PRO 230.A O no hydrogen 2.953 N/A VAL 235.A N LEU 231.A O no hydrogen 2.913 N/A PHE 236.A N VAL 232.A O no hydrogen 2.809 N/A GLY 237.A N LEU 233.A O no hydrogen 2.989 N/A