Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2wa7_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 4.A N ALA 1.A O no hydrogen 2.862 N/A LYS 5.A N PRO 2.A O no hydrogen 3.160 N/A ILE 6.A N TRP 3.A O no hydrogen 3.220 N/A GLN 7.A NE2 ASP 211.A OD2 no hydrogen 2.759 N/A ASN 9.A N LYS 5.A O no hydrogen 2.854 N/A ASN 9.A ND2 GLU 204.A OE2 no hydrogen 3.176 N/A THR 10.A N ILE 6.A O no hydrogen 2.853 N/A THR 10.A OG1 ILE 6.A O no hydrogen 3.044 N/A PHE 11.A N GLN 7.A O no hydrogen 2.867 N/A THR 12.A N GLN 8.A O no hydrogen 2.975 N/A THR 12.A OG1 GLN 8.A O no hydrogen 2.640 N/A ARG 13.A N ASN 9.A O no hydrogen 3.045 N/A ARG 13.A NH1 VAL 199.A O no hydrogen 2.954 N/A ARG 13.A NH1 GLU 204.A OE1 no hydrogen 2.888 N/A ARG 13.A NH2 GLU 204.A OE2 no hydrogen 3.083 N/A TRP 14.A N THR 10.A O no hydrogen 3.014 N/A TRP 14.A NE1 SER 111.A OG no hydrogen 3.133 N/A CYS 15.A N PHE 11.A O no hydrogen 3.025 N/A CYS 15.A SG PHE 11.A O no hydrogen 3.369 N/A ASN 16.A N THR 12.A O no hydrogen 2.937 N/A ASN 16.A ND2 ILE 26.A O no hydrogen 2.978 N/A GLU 17.A N ARG 13.A O no hydrogen 2.853 N/A HIS 18.A N TRP 14.A O no hydrogen 3.261 N/A HIS 18.A ND1 TRP 14.A O no hydrogen 2.957 N/A LEU 19.A N CYS 15.A O no hydrogen 2.768 N/A LYS 20.A N ASN 16.A O no hydrogen 2.903 N/A LYS 20.A NZ GLU 17.A OE1 no hydrogen 3.079 N/A CYS 21.A N HIS 18.A O no hydrogen 3.430 N/A CYS 21.A SG.A GLU 17.A O no hydrogen 3.976 N/A CYS 21.A SG.A HIS 18.A O no hydrogen 3.340 N/A CYS 21.A SG.B HIS 18.A O no hydrogen 3.305 N/A VAL 22.A N LEU 19.A O no hydrogen 2.993 N/A ASN 23.A N LYS 20.A O no hydrogen 3.086 N/A LYS 24.A N LEU 19.A O no hydrogen 3.164 N/A ILE 26.A N ASN 16.A OD1 no hydrogen 2.742 N/A GLY 27.A N ASP 32.A OD2 no hydrogen 2.818 N/A ASN 28.A N ASP 32.A OD2 no hydrogen 2.785 N/A GLN 30.A N ASN 28.A OD1 no hydrogen 3.020 N/A GLN 30.A NE2 GLY 94.A O no hydrogen 3.110 N/A THR 31.A N ASN 28.A O no hydrogen 3.195 N/A THR 31.A OG1 ASN 28.A O no hydrogen 3.283 N/A THR 31.A OG1 ASP 32.A OD1 no hydrogen 2.877 N/A ASP 32.A N ASN 28.A O no hydrogen 2.822 N/A SER 34.A N THR 31.A O no hydrogen 3.282 N/A SER 34.A OG GLN 30.A O no hydrogen 3.529 N/A SER 34.A OG ILE 91.A O no hydrogen 2.678 N/A SER 34.A OG VAL 92.A O no hydrogen 3.335 N/A GLY 36.A N LEU 33.A O no hydrogen 2.941 N/A LEU 37.A N ASP 35.A OD1 no hydrogen 3.086 N/A ARG 38.A NH1 ASP 32.A O no hydrogen 3.005 N/A ILE 40.A N GLY 36.A O no hydrogen 2.932 N/A ALA 41.A N LEU 37.A O no hydrogen 2.932 N/A LEU 42.A N ARG 38.A O no hydrogen 2.907 N/A LEU 43.A N LEU 39.A O no hydrogen 2.989 N/A GLU 44.A N ILE 40.A O no hydrogen 2.993 N/A VAL 45.A N ALA 41.A O no hydrogen 3.034 N/A LEU 46.A N LEU 42.A O no hydrogen 2.912 N/A SER 47.A N LEU 43.A O no hydrogen 2.910 N/A SER 47.A OG LEU 43.A O no hydrogen 2.751 N/A SER 47.A OG GLU 44.A O no hydrogen 3.498 N/A GLN 48.A NE2.A VAL 45.A O no hydrogen 2.690 N/A LYS 49.A N SER 47.A OG no hydrogen 3.046 N/A LYS 49.A NZ GLU 79.A OE1 no hydrogen 2.965 N/A ARG 50.A NH2 GLU 44.A OE1 no hydrogen 2.922 N/A MET 51.A N GLU 44.A OE2 no hydrogen 3.248 N/A ARG 53.A NH1 GLU 74.A OE1 no hydrogen 2.964 N/A HIS 56.A N ASN 68.A OD1 no hydrogen 2.878 N/A THR 60.A N ARG 58.A O no hydrogen 2.936 N/A ARG 62.A NH1 ASP 93.A OD1 no hydrogen 2.686 N/A ARG 62.A NH2 ASP 93.A OD1 no hydrogen 3.410 N/A ARG 62.A NH2 ASP 93.A OD2 no hydrogen 2.945 N/A GLN 65.A N PHE 61.A O no hydrogen 3.237 N/A GLN 65.A NE2 PRO 59.A O no hydrogen 2.995 N/A LEU 66.A N ARG 62.A O no hydrogen 2.977 N/A GLU 67.A N GLN 63.A O no hydrogen 3.001 N/A ASN 68.A N MET 64.A O no hydrogen 2.904 N/A ASN 68.A ND2 ASP 35.A O no hydrogen 3.010 N/A ASN 68.A ND2 HIS 56.A O no hydrogen 2.958 N/A VAL 69.A N GLN 65.A O no hydrogen 3.091 N/A SER 70.A N LEU 66.A O no hydrogen 2.960 N/A SER 70.A OG LEU 66.A O no hydrogen 3.311 N/A SER 70.A OG SER 88.A OG no hydrogen 2.641 N/A VAL 71.A N GLU 67.A O no hydrogen 2.957 N/A ALA 72.A N ASN 68.A O no hydrogen 3.170 N/A LEU 73.A N VAL 69.A O no hydrogen 2.920 N/A GLU 74.A N SER 70.A O no hydrogen 2.825 N/A PHE 75.A N VAL 71.A O no hydrogen 2.965 N/A LEU 76.A N ALA 72.A O no hydrogen 3.056 N/A ASP 77.A N LEU 73.A O no hydrogen 2.966 N/A ARG 78.A N GLU 74.A O no hydrogen 2.830 N/A GLU 79.A N PHE 75.A O no hydrogen 3.006 N/A GLU 79.A N LEU 76.A O no hydrogen 3.141 N/A SER 80.A N ASP 77.A O no hydrogen 3.072 N/A ILE 81.A N LEU 76.A O no hydrogen 3.056 N/A SER 88.A OG LEU 66.A O no hydrogen 3.556 N/A SER 88.A OG SER 70.A OG no hydrogen 2.641 N/A ALA 90.A N ASP 87.A O no hydrogen 3.248 N/A ALA 90.A N ASP 87.A OD1 no hydrogen 3.272 N/A VAL 92.A N SER 88.A O no hydrogen 2.922 N/A ASP 93.A N LYS 89.A O no hydrogen 2.799 N/A GLY 94.A N ILE 91.A O no hydrogen 3.132 N/A ASN 95.A N ALA 90.A O no hydrogen 2.856 N/A LEU 98.A N ASN 95.A OD1 no hydrogen 3.103 N/A ILE 99.A N ASN 95.A O no hydrogen 2.876 N/A LEU 100.A N LEU 96.A O no hydrogen 2.893 N/A GLY 101.A N LYS 97.A O no hydrogen 3.175 N/A LEU 102.A N LEU 98.A O no hydrogen 2.923 N/A VAL 103.A N ILE 99.A O no hydrogen 2.960 N/A TRP 104.A N LEU 100.A O no hydrogen 2.869 N/A THR 105.A N GLY 101.A O no hydrogen 3.131 N/A THR 105.A OG1 GLY 101.A O no hydrogen 3.176 N/A LEU 106.A N LEU 102.A O no hydrogen 3.212 N/A ILE 107.A N VAL 103.A O no hydrogen 2.956 N/A LEU 108.A N TRP 104.A O no hydrogen 2.815 N/A HIS 109.A N THR 105.A O no hydrogen 2.904 N/A TYR 110.A N LEU 106.A O no hydrogen 2.799 N/A SER 111.A N ILE 107.A O no hydrogen 2.876 N/A SER 113.A N LEU 108.A O no hydrogen 2.791 N/A SER 113.A OG LEU 108.A O no hydrogen 3.048 N/A MET 114.A N HIS 109.A O no hydrogen 2.953 N/A THR 125.A N GLN 128.A OE1 no hydrogen 2.917 N/A LYS 127.A NZ GLU 212.A OE1 no hydrogen 2.821 N/A GLN 128.A N THR 125.A OG1 no hydrogen 3.097 N/A ARG 129.A N THR 125.A O no hydrogen 2.891 N/A ARG 129.A NE ILE 112.A O no hydrogen 3.156 N/A ARG 129.A NH1 PRO 115.A O no hydrogen 3.559 N/A ARG 129.A NH1 GLU 120.A OE1 no hydrogen 3.057 N/A ARG 129.A NH2 ILE 112.A O no hydrogen 2.814 N/A ARG 129.A NH2 PRO 115.A O no hydrogen 2.785 N/A LEU 130.A N PRO 126.A O no hydrogen 2.932 N/A LEU 131.A N LYS 127.A O no hydrogen 2.900 N/A GLY 132.A N GLN 128.A O no hydrogen 2.831 N/A TRP 133.A N ARG 129.A O no hydrogen 3.073 N/A TRP 133.A NE1 GLU 118.A O no hydrogen 3.024 N/A ILE 134.A N LEU 130.A O no hydrogen 3.019 N/A GLN 135.A N LEU 131.A O no hydrogen 2.844 N/A GLN 135.A NE2 GLN 135.A O no hydrogen 2.994 N/A GLN 135.A NE2 LEU 141.A O no hydrogen 2.750 N/A ASN 136.A N GLY 132.A O no hydrogen 3.117 N/A LYS 137.A N TRP 133.A O no hydrogen 3.313 N/A ILE 138.A N ILE 134.A O no hydrogen 3.131 N/A LEU 141.A N ILE 138.A O no hydrogen 3.359 N/A ILE 143.A N GLN 135.A OE1 no hydrogen 2.785 N/A THR 144.A N ASN 149.A OD1 no hydrogen 2.794 N/A ASN 145.A N ASN 149.A OD1 no hydrogen 2.992 N/A PHE 146.A N GLU 212.A OE2 no hydrogen 2.767 N/A ASN 147.A N ASN 145.A OD1 no hydrogen 3.141 N/A GLN 148.A N ASN 147.A OD1 no hydrogen 2.751 N/A ASN 149.A N ASN 145.A OD1 no hydrogen 2.880 N/A TRP 150.A N ASN 147.A O no hydrogen 2.976 N/A TRP 150.A NE1 ASN 145.A O no hydrogen 2.973 N/A GLN 151.A N GLN 148.A O no hydrogen 3.172 N/A GLY 153.A N TRP 150.A O no hydrogen 3.283 N/A LYS 154.A N ASP 152.A OD1 no hydrogen 2.985 N/A LYS 154.A NZ GLU 172.A O no hydrogen 3.010 N/A LYS 154.A NZ TRP 174.A O no hydrogen 2.846 N/A GLY 157.A N GLY 153.A O no hydrogen 3.413 N/A ALA 158.A N LYS 154.A O no hydrogen 2.881 N/A LEU 159.A N ALA 155.A O no hydrogen 2.905 N/A VAL 160.A N LEU 156.A O no hydrogen 2.948 N/A ASP 161.A N GLY 157.A O no hydrogen 2.943 N/A SER 162.A N ALA 158.A O no hydrogen 2.913 N/A SER 162.A OG LEU 159.A O no hydrogen 2.755 N/A CYS 163.A N LEU 159.A O no hydrogen 3.049 N/A CYS 163.A SG LEU 159.A O no hydrogen 3.436 N/A ALA 164.A N VAL 160.A O no hydrogen 3.161 N/A GLY 166.A N ASP 161.A OD1 no hydrogen 2.705 N/A LEU 167.A N ALA 164.A O no hydrogen 3.116 N/A CYS 168.A N ASP 161.A OD1 no hydrogen 3.011 N/A TRP 171.A N CYS 168.A O no hydrogen 3.269 N/A SER 173.A N ASP 170.A O no hydrogen 3.014 N/A SER 173.A OG.B ASP 170.A O no hydrogen 2.671 N/A TRP 174.A N TRP 171.A O no hydrogen 3.064 N/A TRP 174.A NE1 ASP 170.A OD1 no hydrogen 3.126 N/A GLN 177.A N ASP 175.A OD1 no hydrogen 2.946 N/A LYS 178.A N ASP 175.A O no hydrogen 2.970 N/A ASN 182.A N LYS 178.A O no hydrogen 3.047 N/A ASN 182.A ND2 ASP 152.A O no hydrogen 2.934 N/A ASN 182.A ND2 ASP 175.A O no hydrogen 2.841 N/A ALA 183.A N PRO 179.A O no hydrogen 2.882 N/A ARG 184.A N VAL 180.A O no hydrogen 2.902 N/A ARG 184.A NH2 GLU 203.A OE2 no hydrogen 2.762 N/A GLU 185.A N ASP 181.A O no hydrogen 3.064 N/A ALA 186.A N ASN 182.A O no hydrogen 3.065 N/A VAL 187.A N ALA 183.A O no hydrogen 2.796 N/A GLN 188.A N ARG 184.A O no hydrogen 2.935 N/A GLN 188.A NE2 ASP 192.A OD1 no hydrogen 2.915 N/A GLN 189.A N GLU 185.A O no hydrogen 3.012 N/A GLN 189.A NE2 LEU 167.A O no hydrogen 2.821 N/A ALA 190.A N ALA 186.A O no hydrogen 2.918 N/A ASP 191.A N VAL 187.A O no hydrogen 2.925 N/A ASP 192.A N GLN 188.A O no hydrogen 2.732 N/A TRP 193.A N GLN 189.A O no hydrogen 2.876 N/A LEU 194.A N ALA 190.A O no hydrogen 2.896 N/A VAL 196.A N ALA 190.A O no hydrogen 3.110 N/A GLN 198.A NE2 GLN 188.A OE1 no hydrogen 2.884 N/A GLN 198.A NE2 ASP 191.A OD2 no hydrogen 2.878 N/A VAL 199.A N PRO 197.A O no hydrogen 2.970 N/A THR 201.A N GLU 204.A OE1 no hydrogen 2.993 N/A THR 201.A OG1 GLU 203.A OE1 no hydrogen 3.449 N/A GLU 203.A N GLU 203.A OE1 no hydrogen 2.891 N/A GLU 204.A N THR 201.A OG1 no hydrogen 3.057 N/A ILE 205.A N THR 201.A O no hydrogen 2.986 N/A HIS 207.A N GLU 204.A O no hydrogen 3.108 N/A ASP 209.A N HIS 207.A ND1 no hydrogen 3.045 N/A VAL 210.A N HIS 207.A O no hydrogen 2.982 N/A SER 214.A N ASP 211.A OD2 no hydrogen 2.852 N/A SER 214.A OG ASP 211.A OD1 no hydrogen 2.588 N/A SER 214.A OG ASP 211.A OD2 no hydrogen 3.220 N/A VAL 215.A N ASP 211.A O no hydrogen 3.477 N/A MET 216.A N GLU 212.A O no hydrogen 2.920 N/A THR 217.A N HIS 213.A O no hydrogen 2.946 N/A THR 217.A OG1 HIS 213.A O no hydrogen 2.778 N/A TYR 218.A N SER 214.A O no hydrogen 3.202 N/A LEU 219.A N VAL 215.A O no hydrogen 2.892 N/A SER 220.A N MET 216.A O no hydrogen 2.905 N/A SER 220.A OG MET 216.A O no hydrogen 3.215 N/A SER 220.A OG THR 217.A O no hydrogen 2.873 N/A GLN 221.A N TYR 218.A O no hydrogen 3.130 N/A GLN 221.A NE2 PRO 197.A O no hydrogen 2.917 N/A GLN 221.A NE2 TYR 218.A O no hydrogen 3.047 N/A PHE 222.A N LEU 219.A O no hydrogen 3.046 N/A ALA 225.A N GLN 221.A O no hydrogen 3.530 N/A