Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3a7d_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A N GLN 6.A OE1 no hydrogen 3.186 N/A THR 3.A OG1 GLU 5.A OE1 no hydrogen 3.540 N/A LYS 4.A NZ TRP 37.A O no hydrogen 2.955 N/A GLN 6.A N THR 3.A OG1 no hydrogen 3.295 N/A ARG 7.A N THR 3.A O no hydrogen 3.142 N/A ARG 7.A NE GLU 36.A OE1 no hydrogen 2.541 N/A ARG 7.A NH1 ASP 2.A O no hydrogen 2.663 N/A ARG 7.A NH1 ASP 2.A OD1 no hydrogen 2.969 N/A ARG 7.A NH2 GLU 36.A OE1 no hydrogen 3.057 N/A ARG 7.A NH2 GLU 36.A OE2 no hydrogen 2.879 N/A ILE 8.A N LYS 4.A O no hydrogen 2.836 N/A LEU 9.A N GLU 5.A O no hydrogen 3.223 N/A ARG 10.A N GLN 6.A O no hydrogen 2.945 N/A ARG 10.A NH2 ASP 2.A OD2 no hydrogen 2.886 N/A TYR 11.A N ARG 7.A O no hydrogen 2.933 N/A VAL 12.A N ILE 8.A O no hydrogen 3.075 N/A GLN 13.A N LEU 9.A O no hydrogen 2.932 N/A GLN 14.A N ARG 10.A O no hydrogen 3.116 N/A ASN 15.A N TYR 11.A O no hydrogen 2.977 N/A ALA 16.A N VAL 12.A O no hydrogen 2.840 N/A LYS 17.A N SER 23.A OG no hydrogen 2.957 N/A LYS 17.A NZ PRO 18.A O no hydrogen 2.940 N/A GLY 19.A N PHE 104.A O no hydrogen 2.748 N/A ASP 20.A N LYS 17.A O no hydrogen 3.140 N/A GLN 22.A NE2 GLU 26.A OE2 no hydrogen 3.305 N/A VAL 24.A N ASP 20.A O no hydrogen 3.277 N/A LEU 25.A N PRO 21.A O no hydrogen 3.081 N/A GLU 26.A N GLN 22.A O no hydrogen 2.857 N/A ALA 27.A N SER 23.A O no hydrogen 2.962 N/A ILE 28.A N VAL 24.A O no hydrogen 3.203 N/A ASP 29.A N LEU 25.A O no hydrogen 3.050 N/A THR 30.A N GLU 26.A O no hydrogen 2.838 N/A THR 30.A OG1 GLU 26.A O no hydrogen 2.898 N/A TYR 31.A N ALA 27.A O no hydrogen 2.737 N/A TYR 31.A OH GLU 36.A OE1 no hydrogen 2.708 N/A CYS 32.A N ILE 28.A O no hydrogen 2.860 N/A CYS 32.A SG ILE 28.A O no hydrogen 3.398 N/A CYS 32.A SG GLU 36.A O no hydrogen 3.576 N/A THR 33.A N ASP 29.A O no hydrogen 2.771 N/A THR 33.A N THR 30.A O no hydrogen 3.121 N/A THR 33.A OG1 ASP 29.A O no hydrogen 3.000 N/A GLN 34.A N THR 30.A O no hydrogen 3.002 N/A LYS 35.A N TYR 31.A O no hydrogen 2.823 N/A GLU 36.A N TYR 31.A O no hydrogen 3.350 N/A TRP 37.A NE1 GLU 198.A O no hydrogen 2.827 N/A LYS 45.A NZ ASP 168.A OD1 no hydrogen 2.709 N/A LYS 45.A NZ ASP 168.A OD2 no hydrogen 3.539 N/A LYS 45.A NZ GLU 198.A OE1 no hydrogen 2.970 N/A LYS 45.A NZ ASP 204.A OD2 no hydrogen 2.531 N/A GLY 46.A N GLY 42.A O no hydrogen 2.779 N/A GLN 47.A N ASP 43.A O no hydrogen 2.940 N/A MET 49.A N LYS 45.A O no hydrogen 3.040 N/A ASP 50.A N GLY 46.A O no hydrogen 2.939 N/A ALA 51.A N GLN 47.A O no hydrogen 3.138 N/A VAL 52.A N ILE 48.A O no hydrogen 2.941 N/A ILE 53.A N MET 49.A O no hydrogen 2.949 N/A ARG 54.A N ASP 50.A O no hydrogen 2.902 N/A GLU 55.A N ALA 51.A O no hydrogen 3.059 N/A TYR 56.A N VAL 52.A O no hydrogen 3.340 N/A TYR 56.A N ILE 53.A O no hydrogen 3.194 N/A SER 57.A N ILE 53.A O no hydrogen 2.791 N/A SER 57.A OG ARG 54.A O no hydrogen 3.528 N/A SER 59.A N ASP 135.A OD2 no hydrogen 2.794 N/A LEU 60.A N ASP 135.A OD2 no hydrogen 2.629 N/A VAL 61.A N ARG 84.A O no hydrogen 2.994 N/A LEU 62.A N MET 136.A O no hydrogen 2.903 N/A GLU 63.A N LEU 86.A O no hydrogen 2.707 N/A LEU 64.A N PHE 138.A O no hydrogen 2.834 N/A GLY 65.A N MET 88.A O no hydrogen 2.782 N/A ALA 66.A N GLU 89.A OE1 no hydrogen 2.879 N/A TYR 67.A N GLU 89.A OE1 no hydrogen 3.033 N/A TYR 67.A OH GLU 5.A OE2 no hydrogen 2.800 N/A GLY 69.A N ALA 66.A O no hydrogen 3.192 N/A TYR 70.A OH ASP 29.A OD1 no hydrogen 3.134 N/A TYR 70.A OH ASP 29.A OD2 no hydrogen 2.735 N/A SER 71.A OG GLU 63.A OE2 no hydrogen 2.341 N/A VAL 73.A N GLY 69.A O no hydrogen 2.891 N/A ARG 74.A N TYR 70.A O no hydrogen 2.878 N/A ARG 74.A NE ASP 50.A OD1 no hydrogen 3.173 N/A ARG 74.A NE ASP 50.A OD2 no hydrogen 3.502 N/A ARG 74.A NH1 ASP 43.A OD1 no hydrogen 3.286 N/A ARG 74.A NH2 ASP 43.A OD1 no hydrogen 3.498 N/A ARG 74.A NH2 ASP 50.A OD2 no hydrogen 3.092 N/A MET 75.A N SER 71.A O no hydrogen 2.906 N/A ALA 76.A N ALA 72.A O no hydrogen 2.976 N/A ARG 77.A N VAL 73.A O no hydrogen 3.318 N/A ARG 77.A NH1 ASP 50.A OD1 no hydrogen 3.295 N/A ARG 77.A NH1 ARG 74.A O no hydrogen 2.780 N/A ARG 77.A NH2 GLN 22.A OE1 no hydrogen 3.540 N/A ARG 77.A NH2 ASP 50.A OD2 no hydrogen 3.135 N/A LEU 78.A N MET 75.A O no hydrogen 3.077 N/A ALA 83.A N GLN 80.A O no hydrogen 3.061 N/A ARG 84.A N SER 59.A O no hydrogen 2.769 N/A ARG 84.A NH1 ALA 83.A O no hydrogen 3.146 N/A LEU 85.A N LYS 110.A O no hydrogen 3.006 N/A LEU 86.A N VAL 61.A O no hydrogen 2.649 N/A THR 87.A N THR 112.A O no hydrogen 3.010 N/A THR 87.A OG1 GLU 63.A OE1 no hydrogen 3.187 N/A MET 88.A N GLU 63.A O no hydrogen 2.849 N/A GLU 89.A N LEU 114.A O no hydrogen 3.005 N/A ASN 91.A N GLU 89.A OE2 no hydrogen 3.037 N/A ASP 93.A N ASN 91.A OD1 no hydrogen 2.893 N/A TYR 94.A N ASN 91.A OD1 no hydrogen 3.372 N/A ALA 95.A N ASN 91.A O no hydrogen 2.964 N/A ALA 96.A N PRO 92.A O no hydrogen 2.969 N/A ALA 96.A N ASP 93.A O no hydrogen 3.019 N/A ILE 97.A N ASP 93.A O no hydrogen 2.967 N/A THR 98.A N TYR 94.A O no hydrogen 2.834 N/A THR 98.A OG1 TYR 67.A O no hydrogen 2.707 N/A THR 98.A OG1 TYR 94.A O no hydrogen 2.942 N/A GLN 99.A N ALA 95.A O no hydrogen 2.986 N/A GLN 99.A NE2 GLN 99.A O no hydrogen 3.387 N/A GLN 99.A NE2 ASN 103.A OD1 no hydrogen 3.009 N/A GLN 100.A N ALA 96.A O no hydrogen 2.972 N/A MET 101.A N ILE 97.A O no hydrogen 2.803 N/A LEU 102.A N THR 98.A O no hydrogen 2.870 N/A ASN 103.A N GLN 99.A O no hydrogen 2.897 N/A PHE 104.A N GLN 100.A O no hydrogen 2.947 N/A ALA 105.A N MET 101.A O no hydrogen 3.155 N/A GLY 106.A N ASN 103.A O no hydrogen 2.995 N/A LEU 107.A N LEU 102.A O no hydrogen 2.928 N/A GLN 108.A N GLN 108.A OE1 no hydrogen 2.570 N/A LYS 110.A N LEU 107.A O no hydrogen 3.041 N/A LYS 110.A NZ GLN 80.A O no hydrogen 3.063 N/A LYS 110.A NZ ALA 83.A O no hydrogen 3.148 N/A THR 112.A N LEU 85.A O no hydrogen 3.012 N/A LEU 114.A N THR 87.A O no hydrogen 2.749 N/A GLY 116.A N GLU 89.A O no hydrogen 2.945 N/A SER 118.A OG GLN 119.A OE1 no hydrogen 3.172 N/A SER 118.A OG ASP 149.A OD2 no hydrogen 2.358 N/A GLN 119.A N GLN 119.A OE1 no hydrogen 2.575 N/A ASP 120.A N ALA 117.A O no hydrogen 3.110 N/A LEU 121.A N ALA 117.A O no hydrogen 2.952 N/A ILE 122.A N SER 118.A O no hydrogen 2.877 N/A GLN 124.A N LEU 121.A O no hydrogen 2.920 N/A LEU 125.A N ILE 122.A O no hydrogen 3.251 N/A LYS 126.A NZ ASP 132.A O no hydrogen 3.352 N/A LYS 126.A NZ GLY 157.A O no hydrogen 2.979 N/A LYS 128.A N GLN 124.A O no hydrogen 2.706 N/A TYR 129.A N LEU 125.A O no hydrogen 3.046 N/A ASP 130.A N LYS 126.A O no hydrogen 3.119 N/A VAL 131.A N LEU 125.A O no hydrogen 3.277 N/A LEU 134.A N LEU 158.A O no hydrogen 2.924 N/A ASP 135.A N LEU 60.A O no hydrogen 3.056 N/A MET 136.A N LEU 60.A O no hydrogen 3.298 N/A VAL 137.A N VAL 164.A O no hydrogen 2.753 N/A PHE 138.A N LEU 62.A O no hydrogen 2.780 N/A LEU 139.A N LEU 166.A O no hydrogen 2.762 N/A ASP 140.A N LEU 64.A O no hydrogen 3.065 N/A HIS 141.A N HIS 141.A ND1 no hydrogen 2.777 N/A HIS 141.A NE2 ASP 149.A OD2 no hydrogen 2.770 N/A LYS 143.A NZ ASP 140.A OD1 no hydrogen 3.441 N/A LYS 143.A NZ HIS 141.A O no hydrogen 2.874 N/A LYS 143.A NZ TYR 146.A OH no hydrogen 3.123 N/A LYS 143.A NZ ASN 169.A OD1 no hydrogen 3.199 N/A ARG 145.A N TRP 142.A O no hydrogen 2.924 N/A ARG 145.A NE ASP 149.A OD1 no hydrogen 3.399 N/A ARG 145.A NH2 ASP 149.A OD1 no hydrogen 2.696 N/A TYR 146.A N LYS 143.A O no hydrogen 3.290 N/A TYR 146.A OH ASP 168.A O no hydrogen 2.652 N/A ASP 149.A N ARG 145.A O no hydrogen 2.990 N/A THR 150.A N TYR 146.A O no hydrogen 3.079 N/A THR 150.A OG1 TYR 146.A O no hydrogen 2.645 N/A LEU 151.A N LEU 147.A O no hydrogen 2.872 N/A LEU 152.A N PRO 148.A O no hydrogen 2.809 N/A LEU 153.A N ASP 149.A O no hydrogen 2.736 N/A GLU 154.A N THR 150.A O no hydrogen 2.967 N/A LYS 155.A N LEU 151.A O no hydrogen 2.863 N/A CYS 156.A N LEU 152.A O no hydrogen 2.917 N/A CYS 156.A SG LEU 152.A O no hydrogen 3.462 N/A GLY 157.A N GLU 154.A O no hydrogen 3.042 N/A LEU 158.A N LEU 153.A O no hydrogen 3.037 N/A ARG 160.A N THR 163.A OG1 no hydrogen 3.106 N/A ARG 160.A NH1 LYS 161.A O no hydrogen 3.190 N/A ARG 160.A NH2 ASP 135.A OD1 no hydrogen 2.509 N/A GLY 162.A N TYR 211.A O no hydrogen 2.759 N/A THR 163.A N ARG 160.A O no hydrogen 3.110 N/A THR 163.A OG1 LEU 134.A O no hydrogen 2.646 N/A THR 163.A OG1 ARG 160.A O no hydrogen 3.240 N/A VAL 164.A N ASP 135.A O no hydrogen 3.065 N/A LEU 165.A N ALA 209.A O no hydrogen 2.733 N/A LEU 166.A N VAL 137.A O no hydrogen 2.660 N/A ALA 167.A N GLU 207.A O no hydrogen 2.881 N/A ASP 168.A N LEU 139.A O no hydrogen 2.923 N/A ASN 169.A N ASP 168.A OD1 no hydrogen 2.816 N/A ASN 169.A ND2 VAL 172.A O no hydrogen 2.789 N/A VAL 170.A N GLY 205.A O no hydrogen 3.379 N/A ILE 171.A N ASP 204.A OD1 no hydrogen 3.132 N/A VAL 172.A N ASP 204.A OD1 no hydrogen 2.801 N/A GLY 174.A N ASN 169.A O no hydrogen 2.939 N/A THR 175.A N VAL 170.A O no hydrogen 3.170 N/A THR 175.A OG1 THR 175.A O no hydrogen 2.621 N/A LEU 179.A N THR 175.A O no hydrogen 3.053 N/A ALA 180.A N PRO 176.A O no hydrogen 3.094 N/A TYR 181.A N ASP 177.A O no hydrogen 3.154 N/A VAL 182.A N PHE 178.A O no hydrogen 3.034 N/A ARG 183.A N LEU 179.A O no hydrogen 3.049 N/A ARG 183.A NE GLU 207.A OE2 no hydrogen 2.956 N/A ARG 183.A NH2 GLU 207.A OE1 no hydrogen 2.916 N/A ARG 183.A NH2 GLU 207.A OE2 no hydrogen 3.415 N/A GLY 184.A N ALA 180.A O no hydrogen 2.968 N/A SER 185.A N TYR 181.A O no hydrogen 2.873 N/A SER 187.A N SER 185.A OG no hydrogen 3.017 N/A SER 187.A OG GLY 213.A O no hydrogen 3.266 N/A PHE 188.A N SER 185.A O no hydrogen 3.357 N/A GLU 189.A N ILE 210.A O no hydrogen 2.893 N/A CYS 190.A SG PHE 188.A O no hydrogen 3.911 N/A THR 191.A N LYS 208.A O no hydrogen 2.706 N/A HIS 192.A ND1 GLU 207.A OE1 no hydrogen 2.876 N/A TYR 193.A N LEU 206.A O no hydrogen 2.806 N/A SER 195.A N ASP 204.A O no hydrogen 2.942 N/A TYR 196.A N SER 195.A OG no hydrogen 2.546 N/A LEU 197.A N VAL 202.A O no hydrogen 2.752 N/A GLU 198.A N GLU 198.A OE1 no hydrogen 2.801 N/A TYR 199.A OH ASP 29.A OD1 no hydrogen 2.660 N/A MET 200.A N LEU 197.A O no hydrogen 3.056 N/A ASP 204.A N SER 195.A O no hydrogen 3.042 N/A LEU 206.A N TYR 193.A O no hydrogen 3.014 N/A GLU 207.A N ALA 167.A O no hydrogen 3.130 N/A LYS 208.A N THR 191.A O no hydrogen 2.709 N/A LYS 208.A NZ TYR 56.A OH no hydrogen 3.067 N/A LYS 208.A NZ TYR 193.A OH no hydrogen 3.069 N/A ALA 209.A N LEU 165.A O no hydrogen 2.753 N/A ILE 210.A N GLU 189.A O no hydrogen 2.826 N/A TYR 211.A N THR 163.A O no hydrogen 2.954 N/A TYR 211.A OH GLU 154.A OE2 no hydrogen 2.532 N/A GLN 212.A N SER 187.A O no hydrogen 2.805 N/A GLN 212.A NE2 ILE 210.A O no hydrogen 2.934 N/A