Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2ddg_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 3.A NH1 GLY 45.A O no hydrogen 2.715 N/A ARG 3.A NH2 TYR 108.A OH no hydrogen 2.908 N/A ALA 5.A N ASP 2.A OD2 no hydrogen 2.983 N/A PHE 6.A N ASP 2.A O no hydrogen 3.007 N/A VAL 7.A N ARG 3.A O no hydrogen 2.945 N/A GLN 8.A N GLU 4.A O no hydrogen 3.024 N/A THR 9.A N ALA 5.A O no hydrogen 2.974 N/A THR 9.A OG1 ALA 5.A O no hydrogen 2.808 N/A THR 9.A OG1 PHE 6.A O no hydrogen 3.283 N/A LEU 10.A N PHE 6.A O no hydrogen 2.781 N/A THR 11.A N VAL 7.A O no hydrogen 3.144 N/A THR 11.A OG1 VAL 7.A O no hydrogen 2.785 N/A THR 11.A OG1 GLN 8.A O no hydrogen 3.105 N/A ALA 12.A N THR 9.A O no hydrogen 3.401 N/A CYS 13.A N LEU 10.A O no hydrogen 3.048 N/A ARG 18.A NE GLU 126.A OE2 no hydrogen 2.837 N/A ARG 18.A NH2 LYS 121.A O no hydrogen 2.892 N/A ARG 18.A NH2 GLU 126.A OE1 no hydrogen 2.638 N/A ARG 18.A NH2 GLU 126.A OE2 no hydrogen 3.487 N/A VAL 20.A N CYS 16.A O no hydrogen 2.850 N/A ALA 21.A N PRO 17.A O no hydrogen 3.204 N/A TRP 22.A N ARG 18.A O no hydrogen 3.050 N/A ARG 23.A N LEU 19.A O no hydrogen 2.963 N/A ARG 23.A NH2 CYS 13.A O no hydrogen 3.433 N/A GLU 24.A N ALA 21.A O no hydrogen 3.261 N/A GLU 25.A N ALA 21.A O no hydrogen 2.871 N/A VAL 26.A N TRP 22.A O no hydrogen 3.094 N/A VAL 27.A N GLU 24.A O no hydrogen 3.069 N/A ARG 29.A N VAL 26.A O no hydrogen 2.980 N/A ARG 29.A NE GLU 25.A OE1 no hydrogen 3.129 N/A ARG 29.A NH1 GLU 25.A OE1 no hydrogen 2.927 N/A PHE 33.A N LYS 30.A O no hydrogen 2.987 N/A ARG 34.A N ARG 31.A O no hydrogen 3.317 N/A ARG 34.A NE GLY 28.A O no hydrogen 2.831 N/A ARG 34.A NH1 GLY 28.A O no hydrogen 2.876 N/A GLU 36.A N PHE 33.A O no hydrogen 3.104 N/A TYR 38.A OH HIS 63.A ND1 no hydrogen 2.582 N/A TRP 39.A N ARG 67.A O no hydrogen 2.910 N/A TRP 39.A NE1 PRO 42.A O no hydrogen 2.731 N/A ALA 40.A N ASN 66.A O no hydrogen 2.716 N/A VAL 43.A N ARG 114.A O no hydrogen 2.831 N/A PHE 46.A N LEU 109.A O no hydrogen 2.881 N/A ASP 48.A N VAL 107.A O no hydrogen 2.941 N/A GLU 50.A N ASP 48.A OD1 no hydrogen 2.741 N/A ALA 51.A N ASP 48.A O no hydrogen 2.873 N/A ARG 52.A N GLY 106.A O no hydrogen 2.939 N/A ARG 52.A NH2 ALA 217.A O no hydrogen 2.891 N/A ILE 53.A N GLY 106.A O no hydrogen 2.954 N/A LEU 54.A N VAL 146.A O no hydrogen 2.878 N/A LEU 55.A N TYR 108.A O no hydrogen 3.019 N/A PHE 56.A N VAL 148.A O no hydrogen 2.762 N/A GLY 57.A N THR 110.A O no hydrogen 2.846 N/A HIS 63.A ND1 TYR 38.A OH no hydrogen 2.582 N/A GLY 64.A N GLY 61.A O no hydrogen 3.115 N/A ASN 66.A N GLY 61.A O no hydrogen 3.304 N/A ASN 66.A ND2 ARG 23.A O no hydrogen 3.022 N/A ASN 66.A ND2 ALA 62.A O no hydrogen 3.064 N/A ARG 67.A N GLY 64.A O no hydrogen 2.975 N/A ARG 67.A NE HIS 63.A O no hydrogen 2.920 N/A ARG 67.A NH2 GLY 74.A O no hydrogen 2.935 N/A THR 68.A N GLY 64.A O no hydrogen 2.977 N/A THR 68.A OG1 GLY 64.A O no hydrogen 3.261 N/A THR 68.A OG1 ARG 70.A O no hydrogen 3.461 N/A THR 68.A OG1 THR 73.A O no hydrogen 2.809 N/A GLY 69.A N SER 65.A O no hydrogen 2.729 N/A ARG 70.A N THR 68.A OG1 no hydrogen 3.358 N/A ARG 70.A NH1 ASP 100.A OD1 no hydrogen 2.942 N/A ARG 70.A NH2 SER 96.A OG no hydrogen 3.069 N/A ARG 70.A NH2 ASP 100.A OD1 no hydrogen 2.806 N/A THR 73.A N ARG 70.A O no hydrogen 2.986 N/A THR 73.A OG1 ARG 70.A O no hydrogen 3.308 N/A THR 73.A OG1 PRO 71.A O no hydrogen 3.030 N/A THR 73.A OG1 SER 96.A OG no hydrogen 2.807 N/A GLY 78.A N ASP 75.A OD1 no hydrogen 3.050 N/A ALA 79.A N ASP 75.A O no hydrogen 3.094 N/A PHE 80.A N ALA 76.A O no hydrogen 3.201 N/A PHE 80.A N SER 77.A O no hydrogen 3.219 N/A LEU 81.A N SER 77.A O no hydrogen 2.821 N/A TYR 82.A N GLY 78.A O no hydrogen 2.968 N/A TYR 82.A OH PRO 71.A O no hydrogen 2.792 N/A LEU 85.A N LEU 81.A O no hydrogen 3.005 N/A HIS 86.A N TYR 82.A O no hydrogen 3.154 N/A GLU 87.A N PRO 83.A O no hydrogen 2.871 N/A ALA 88.A N LEU 84.A O no hydrogen 2.948 N/A GLY 89.A N HIS 86.A O no hydrogen 2.891 N/A LEU 90.A N LEU 85.A O no hydrogen 2.773 N/A SER 91.A OG LYS 93.A O no hydrogen 3.280 N/A SER 92.A N ARG 103.A O no hydrogen 2.792 N/A SER 92.A OG ARG 103.A O no hydrogen 3.533 N/A LYS 93.A NZ GLU 95.A O no hydrogen 2.837 N/A LYS 93.A NZ ASP 100.A OD2 no hydrogen 2.561 N/A SER 96.A OG THR 73.A OG1 no hydrogen 2.807 N/A LEU 97.A N ASP 100.A OD2 no hydrogen 2.787 N/A ASP 100.A N LEU 97.A O no hydrogen 2.924 N/A LEU 102.A N ASP 100.A OD1 no hydrogen 3.063 N/A ARG 103.A N SER 92.A OG no hydrogen 2.840 N/A TYR 105.A N LEU 90.A O no hydrogen 2.835 N/A GLY 106.A N ASP 48.A OD2 no hydrogen 2.969 N/A TYR 108.A N ILE 53.A O no hydrogen 3.050 N/A TYR 108.A OH GLU 137.A OE2 no hydrogen 2.694 N/A LEU 109.A N PHE 46.A O no hydrogen 2.810 N/A THR 110.A N LEU 55.A O no hydrogen 3.300 N/A THR 110.A OG1 GLU 137.A OE1 no hydrogen 2.483 N/A THR 110.A OG1 GLU 137.A OE2 no hydrogen 3.277 N/A ALA 111.A N THR 110.A OG1 no hydrogen 2.766 N/A ALA 112.A N GLY 57.A O no hydrogen 3.034 N/A VAL 113.A N LEU 58.A O no hydrogen 3.097 N/A ARG 114.A NE GLU 137.A OE1 no hydrogen 3.265 N/A ARG 114.A NH1 THR 134.A OG1 no hydrogen 3.379 N/A ARG 114.A NH2 THR 134.A OG1 no hydrogen 3.058 N/A ARG 114.A NH2 GLU 137.A OE1 no hydrogen 3.011 N/A ASN 120.A N PRO 117.A O no hydrogen 2.969 N/A LYS 121.A N PRO 118.A O no hydrogen 3.038 N/A THR 123.A N GLU 126.A OE1 no hydrogen 2.764 N/A GLU 126.A N THR 123.A OG1 no hydrogen 3.098 N/A LEU 127.A N THR 123.A O no hydrogen 3.016 N/A ARG 128.A N PRO 124.A O no hydrogen 3.056 N/A ALA 129.A N GLU 125.A O no hydrogen 3.044 N/A CYS 130.A N GLU 126.A O no hydrogen 3.063 N/A ALA 131.A N LEU 127.A O no hydrogen 2.995 N/A ARG 132.A N ALA 129.A O no hydrogen 3.281 N/A ARG 132.A NE ALA 129.A O no hydrogen 2.912 N/A TRP 133.A N CYS 130.A O no hydrogen 2.820 N/A THR 134.A N CYS 130.A O no hydrogen 3.213 N/A GLU 135.A N ALA 131.A O no hydrogen 3.136 N/A VAL 136.A N ARG 132.A O no hydrogen 3.300 N/A GLU 137.A N TRP 133.A O no hydrogen 2.764 N/A LEU 138.A N THR 134.A O no hydrogen 2.920 N/A GLY 139.A N GLU 135.A O no hydrogen 3.016 N/A LEU 140.A N GLU 137.A O no hydrogen 2.840 N/A LEU 141.A N LEU 138.A O no hydrogen 3.040 N/A ARG 145.A N ARG 52.A O no hydrogen 2.686 N/A VAL 146.A N ARG 52.A O no hydrogen 2.933 N/A TYR 147.A N HIS 184.A O no hydrogen 2.887 N/A VAL 148.A N LEU 54.A O no hydrogen 2.712 N/A ALA 149.A N LEU 186.A O no hydrogen 2.796 N/A LEU 150.A N PHE 56.A O no hydrogen 2.821 N/A GLY 151.A N SER 188.A O no hydrogen 2.731 N/A ARG 152.A NH2 GLU 156.A OE2 no hydrogen 3.202 N/A LEU 155.A N GLY 151.A O no hydrogen 3.086 N/A GLU 156.A N ARG 152.A O no hydrogen 3.044 N/A ALA 157.A N ILE 153.A O no hydrogen 3.057 N/A LEU 158.A N ALA 154.A O no hydrogen 2.997 N/A LEU 159.A N LEU 155.A O no hydrogen 2.772 N/A ALA 160.A N GLU 156.A O no hydrogen 3.032 N/A HIS 161.A N ALA 157.A O no hydrogen 2.997 N/A HIS 161.A ND1 GLU 135.A OE1 no hydrogen 2.563 N/A PHE 162.A N LEU 158.A O no hydrogen 2.850 N/A GLY 163.A N ALA 160.A O no hydrogen 3.069 N/A LEU 164.A N LEU 159.A O no hydrogen 2.793 N/A LYS 166.A NZ GLU 156.A OE1 no hydrogen 3.443 N/A ALA 168.A N ARG 165.A O no hydrogen 3.236 N/A HIS 169.A N LYS 166.A O no hydrogen 2.939 N/A HIS 169.A ND1 ARG 165.A O no hydrogen 2.566 N/A GLY 174.A N ALA 187.A O no hydrogen 2.934 N/A ALA 175.A N ARG 172.A O no hydrogen 2.997 N/A TYR 177.A N LEU 185.A O no hydrogen 2.788 N/A TYR 177.A OH PRO 170.A O no hydrogen 2.573 N/A LEU 179.A N ARG 183.A O no hydrogen 2.976 N/A ARG 183.A N LEU 179.A O no hydrogen 3.252 N/A ARG 183.A NE PRO 180.A O no hydrogen 2.806 N/A ARG 183.A NH1 PRO 180.A O no hydrogen 3.370 N/A HIS 184.A N ARG 145.A O no hydrogen 2.825 N/A LEU 185.A N TYR 177.A O no hydrogen 2.823 N/A LEU 186.A N TYR 147.A O no hydrogen 2.896 N/A ALA 187.A N ALA 175.A O no hydrogen 2.967 N/A SER 188.A N ALA 149.A O no hydrogen 2.977 N/A SER 188.A OG TYR 189.A O no hydrogen 2.923 N/A TYR 189.A N HIS 173.A ND1 no hydrogen 3.063 N/A SER 192.A N HIS 190.A ND1 no hydrogen 2.977 N/A GLN 194.A N SER 192.A OG no hydrogen 3.055 N/A ASN 195.A N SER 192.A O no hydrogen 2.741 N/A THR 196.A N SER 192.A O no hydrogen 2.974 N/A THR 196.A OG1 SER 192.A O no hydrogen 3.564 N/A GLN 197.A N ARG 193.A O no hydrogen 2.978 N/A THR 198.A OG1 GLN 194.A O no hydrogen 2.371 N/A THR 198.A OG1 ASN 195.A O no hydrogen 3.142 N/A LEU 201.A N ASN 195.A O no hydrogen 2.976 N/A MET 205.A N THR 202.A OG1 no hydrogen 3.122 N/A PHE 206.A N THR 202.A O no hydrogen 3.033 N/A LEU 207.A N ARG 203.A O no hydrogen 2.910 N/A GLU 208.A N GLU 204.A O no hydrogen 3.107 N/A VAL 209.A N MET 205.A O no hydrogen 3.128 N/A LEU 210.A N PHE 206.A O no hydrogen 3.000 N/A MET 211.A N LEU 207.A O no hydrogen 2.829 N/A GLU 212.A N GLU 208.A O no hydrogen 2.897 N/A ALA 213.A N VAL 209.A O no hydrogen 2.859 N/A LYS 214.A N LEU 210.A O no hydrogen 2.950 N/A LYS 214.A NZ ALA 88.A O no hydrogen 2.786 N/A ARG 215.A N MET 211.A O no hydrogen 2.990 N/A ARG 215.A NE GLU 212.A OE1 no hydrogen 2.783 N/A ARG 215.A NH2 GLU 212.A OE1 no hydrogen 2.818 N/A ARG 215.A NH2 GLU 212.A OE2 no hydrogen 2.790 N/A LEU 216.A N GLU 212.A O no hydrogen 2.922 N/A ALA 217.A N ALA 213.A O no hydrogen 2.928 N/A ALA 217.A N LYS 214.A O no hydrogen 3.145 N/A GLY 218.A N ARG 215.A O no hydrogen 3.139 N/A LEU 219.A N LYS 214.A O no hydrogen 2.816 N/A