Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ec3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 4.A N GLN 41.A OE1 no hydrogen 2.743 N/A SER 4.A OG HIS 55.A ND1 no hydrogen 2.863 N/A LYS 5.A N PHE 53.A O no hydrogen 2.868 N/A ILE 7.A N HIS 55.A O no hydrogen 2.905 N/A GLN 12.A N THR 9.A OG1 no hydrogen 3.191 N/A GLN 14.A N LEU 10.A O no hydrogen 3.005 N/A GLU 15.A N LYS 11.A O no hydrogen 2.897 N/A PHE 16.A N GLN 12.A O no hydrogen 3.025 N/A LEU 17.A N VAL 13.A O no hydrogen 3.157 N/A LEU 17.A N GLN 14.A O no hydrogen 3.174 N/A LYS 18.A N GLN 14.A O no hydrogen 3.029 N/A LYS 18.A NZ GLN 14.A O no hydrogen 3.243 N/A ASP 19.A N GLU 15.A O no hydrogen 2.878 N/A GLY 20.A N PHE 16.A O no hydrogen 2.950 N/A VAL 23.A N ASP 22.A OD1 no hydrogen 2.888 N/A LEU 26.A N VAL 73.A O no hydrogen 2.804 N/A GLY 27.A N HIS 54.A O no hydrogen 2.905 N/A VAL 28.A N LYS 71.A O no hydrogen 2.720 N/A PHE 29.A N THR 56.A O no hydrogen 2.950 N/A GLN 30.A N ASP 34.A OD2 no hydrogen 2.814 N/A ASP 34.A N GLY 31.A O no hydrogen 3.072 N/A GLY 36.A N ASP 34.A OD1 no hydrogen 3.170 N/A LEU 38.A N ASP 34.A O no hydrogen 3.126 N/A GLN 39.A N PRO 35.A O no hydrogen 3.105 N/A GLN 39.A NE2 THR 94.A O no hydrogen 2.766 N/A TYR 40.A N GLY 36.A O no hydrogen 2.926 N/A TYR 40.A OH HIS 54.A O no hydrogen 2.625 N/A GLN 41.A N TYR 37.A O no hydrogen 2.921 N/A GLN 41.A NE2 SER 4.A O no hydrogen 3.299 N/A GLN 41.A NE2 TYR 37.A OH no hydrogen 2.772 N/A ASP 42.A N LEU 38.A O no hydrogen 3.089 N/A ALA 43.A N GLN 39.A O no hydrogen 3.043 N/A ALA 44.A N TYR 40.A O no hydrogen 2.826 N/A ASN 45.A N GLN 41.A O no hydrogen 2.952 N/A THR 46.A N ASP 42.A O no hydrogen 3.334 N/A THR 46.A OG1 ASP 42.A O no hydrogen 3.446 N/A LEU 47.A N ALA 43.A O no hydrogen 3.166 N/A ARG 48.A N ASN 45.A O no hydrogen 3.375 N/A ARG 48.A NH1 SER 1.A O no hydrogen 3.218 N/A ARG 48.A NH1 ASN 45.A OD1 no hydrogen 2.873 N/A ARG 48.A NH2 SER 1.A O no hydrogen 3.156 N/A ASP 50.A N LEU 47.A O no hydrogen 2.965 N/A TYR 51.A N LEU 47.A O no hydrogen 3.117 N/A HIS 54.A N ILE 25.A O no hydrogen 2.894 N/A HIS 55.A N LYS 5.A O no hydrogen 3.027 N/A HIS 55.A ND1 SER 4.A OG no hydrogen 2.863 N/A THR 56.A N GLY 27.A O no hydrogen 2.740 N/A SER 58.A N THR 56.A OG1 no hydrogen 3.177 N/A ILE 61.A N SER 58.A OG no hydrogen 3.047 N/A ALA 62.A N SER 58.A O no hydrogen 3.045 N/A LYS 63.A N THR 59.A O no hydrogen 2.870 N/A PHE 64.A N GLU 60.A O no hydrogen 3.004 N/A LEU 65.A N ILE 61.A O no hydrogen 2.864 N/A LYS 66.A N LYS 63.A O no hydrogen 2.965 N/A VAL 67.A N ALA 62.A O no hydrogen 3.084 N/A GLY 70.A N VAL 28.A O no hydrogen 2.630 N/A LYS 71.A N VAL 28.A O no hydrogen 2.957 N/A LYS 71.A NZ ASP 89.A OD1 no hydrogen 2.514 N/A VAL 73.A N LEU 26.A O no hydrogen 2.801 N/A LEU 74.A N HIS 87.A O no hydrogen 2.871 N/A GLN 75.A NE2 ALA 107.A O no hydrogen 3.096 N/A GLU 77.A N LEU 17.A O no hydrogen 2.834 N/A LYS 78.A NZ GLY 20.A O no hydrogen 2.909 N/A PHE 79.A N PRO 76.A O no hydrogen 2.912 N/A GLN 80.A N GLU 77.A O no hydrogen 3.145 N/A GLN 80.A NE2 GLN 75.A O no hydrogen 3.189 N/A SER 81.A OG GLU 84.A OE1 no hydrogen 2.573 N/A TYR 83.A N SER 81.A OG no hydrogen 3.119 N/A TYR 83.A OH GLU 154.A OE1 no hydrogen 3.267 N/A TYR 83.A OH GLU 154.A OE2 no hydrogen 2.663 N/A GLU 84.A N SER 81.A O no hydrogen 3.330 N/A HIS 87.A N LEU 74.A O no hydrogen 2.877 N/A VAL 90.A N GLY 70.A O no hydrogen 3.031 N/A GLN 91.A N THR 94.A OG1 no hydrogen 2.660 N/A THR 94.A N GLN 91.A O no hydrogen 3.021 N/A THR 94.A OG1 GLN 91.A O no hydrogen 3.235 N/A SER 97.A OG GLU 95.A OE2 no hydrogen 3.081 N/A ALA 98.A N GLU 95.A O no hydrogen 3.030 N/A ILE 99.A N GLU 95.A O no hydrogen 3.298 N/A LYS 100.A N ALA 96.A O no hydrogen 2.920 N/A ASP 101.A N SER 97.A O no hydrogen 2.892 N/A TYR 102.A N ALA 98.A O no hydrogen 3.001 N/A VAL 103.A N ILE 99.A O no hydrogen 3.120 N/A VAL 104.A N LYS 100.A O no hydrogen 3.122 N/A LYS 105.A N ASP 101.A O no hydrogen 2.880 N/A HIS 106.A N TYR 102.A O no hydrogen 2.913 N/A LEU 110.A N GLU 84.A OE2 no hydrogen 2.845 N/A ARG 114.A N ILE 166.A O no hydrogen 2.900 N/A ARG 114.A NH1 GLU 175.A OE1 no hydrogen 2.873 N/A ARG 114.A NH1 GLU 175.A OE2 no hydrogen 3.417 N/A ARG 114.A NH2 GLU 175.A OE2 no hydrogen 2.731 N/A LYS 115.A N ASN 118.A OD1 no hydrogen 2.955 N/A LYS 115.A NZ ASP 21.A OD2 no hydrogen 2.584 N/A THR 116.A N ASP 171.A OD2 no hydrogen 3.120 N/A THR 116.A OG1 ASP 171.A OD1 no hydrogen 2.739 N/A ASN 118.A N LYS 115.A O no hydrogen 2.832 N/A ASN 118.A ND2 HIS 113.A O no hydrogen 2.964 N/A LYS 121.A NZ GLU 49.A O no hydrogen 3.044 N/A ARG 122.A N ASN 118.A O no hydrogen 2.716 N/A ARG 122.A NH1 ASP 22.A OD2 no hydrogen 2.662 N/A ARG 122.A NH2 ASP 22.A OD2 no hydrogen 2.718 N/A ARG 122.A NH2 ASP 50.A O no hydrogen 2.745 N/A TYR 123.A N ASP 119.A O no hydrogen 2.830 N/A SER 124.A OG ALA 120.A O no hydrogen 3.253 N/A ARG 126.A NH1 TYR 123.A O no hydrogen 2.833 N/A ARG 126.A NH1 LYS 125.A O no hydrogen 2.927 N/A LEU 128.A N LEU 193.A O no hydrogen 2.918 N/A VAL 129.A N THR 163.A O no hydrogen 2.698 N/A VAL 130.A N ALA 191.A O no hydrogen 2.802 N/A VAL 131.A N ALA 165.A O no hydrogen 2.885 N/A TYR 132.A N ASN 189.A O no hydrogen 2.723 N/A TYR 132.A OH GLU 175.A OE2 no hydrogen 2.551 N/A TYR 133.A N ALA 167.A O no hydrogen 3.031 N/A TYR 133.A OH THR 145.A O no hydrogen 2.738 N/A VAL 135.A N ASP 168.A OD2 no hydrogen 3.005 N/A ASP 136.A N THR 145.A OG1 no hydrogen 3.011 N/A SER 138.A N ASP 136.A OD1 no hydrogen 2.924 N/A SER 138.A OG ASP 136.A OD1 no hydrogen 2.827 N/A TYR 141.A N SER 138.A O no hydrogen 3.021 N/A ARG 142.A N SER 138.A O no hydrogen 2.895 N/A THR 145.A N TYR 141.A O no hydrogen 3.143 N/A THR 145.A OG1 ASP 136.A O no hydrogen 2.796 N/A THR 145.A OG1 TYR 141.A O no hydrogen 3.126 N/A GLN 146.A N ARG 142.A O no hydrogen 2.896 N/A GLN 146.A NE2 LYS 78.A O no hydrogen 2.882 N/A PHE 147.A N THR 143.A O no hydrogen 2.797 N/A TRP 148.A N ALA 144.A O no hydrogen 3.254 N/A ARG 149.A N THR 145.A O no hydrogen 2.954 N/A ARG 149.A NE VAL 111.A O no hydrogen 3.035 N/A ARG 149.A NH1 GLN 80.A O no hydrogen 3.053 N/A ARG 149.A NH1 GLN 146.A OE1 no hydrogen 3.121 N/A ARG 149.A NH2 GLN 80.A O no hydrogen 3.500 N/A ARG 149.A NH2 VAL 111.A O no hydrogen 3.133 N/A ASN 150.A N GLN 146.A O no hydrogen 2.792 N/A LYS 151.A N TRP 148.A O no hydrogen 3.047 N/A VAL 152.A N TRP 148.A O no hydrogen 3.275 N/A LEU 153.A N ARG 149.A O no hydrogen 2.882 N/A GLU 154.A N ASN 150.A O no hydrogen 3.197 N/A VAL 155.A N VAL 152.A O no hydrogen 3.001 N/A ALA 156.A N VAL 152.A O no hydrogen 2.835 N/A LYS 157.A N LEU 153.A O no hydrogen 3.086 N/A LYS 157.A NZ GLU 154.A O no hydrogen 3.078 N/A LYS 157.A NZ ASP 158.A OD1 no hydrogen 3.397 N/A LYS 157.A NZ ASP 158.A OD2 no hydrogen 3.332 N/A ASP 158.A N VAL 155.A O no hydrogen 2.863 N/A PHE 159.A N ALA 156.A O no hydrogen 3.131 N/A GLU 161.A N GLU 161.A OE1 no hydrogen 2.749 N/A TYR 162.A N PHE 159.A O no hydrogen 2.978 N/A THR 163.A N PRO 127.A O no hydrogen 3.179 N/A ALA 165.A N VAL 129.A O no hydrogen 2.951 N/A ILE 166.A N GLY 112.A O no hydrogen 2.953 N/A ALA 167.A N VAL 131.A O no hydrogen 2.752 N/A GLU 169.A N TYR 133.A O no hydrogen 2.807 N/A GLU 170.A N ASP 168.A OD1 no hydrogen 3.167 N/A ASP 171.A N ASP 168.A OD1 no hydrogen 2.981 N/A TYR 172.A N ASP 168.A O no hydrogen 3.014 N/A TYR 172.A OH ASP 119.A OD2 no hydrogen 2.525 N/A ALA 173.A N GLU 170.A O no hydrogen 2.975 N/A VAL 176.A N TYR 172.A O no hydrogen 2.836 N/A LYS 177.A N ALA 173.A O no hydrogen 2.892 N/A ASP 178.A N THR 174.A O no hydrogen 3.027 N/A LEU 179.A N GLU 175.A O no hydrogen 3.001 N/A GLY 180.A N LYS 177.A O no hydrogen 2.782 N/A LEU 181.A N VAL 176.A O no hydrogen 3.018 N/A GLU 183.A N GLU 183.A OE1 no hydrogen 2.711 N/A SER 184.A OG LEU 181.A O no hydrogen 3.138 N/A SER 184.A OG ASN 189.A OD1 no hydrogen 2.993 N/A ASN 189.A N TYR 132.A O no hydrogen 2.997 N/A ASN 189.A ND2 GLY 186.A O no hydrogen 3.416 N/A ALA 191.A N VAL 130.A O no hydrogen 2.915 N/A ILE 192.A N PHE 200.A O no hydrogen 2.914 N/A LEU 193.A N LEU 128.A O no hydrogen 2.839 N/A ASP 194.A N LYS 198.A O no hydrogen 2.996 N/A SER 196.A N ASP 194.A OD1 no hydrogen 3.010 N/A GLY 197.A N ASP 194.A O no hydrogen 3.277 N/A GLY 197.A N ASP 194.A OD1 no hydrogen 3.093 N/A LYS 198.A N ASP 194.A OD1 no hydrogen 2.893 N/A PHE 200.A N ILE 192.A O no hydrogen 2.898 N/A SER 208.A OG LYS 151.A O no hydrogen 2.582 N/A ALA 210.A N ASP 207.A OD1 no hydrogen 2.899 N/A LEU 211.A N ASP 207.A O no hydrogen 3.076 N/A ARG 212.A N SER 208.A O no hydrogen 2.615 N/A GLU 213.A N ASP 209.A O no hydrogen 2.885 N/A PHE 214.A N ALA 210.A O no hydrogen 3.136 N/A VAL 215.A N LEU 211.A O no hydrogen 3.158 N/A PHE 217.A N PHE 214.A O no hydrogen 2.950 N/A LYS 218.A N VAL 215.A O no hydrogen 2.878 N/A LYS 218.A NZ GLU 161.A OE2 no hydrogen 2.655 N/A LYS 218.A NZ TYR 162.A OH no hydrogen 2.953 N/A GLY 220.A N PHE 217.A O no hydrogen 3.026 N/A LYS 221.A N ALA 216.A O no hydrogen 2.734 N/A VAL 225.A N LYS 199.A O no hydrogen 2.814 N/A