Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3sju_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 2.A OG1 PHE 75.A O no hydrogen 3.325 N/A ALA 3.A N ALA 26.A O no hydrogen 2.576 N/A PHE 4.A N ILE 80.A O no hydrogen 2.578 N/A VAL 5.A N TYR 28.A O no hydrogen 2.913 N/A THR 6.A N VAL 82.A O no hydrogen 2.936 N/A GLY 7.A N CYS 30.A O no hydrogen 2.822 N/A VAL 8.A N CYS 30.A O no hydrogen 3.212 N/A LEU 14.A N SER 10.A O no hydrogen 3.252 N/A ALA 15.A N GLY 11.A O no hydrogen 2.872 N/A VAL 16.A N ILE 12.A O no hydrogen 2.729 N/A ALA 17.A N GLY 13.A O no hydrogen 2.935 N/A ARG 18.A N LEU 14.A O no hydrogen 2.895 N/A THR 19.A N ALA 15.A O no hydrogen 2.923 N/A THR 19.A OG1 ALA 15.A O no hydrogen 2.888 N/A LEU 20.A N VAL 16.A O no hydrogen 2.927 N/A ALA 21.A N ALA 17.A O no hydrogen 2.970 N/A ALA 22.A N ARG 18.A O no hydrogen 2.986 N/A ARG 23.A N LEU 20.A O no hydrogen 3.189 N/A GLY 24.A N ALA 21.A O no hydrogen 2.890 N/A ILE 25.A N LEU 20.A O no hydrogen 3.106 N/A ALA 26.A N GLN 1.A O no hydrogen 3.075 N/A VAL 27.A N ASP 50.A O no hydrogen 3.109 N/A TYR 28.A N ALA 3.A O no hydrogen 2.789 N/A TYR 28.A OH SER 54.A OG no hydrogen 3.146 N/A GLY 29.A N ASP 52.A O no hydrogen 2.786 N/A CYS 30.A N VAL 5.A O no hydrogen 3.024 N/A ASN 36.A N ASP 33.A OD2 no hydrogen 2.739 N/A VAL 37.A N ASP 33.A O no hydrogen 2.849 N/A SER 38.A N ALA 34.A O no hydrogen 2.696 N/A ALA 39.A N LYS 35.A O no hydrogen 2.725 N/A ALA 40.A N ASN 36.A O no hydrogen 2.924 N/A VAL 41.A N VAL 37.A O no hydrogen 2.882 N/A ASP 42.A N SER 38.A O no hydrogen 2.967 N/A GLY 43.A N ALA 39.A O no hydrogen 3.041 N/A LEU 44.A N ALA 40.A O no hydrogen 3.164 N/A ARG 45.A N VAL 41.A O no hydrogen 2.923 N/A ARG 45.A NH1 VAL 51.A O no hydrogen 3.065 N/A ALA 46.A N ASP 42.A O no hydrogen 2.956 N/A ALA 47.A N LEU 44.A O no hydrogen 3.186 N/A GLY 48.A N ARG 45.A O no hydrogen 3.212 N/A ASP 52.A N VAL 27.A O no hydrogen 3.060 N/A GLY 53.A N ASP 52.A OD1 no hydrogen 2.726 N/A SER 54.A N GLY 29.A O no hydrogen 3.448 N/A SER 54.A OG TYR 28.A OH no hydrogen 3.146 N/A CYS 56.A N ALA 31.A O no hydrogen 2.783 N/A ASP 57.A N GLU 63.A OE1 no hydrogen 3.068 N/A THR 59.A N ASP 57.A OD2 no hydrogen 2.852 N/A THR 59.A OG1 ASP 57.A OD2 no hydrogen 2.383 N/A SER 60.A N ASP 57.A O no hydrogen 2.713 N/A GLU 63.A N SER 60.A OG no hydrogen 3.190 N/A VAL 64.A N SER 60.A O no hydrogen 3.110 N/A HIS 65.A N THR 61.A O no hydrogen 2.900 N/A HIS 65.A ND1 GLU 118.A OE1 no hydrogen 2.496 N/A ALA 66.A N ASP 62.A O no hydrogen 3.001 N/A ALA 67.A N GLU 63.A O no hydrogen 2.744 N/A VAL 68.A N VAL 64.A O no hydrogen 3.125 N/A ALA 69.A N HIS 65.A O no hydrogen 2.861 N/A ALA 70.A N ALA 66.A O no hydrogen 2.603 N/A ALA 71.A N ALA 67.A O no hydrogen 2.786 N/A VAL 72.A N VAL 68.A O no hydrogen 3.029 N/A GLU 73.A N ALA 69.A O no hydrogen 3.009 N/A ARG 74.A N ALA 70.A O no hydrogen 2.895 N/A ARG 74.A NE ASP 52.A OD2 no hydrogen 2.201 N/A PHE 75.A N ALA 71.A O no hydrogen 2.924 N/A GLY 76.A N VAL 72.A O no hydrogen 2.688 N/A ILE 78.A N GLY 123.A O no hydrogen 2.745 N/A GLY 79.A N THR 2.A O no hydrogen 2.917 N/A ILE 80.A N THR 2.A O no hydrogen 3.233 N/A LEU 81.A N ARG 132.A O no hydrogen 2.834 N/A VAL 82.A N PHE 4.A O no hydrogen 2.829 N/A ASN 83.A N VAL 134.A O no hydrogen 2.936 N/A SER 84.A N THR 6.A O no hydrogen 3.118 N/A SER 84.A OG SER 84.A O no hydrogen 2.445 N/A ALA 85.A N THR 6.A OG1 no hydrogen 3.061 N/A ARG 87.A NE ASP 103.A OD1 no hydrogen 3.098 N/A ARG 87.A NH1 ASN 88.A O no hydrogen 3.025 N/A ARG 87.A NH2 ASP 103.A OD2 no hydrogen 2.742 N/A GLY 91.A N TYR 147.A O no hydrogen 2.787 N/A ASP 95.A N GLU 92.A O no hydrogen 2.930 N/A LEU 96.A N THR 93.A O no hydrogen 3.324 N/A LEU 100.A N ASP 97.A OD2 no hydrogen 2.780 N/A TRP 101.A N ASP 97.A O no hydrogen 3.128 N/A ALA 102.A N ASP 98.A O no hydrogen 2.879 N/A ASP 103.A N ALA 99.A O no hydrogen 2.915 N/A VAL 104.A N LEU 100.A O no hydrogen 3.258 N/A LEU 105.A N TRP 101.A O no hydrogen 3.040 N/A ASP 106.A N ALA 102.A O no hydrogen 2.683 N/A THR 107.A N ASP 103.A O no hydrogen 2.996 N/A THR 107.A OG1 ASP 103.A O no hydrogen 3.057 N/A ASN 108.A N VAL 104.A O no hydrogen 3.047 N/A ASN 108.A ND2 ARG 87.A O no hydrogen 2.664 N/A ASN 108.A ND2 SER 154.A OG no hydrogen 3.388 N/A LEU 109.A N LEU 105.A O no hydrogen 3.043 N/A THR 110.A N LEU 105.A O no hydrogen 2.980 N/A PHE 113.A N LEU 109.A O no hydrogen 3.032 N/A ARG 114.A N THR 110.A O no hydrogen 2.717 N/A ARG 114.A NE VAL 58.A O no hydrogen 2.815 N/A ARG 114.A NH2 VAL 58.A O no hydrogen 3.098 N/A ARG 114.A NH2 ASP 106.A OD1 no hydrogen 2.792 N/A VAL 115.A N GLY 111.A O no hydrogen 2.971 N/A THR 116.A N VAL 112.A O no hydrogen 2.997 N/A THR 116.A OG1 ASN 83.A OD1 no hydrogen 3.366 N/A THR 116.A OG1 VAL 112.A O no hydrogen 2.660 N/A ARG 117.A N PHE 113.A O no hydrogen 2.864 N/A GLU 118.A N ARG 114.A O no hydrogen 3.033 N/A VAL 119.A N VAL 115.A O no hydrogen 3.062 N/A LEU 120.A N THR 116.A O no hydrogen 2.948 N/A ARG 121.A N ARG 117.A O no hydrogen 2.796 N/A ALA 122.A N GLU 118.A O no hydrogen 2.577 N/A GLY 123.A N VAL 119.A O no hydrogen 2.921 N/A GLU 127.A N GLY 124.A O no hydrogen 3.227 N/A ALA 128.A N GLY 124.A O no hydrogen 3.346 N/A ALA 128.A N MET 125.A O no hydrogen 3.278 N/A GLY 131.A N GLY 173.A O no hydrogen 3.251 N/A ARG 132.A N GLY 79.A O no hydrogen 2.930 N/A ARG 132.A NE LEU 233.A O no hydrogen 3.203 N/A ARG 132.A NE THR 235.A O no hydrogen 3.217 N/A ARG 132.A NH1 GLY 131.A O no hydrogen 3.185 N/A ARG 132.A NH2 THR 235.A O no hydrogen 2.783 N/A ILE 133.A N THR 175.A O no hydrogen 2.874 N/A VAL 134.A N LEU 81.A O no hydrogen 2.781 N/A ASN 135.A N ASN 177.A O no hydrogen 2.878 N/A ILE 136.A N ASN 83.A O no hydrogen 3.102 N/A ALA 137.A N VAL 179.A O no hydrogen 2.815 N/A SER 138.A OG TYR 151.A OH no hydrogen 3.107 N/A THR 139.A N PRO 181.A O no hydrogen 3.049 N/A THR 139.A OG1 PRO 181.A O no hydrogen 3.550 N/A GLY 140.A N SER 138.A OG no hydrogen 3.092 N/A GLY 141.A N SER 138.A O no hydrogen 2.885 N/A LYS 142.A N THR 139.A O no hydrogen 3.086 N/A LYS 142.A NZ ALA 245.A O no hydrogen 2.654 N/A LYS 142.A NZ ASN 247.A OD1 no hydrogen 2.656 N/A LYS 142.A NZ TYR 255.A O no hydrogen 3.101 N/A GLN 143.A NE2 LEU 252.A O no hydrogen 3.452 N/A ALA 148.A N VAL 145.A O no hydrogen 2.987 N/A TYR 151.A OH SER 138.A OG no hydrogen 3.107 N/A THR 152.A N ALA 148.A O no hydrogen 2.890 N/A THR 152.A OG1 ALA 148.A O no hydrogen 2.921 N/A ALA 153.A N ALA 149.A O no hydrogen 2.755 N/A SER 154.A N PRO 150.A O no hydrogen 2.919 N/A SER 154.A OG PRO 150.A O no hydrogen 3.495 N/A SER 154.A OG TYR 151.A O no hydrogen 2.636 N/A LYS 155.A N TYR 151.A O no hydrogen 2.887 N/A LYS 155.A NZ ILE 136.A O no hydrogen 3.180 N/A LYS 155.A NZ ALA 137.A O no hydrogen 3.501 N/A HIS 156.A N THR 152.A O no hydrogen 2.884 N/A GLY 157.A N ALA 153.A O no hydrogen 2.935 N/A VAL 158.A N SER 154.A O no hydrogen 3.057 N/A VAL 159.A N LYS 155.A O no hydrogen 3.036 N/A GLY 160.A N HIS 156.A O no hydrogen 2.940 N/A PHE 161.A N GLY 157.A O no hydrogen 2.743 N/A THR 162.A N VAL 158.A O no hydrogen 2.833 N/A THR 162.A OG1 ASN 135.A OD1 no hydrogen 2.890 N/A THR 162.A OG1 VAL 158.A O no hydrogen 2.656 N/A LYS 163.A N VAL 159.A O no hydrogen 3.182 N/A SER 164.A N GLY 160.A O no hydrogen 3.101 N/A SER 164.A OG GLY 160.A O no hydrogen 3.527 N/A VAL 165.A N PHE 161.A O no hydrogen 2.911 N/A GLY 166.A N THR 162.A O no hydrogen 2.813 N/A PHE 167.A N LYS 163.A O no hydrogen 2.882 N/A GLU 168.A N SER 164.A O no hydrogen 2.855 N/A LEU 169.A N VAL 165.A O no hydrogen 2.996 N/A ALA 170.A N PHE 167.A O no hydrogen 3.268 N/A THR 172.A N LEU 169.A O no hydrogen 3.098 N/A THR 172.A OG1 LEU 169.A O no hydrogen 2.428 N/A ILE 174.A N THR 172.A OG1 no hydrogen 3.209 N/A THR 175.A N GLY 131.A O no hydrogen 2.817 N/A VAL 176.A N THR 242.A OG1 no hydrogen 2.985 N/A ASN 177.A N ILE 133.A O no hydrogen 2.993 N/A ASN 177.A ND2 ILE 241.A O no hydrogen 2.850 N/A ALA 178.A N GLN 244.A O no hydrogen 2.880 N/A VAL 179.A N ASN 135.A O no hydrogen 2.857 N/A CYS 180.A N LEU 246.A O no hydrogen 2.742 N/A GLY 182.A N VAL 248.A O no hydrogen 3.119 N/A GLU 185.A N SER 221.A O no hydrogen 2.855 N/A THR 186.A N VAL 184.A O no hydrogen 2.946 N/A GLU 190.A N THR 186.A O no hydrogen 2.999 N/A ARG 191.A N PRO 187.A O no hydrogen 2.740 N/A VAL 192.A N MET 188.A O no hydrogen 2.856 N/A ARG 193.A N ALA 189.A O no hydrogen 3.130 N/A ARG 193.A NE TYR 220.A OH no hydrogen 3.561 N/A ARG 193.A NH1 GLU 204.A OE1 no hydrogen 2.901 N/A ARG 193.A NH2 GLU 185.A OE1 no hydrogen 3.230 N/A GLU 194.A N GLU 190.A O no hydrogen 3.028 N/A GLY 195.A N ARG 191.A O no hydrogen 2.898 N/A GLU 206.A N THR 203.A O no hydrogen 2.926 N/A GLU 206.A N THR 203.A OG1 no hydrogen 3.294 N/A VAL 207.A N THR 203.A O no hydrogen 3.448 N/A HIS 208.A N GLU 204.A O no hydrogen 3.077 N/A GLU 209.A N GLN 205.A O no hydrogen 3.049 N/A ARG 210.A N GLU 206.A O no hydrogen 2.937 N/A PHE 211.A N VAL 207.A O no hydrogen 3.088 N/A ASN 212.A N HIS 208.A O no hydrogen 2.647 N/A ALA 213.A N GLU 209.A O no hydrogen 2.796 N/A LYS 214.A N PHE 211.A O no hydrogen 3.094 N/A ILE 215.A N ASN 212.A O no hydrogen 2.855 N/A LEU 217.A N GLY 250.A O no hydrogen 2.828 N/A GLY 218.A N ILE 215.A O no hydrogen 2.690 N/A ARG 219.A NH1 TYR 220.A O no hydrogen 2.770 N/A ARG 219.A NH1 GLU 225.A OE1 no hydrogen 2.872 N/A ARG 219.A NH2 GLU 225.A OE1 no hydrogen 3.482 N/A ARG 219.A NH2 GLU 225.A OE2 no hydrogen 2.864 N/A SER 221.A N TYR 183.A O no hydrogen 2.918 N/A THR 222.A N GLU 225.A OE1 no hydrogen 3.183 N/A GLU 225.A N THR 222.A O no hydrogen 2.882 N/A GLU 225.A N THR 222.A OG1 no hydrogen 3.076 N/A VAL 226.A N THR 222.A O no hydrogen 3.234 N/A ALA 227.A N PRO 223.A O no hydrogen 2.714 N/A GLY 228.A N GLU 224.A O no hydrogen 2.743 N/A LEU 229.A N GLU 225.A O no hydrogen 3.391 N/A LEU 229.A N VAL 226.A O no hydrogen 3.064 N/A VAL 230.A N VAL 226.A O no hydrogen 3.355 N/A GLY 231.A N ALA 227.A O no hydrogen 2.849 N/A TYR 232.A N GLY 228.A O no hydrogen 2.883 N/A LEU 233.A N LEU 229.A O no hydrogen 2.800 N/A VAL 234.A N VAL 230.A O no hydrogen 3.290 N/A THR 235.A N TYR 232.A O no hydrogen 3.101 N/A ALA 239.A N ASP 236.A O no hydrogen 2.936 N/A ILE 241.A N ALA 238.A O no hydrogen 3.084 N/A ALA 243.A N VAL 176.A O no hydrogen 2.795 N/A GLN 244.A N ASN 177.A OD1 no hydrogen 3.031 N/A GLN 244.A NE2 THR 242.A O no hydrogen 2.908 N/A LEU 246.A N ALA 178.A O no hydrogen 2.864 N/A VAL 248.A N CYS 180.A O no hydrogen 3.058 N/A LEU 252.A N CYS 249.A O no hydrogen 3.215 N/A ASN 254.A N GLN 143.A OE1 no hydrogen 2.765 N/A TYR 255.A OH LYS 142.A O no hydrogen 2.963 N/A