Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8aly_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 5.A OG1 ASP 1.A O no hydrogen 3.545 N/A GLN 6.A N PHE 2.A O no hydrogen 3.223 N/A PHE 7.A N SER 3.A O no hydrogen 2.940 N/A VAL 8.A N ILE 4.A O no hydrogen 2.904 N/A ARG 9.A N THR 5.A O no hydrogen 2.878 N/A ASN 10.A N GLN 6.A O no hydrogen 2.874 N/A LEU 11.A N PHE 7.A O no hydrogen 3.013 N/A GLY 12.A N ARG 9.A O no hydrogen 3.104 N/A LEU 13.A N VAL 8.A O no hydrogen 3.043 N/A GLU 14.A N GLU 14.A OE1 no hydrogen 3.078 N/A LEU 16.A N LEU 13.A O no hydrogen 2.949 N/A PHE 20.A N LEU 16.A O no hydrogen 3.008 N/A GLU 21.A N MET 17.A O no hydrogen 2.832 N/A ARG 22.A N ASP 18.A O no hydrogen 2.902 N/A ARG 22.A NH2.A ILE 41.A O no hydrogen 3.487 N/A GLU 23.A N ILE 19.A O no hydrogen 2.996 N/A GLN 24.A N GLU 21.A O no hydrogen 3.378 N/A ILE 25.A N PHE 20.A O no hydrogen 3.045 N/A THR 26.A OG1 ASP 28.A OD1 no hydrogen 2.346 N/A VAL 29.A N THR 26.A O no hydrogen 3.050 N/A LEU 30.A N THR 26.A O no hydrogen 2.703 N/A VAL 31.A N LEU 27.A O no hydrogen 2.965 N/A GLU 32.A N VAL 29.A O no hydrogen 3.171 N/A GLY 34.A N GLU 37.A OE1 no hydrogen 3.263 N/A GLU 37.A N GLU 37.A OE1 no hydrogen 2.945 N/A LEU 38.A N GLY 34.A O no hydrogen 2.983 N/A LYS 39.A N HIS 35.A O no hydrogen 2.915 N/A GLU 40.A N LYS 36.A O no hydrogen 2.955 N/A GLY 42.A N LYS 39.A O no hydrogen 3.193 N/A ILE 43.A N LEU 38.A O no hydrogen 3.136 N/A ARG 49.A N ALA 45.A O no hydrogen 3.330 N/A ARG 49.A NE HIS 35.A ND1 no hydrogen 3.013 N/A ARG 49.A NH1 ILE 43.A O no hydrogen 2.887 N/A ARG 49.A NH1 ASN 44.A O no hydrogen 2.992 N/A HIS 50.A N TYR 46.A O no hydrogen 2.900 N/A LYS 51.A N GLY 47.A O no hydrogen 2.932 N/A LEU 52.A N HIS 48.A O no hydrogen 2.940 N/A ILE 53.A N ARG 49.A O no hydrogen 2.938 N/A LYS 54.A N HIS 50.A O no hydrogen 2.928 N/A LYS 54.A NZ GLU 57.A OE1 no hydrogen 3.532 N/A GLY 55.A N LYS 51.A O no hydrogen 2.909 N/A VAL 56.A N LEU 52.A O no hydrogen 2.954 N/A GLU 57.A N ILE 53.A O no hydrogen 2.944 N/A ARG 58.A N LYS 54.A O no hydrogen 2.898 N/A LEU 59.A N VAL 56.A O no hydrogen 3.243 N/A ILE 60.A N VAL 56.A O no hydrogen 2.942 N/A SER 61.A N GLU 57.A O no hydrogen 2.907 N/A GLY 62.A N GLU 57.A O no hydrogen 3.343 N/A LEU 66.A N GLN 63.A O no hydrogen 3.017 N/A ASN 67.A N GLN 64.A O no hydrogen 3.206 N/A THR 75.A OG1 ILE 154.A O no hydrogen 2.563 N/A ILE 76.A N CYS 115.A O no hydrogen 3.154 N/A ILE 78.A N LYS 113.A O no hydrogen 3.064 N/A LEU 80.A N ILE 111.A O no hydrogen 2.930 N/A ASP 84.A N SER 81.A O no hydrogen 2.959 N/A GLN 88.A N ASP 84.A O no hydrogen 3.082 N/A GLN 88.A NE2 PRO 82.A O no hydrogen 3.577 N/A SER 89.A N LYS 85.A O no hydrogen 2.910 N/A SER 89.A OG LYS 85.A O no hydrogen 3.088 N/A VAL 90.A N GLU 86.A O no hydrogen 2.977 N/A GLU 91.A N PHE 87.A O no hydrogen 2.891 N/A GLU 92.A N GLN 88.A O no hydrogen 2.867 N/A GLU 93.A N SER 89.A O no hydrogen 2.985 N/A MET 94.A N VAL 90.A O no hydrogen 2.913 N/A GLN 95.A N GLU 91.A O no hydrogen 2.891 N/A GLN 95.A NE2 TYR 106.A O no hydrogen 3.278 N/A SER 96.A N GLU 92.A O no hydrogen 2.898 N/A SER 96.A OG GLU 92.A O no hydrogen 2.765 N/A THR 97.A N GLU 93.A O no hydrogen 2.952 N/A THR 97.A OG1 GLU 93.A O no hydrogen 2.590 N/A VAL 98.A N GLN 95.A O no hydrogen 3.037 N/A TYR 106.A N GLN 95.A OE1 no hydrogen 2.860 N/A ASN 107.A N GLN 257.A O no hydrogen 2.927 N/A LEU 109.A N THR 255.A O no hydrogen 2.782 N/A LYS 110.A N THR 255.A O no hydrogen 3.478 N/A GLN 112.A N LEU 253.A O no hydrogen 3.108 N/A GLN 112.A NE2 ASP 79.A OD1 no hydrogen 2.393 N/A LYS 113.A N ILE 78.A O no hydrogen 2.892 N/A LYS 113.A NZ GLU 251.A OE2 no hydrogen 2.883 N/A VAL 114.A N GLU 251.A O no hydrogen 2.959 N/A CYS 115.A N ILE 76.A O no hydrogen 3.160 N/A ASN 116.A N TYR 249.A OH no hydrogen 3.126 N/A ASN 116.A ND2 THR 75.A OG1 no hydrogen 2.899 N/A TRP 120.A N ASN 116.A O no hydrogen 3.212 N/A GLU 121.A N LYS 117.A O no hydrogen 2.947 N/A ARG 122.A N LYS 118.A O no hydrogen 2.980 N/A TYR 123.A N LEU 119.A O no hydrogen 2.921 N/A TYR 123.A OH GLU 140.A OE2 no hydrogen 2.190 N/A TYR 123.A OH THR 209.A OG1 no hydrogen 2.772 N/A THR 124.A N TRP 120.A O no hydrogen 2.890 N/A THR 124.A OG1 TRP 120.A O no hydrogen 2.691 N/A THR 124.A OG1 GLU 121.A O no hydrogen 3.006 N/A HIS 125.A N GLU 121.A O no hydrogen 2.939 N/A ARG 126.A N ARG 122.A O no hydrogen 3.026 N/A ARG 126.A NE GLN 247.A OE1 no hydrogen 3.376 N/A ARG 127.A N TYR 123.A O no hydrogen 2.855 N/A ARG 127.A NH1 GLU 140.A OE1 no hydrogen 3.556 N/A ARG 127.A NH1 GLU 140.A OE2 no hydrogen 3.314 N/A LYS 128.A N THR 124.A O no hydrogen 2.906 N/A GLU 129.A N HIS 125.A O no hydrogen 3.015 N/A VAL 130.A N ARG 126.A O no hydrogen 2.922 N/A SER 131.A N ARG 127.A O no hydrogen 2.854 N/A SER 131.A OG ARG 127.A O no hydrogen 2.809 N/A GLU 132.A N LYS 128.A O no hydrogen 2.939 N/A GLU 133.A N GLU 129.A O no hydrogen 2.990 N/A ASN 134.A N VAL 130.A O no hydrogen 2.871 N/A ASN 134.A ND2 HIS 137.A O no hydrogen 3.181 N/A ASN 136.A N SER 131.A O no hydrogen 2.657 N/A HIS 137.A N ASN 134.A O no hydrogen 2.887 N/A ASN 139.A ND2 GLY 211.A O no hydrogen 2.939 N/A ARG 141.A N VAL 208.A O no hydrogen 2.803 N/A LEU 143.A N CYS 206.A O no hydrogen 3.357 N/A PHE 144.A N ALA 176.A O no hydrogen 2.990 N/A HIS 145.A N LEU 204.A O no hydrogen 2.882 N/A HIS 145.A ND1 TYR 174.A O no hydrogen 3.026 N/A ILE 154.A N VAL 150.A O no hydrogen 3.420 N/A HIS 155.A ND1 ASN 151.A O no hydrogen 2.886 N/A LYS 156.A N ALA 152.A O no hydrogen 2.887 N/A GLY 157.A N ILE 153.A O no hydrogen 2.695 N/A ARG 161.A NE ASP 159.A OD1 no hydrogen 3.432 N/A ARG 161.A NE ASP 159.A OD2 no hydrogen 3.130 N/A ARG 161.A NH2 ASP 159.A OD2 no hydrogen 3.428 N/A HIS 162.A N ASP 159.A O no hydrogen 3.303 N/A TYR 164.A N GLY 172.A O no hydrogen 3.182 N/A ALA 171.A N MET 222.A O no hydrogen 3.197 N/A ILE 173.A N ILE 242.A O no hydrogen 2.772 N/A TYR 174.A OH GLY 170.A O no hydrogen 2.465 N/A PHE 175.A N TYR 240.A O no hydrogen 2.749 N/A ALA 176.A N PHE 144.A O no hydrogen 3.096 N/A ASN 178.A ND2 THR 97.A O no hydrogen 2.719 N/A SER 179.A OG TYR 106.A OH no hydrogen 3.004 N/A SER 182.A N SER 179.A O no hydrogen 3.108 N/A ASN 183.A N SER 179.A O no hydrogen 2.943 N/A GLN 184.A N SER 180.A O no hydrogen 2.963 N/A TYR 185.A N SER 182.A O no hydrogen 3.361 N/A VAL 186.A N ASN 183.A O no hydrogen 3.307 N/A CYS 196.A SG HIS 191.A ND1 no hydrogen 3.123 N/A ARG 201.A N TYR 256.A O no hydrogen 3.230 N/A ARG 201.A NE TYR 187.A OH no hydrogen 3.318 N/A ARG 201.A NH2 ARG 194.A O no hydrogen 3.479 N/A GLN 202.A NE2 ASN 151.A OD1 no hydrogen 3.363 N/A LEU 203.A N ILE 254.A O no hydrogen 2.700 N/A LEU 204.A N HIS 145.A O no hydrogen 3.152 N/A PHE 205.A N TYR 252.A O no hydrogen 3.323 N/A CYS 206.A N LEU 143.A O no hydrogen 2.738 N/A ARG 207.A N TYR 249.A O no hydrogen 2.944 N/A ARG 207.A NE GLU 251.A OE1 no hydrogen 3.120 N/A VAL 208.A N ARG 141.A O no hydrogen 2.725 N/A THR 209.A N GLN 247.A O no hydrogen 3.003 N/A THR 209.A OG1 TYR 123.A OH no hydrogen 2.772 N/A LEU 210.A N ASN 139.A O no hydrogen 2.978 N/A GLY 211.A N ALA 138.A O no hydrogen 2.844 N/A LYS 212.A N HIS 230.A ND1 no hydrogen 3.059 N/A SER 213.A OG SER 231.A OG no hydrogen 2.690 N/A PHE 214.A N SER 231.A O no hydrogen 2.936 N/A GLN 216.A N THR 233.A O no hydrogen 3.316 N/A SER 218.A OG ALA 219.A O no hydrogen 3.509 N/A HIS 229.A N PRO 226.A O no hydrogen 2.904 N/A HIS 229.A ND1 PRO 227.A O no hydrogen 3.242 N/A HIS 230.A N LYS 212.A O no hydrogen 2.757 N/A HIS 230.A NE2 GLU 133.A OE2 no hydrogen 2.315 N/A SER 231.A OG LEU 210.A O no hydrogen 3.155 N/A VAL 232.A N VAL 241.A O no hydrogen 3.036 N/A THR 233.A N PHE 214.A O no hydrogen 3.108 N/A GLY 234.A N GLU 239.A O no hydrogen 2.849 N/A ARG 235.A N GLN 216.A O no hydrogen 3.416 N/A GLU 239.A N GLY 234.A O no hydrogen 2.920 N/A TYR 240.A N PHE 175.A O no hydrogen 2.799 N/A VAL 241.A N VAL 232.A O no hydrogen 2.906 N/A ILE 242.A N ILE 173.A O no hydrogen 3.151 N/A TYR 243.A OH PHE 169.A O no hydrogen 2.703 N/A GLY 245.A N GLU 160.A OE1 no hydrogen 2.935 N/A GLU 246.A N GLU 246.A OE1 no hydrogen 3.082 N/A GLN 247.A N ARG 244.A O no hydrogen 3.249 N/A GLN 247.A NE2 THR 209.A O no hydrogen 2.571 N/A GLN 247.A NE2 HIS 230.A O no hydrogen 3.240 N/A TYR 249.A N ARG 207.A O no hydrogen 3.191 N/A TYR 249.A OH VAL 114.A O no hydrogen 2.967 N/A TYR 252.A N PHE 205.A O no hydrogen 3.411 N/A TYR 252.A OH GLU 86.A OE2 no hydrogen 2.181 N/A LEU 253.A N GLN 112.A O no hydrogen 2.828 N/A ILE 254.A N LEU 203.A O no hydrogen 2.730 N/A THR 255.A N LYS 110.A O no hydrogen 3.103 N/A TYR 256.A N ARG 201.A O no hydrogen 3.079 N/A GLN 257.A N ASN 107.A O no hydrogen 2.963 N/A