Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6aah_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 4.A N ASP 2.A OD1 no hydrogen 2.874 N/A THR 4.A OG1 ASP 2.A OD1 no hydrogen 2.586 N/A THR 4.A OG1 ASP 2.A OD2 no hydrogen 3.170 N/A HIS 5.A N ASP 2.A O no hydrogen 3.017 N/A PHE 6.A N ILE 74.A O no hydrogen 2.839 N/A GLU 7.A N TYR 30.A OH no hydrogen 3.053 N/A ARG 9.A NE GLU 7.A OE1 no hydrogen 3.004 N/A ARG 9.A NH2 GLU 7.A OE1 no hydrogen 2.551 N/A PHE 10.A N GLU 7.A O no hydrogen 3.123 N/A LEU 11.A N LYS 8.A O no hydrogen 3.065 N/A LYS 12.A N ARG 29.A O no hydrogen 2.858 N/A LYS 12.A NZ ARG 9.A O no hydrogen 2.519 N/A ARG 13.A NE ASP 16.A OD1 no hydrogen 3.312 N/A ARG 13.A NE GLU 26.A OE2 no hydrogen 3.261 N/A ARG 13.A NH2 ASP 16.A OD1 no hydrogen 3.192 N/A ILE 14.A N LEU 27.A O no hydrogen 2.762 N/A ARG 15.A N LEU 27.A O no hydrogen 3.367 N/A LEU 17.A N VAL 25.A O no hydrogen 2.870 N/A GLY 18.A N VAL 25.A O no hydrogen 3.333 N/A GLY 20.A N GLY 23.A O no hydrogen 3.176 N/A GLY 23.A N GLY 20.A O no hydrogen 3.089 N/A LYS 24.A N SER 45.A O no hydrogen 2.577 N/A VAL 25.A N GLY 18.A O no hydrogen 2.813 N/A GLU 26.A N VAL 43.A O no hydrogen 2.808 N/A LEU 27.A N ARG 15.A O no hydrogen 2.892 N/A CYS 28.A N VAL 41.A O no hydrogen 2.850 N/A ARG 29.A N LYS 12.A O no hydrogen 2.888 N/A ARG 29.A NH1 GLY 38.A O no hydrogen 2.816 N/A TYR 30.A N GLU 39.A O no hydrogen 2.909 N/A ASP 31.A N PHE 10.A O no hydrogen 2.744 N/A GLY 34.A N ASP 31.A O no hydrogen 3.038 N/A ASN 36.A N ASP 31.A OD2 no hydrogen 2.890 N/A THR 37.A N ASP 35.A OD1 no hydrogen 3.229 N/A THR 37.A OG1 ASP 35.A OD1 no hydrogen 2.652 N/A GLY 38.A N ASP 31.A OD1 no hydrogen 2.867 N/A VAL 41.A N CYS 28.A O no hydrogen 2.694 N/A ALA 42.A N MET 87.A O no hydrogen 2.985 N/A VAL 43.A N GLU 26.A O no hydrogen 2.699 N/A LYS 44.A N LEU 85.A O no hydrogen 2.748 N/A LYS 44.A NZ GLU 56.A OE1 no hydrogen 3.214 N/A LYS 44.A NZ GLU 56.A OE2 no hydrogen 2.785 N/A LYS 44.A NZ ASP 152.A OD1 no hydrogen 2.734 N/A LYS 44.A NZ ASP 152.A OD2 no hydrogen 3.548 N/A SER 45.A N LYS 24.A O no hydrogen 2.767 N/A LEU 53.A N HIS 49.A O no hydrogen 3.066 N/A LYS 54.A N ILE 50.A O no hydrogen 2.763 N/A LYS 55.A N ALA 51.A O no hydrogen 2.988 N/A GLU 56.A N ASP 52.A O no hydrogen 2.981 N/A ILE 57.A N LEU 53.A O no hydrogen 2.954 N/A GLU 58.A N LYS 54.A O no hydrogen 3.133 N/A ILE 59.A N LYS 55.A O no hydrogen 3.043 N/A LEU 60.A N GLU 56.A O no hydrogen 2.941 N/A ARG 61.A N ILE 57.A O no hydrogen 2.905 N/A ARG 61.A NE GLU 58.A OE2 no hydrogen 2.734 N/A ARG 61.A NH2 GLU 58.A OE1 no hydrogen 3.357 N/A ARG 61.A NH2 GLU 58.A OE2 no hydrogen 3.406 N/A ASN 62.A N ILE 59.A O no hydrogen 3.126 N/A ASN 62.A ND2 GLU 58.A O no hydrogen 2.901 N/A ASN 62.A ND2 GLU 58.A OE1 no hydrogen 3.304 N/A LEU 63.A N LEU 60.A O no hydrogen 3.172 N/A TYR 64.A N TYR 124.A OH no hydrogen 2.922 N/A ASN 67.A N HIS 65.A ND1 no hydrogen 3.141 N/A ASN 67.A ND2 VAL 148.A O no hydrogen 2.912 N/A ILE 68.A N.A HIS 65.A O no hydrogen 3.120 N/A ILE 68.A N.B HIS 65.A O no hydrogen 3.112 N/A VAL 69.A N ILE 150.A O no hydrogen 2.937 N/A LYS 70.A N GLU 88.A OE2 no hydrogen 2.832 N/A LYS 72.A N ILE 86.A O no hydrogen 2.778 N/A LYS 72.A NZ GLU 39.A OE1 no hydrogen 3.294 N/A GLY 73.A N ILE 86.A O no hydrogen 3.013 N/A ILE 74.A N THR 4.A O no hydrogen 2.731 N/A CYS 75.A N LYS 84.A O no hydrogen 3.124 N/A CYS 75.A SG PHE 6.A O no hydrogen 3.202 N/A GLU 77.A N GLY 82.A O no hydrogen 3.357 N/A LYS 84.A N CYS 75.A O no hydrogen 2.910 N/A LEU 85.A N LYS 44.A O no hydrogen 2.895 N/A ILE 86.A N GLY 73.A O no hydrogen 2.835 N/A MET 87.A N ALA 42.A O no hydrogen 2.833 N/A GLU 88.A N LYS 70.A O no hydrogen 2.981 N/A GLY 93.A N LEU 90.A O no hydrogen 3.040 N/A LEU 95.A N VAL 140.A O no hydrogen 2.876 N/A GLU 97.A N SER 94.A O no hydrogen 2.948 N/A GLU 97.A N SER 94.A OG no hydrogen 3.312 N/A TYR 98.A N SER 94.A O no hydrogen 2.806 N/A LEU 99.A N LEU 95.A O no hydrogen 2.854 N/A LYS 101.A N TYR 98.A O no hydrogen 3.083 N/A ASN 102.A N LEU 99.A O no hydrogen 3.094 N/A ASN 102.A ND2 TYR 98.A O no hydrogen 2.951 N/A LYS 105.A N ASN 102.A O no hydrogen 2.927 N/A ILE 106.A N LYS 103.A O no hydrogen 3.237 N/A LYS 109.A NZ LEU 282.A O no hydrogen 3.453 N/A GLN 110.A N ASN 107.A OD1 no hydrogen 3.234 N/A GLN 110.A NE2 GLN 110.A O no hydrogen 3.213 N/A GLN 111.A N ASN 107.A O no hydrogen 2.997 N/A GLN 111.A NE2 LEU 203.A O no hydrogen 2.977 N/A LEU 112.A N LEU 108.A O no hydrogen 2.909 N/A LYS 113.A N LYS 109.A O no hydrogen 2.994 N/A TYR 114.A N GLN 110.A O no hydrogen 2.916 N/A TYR 114.A OH SER 144.A O no hydrogen 3.286 N/A TYR 114.A OH GLU 145.A O no hydrogen 2.917 N/A ALA 115.A N GLN 111.A O no hydrogen 2.884 N/A VAL 116.A N LEU 112.A O no hydrogen 2.958 N/A GLN 117.A N LYS 113.A O no hydrogen 3.087 N/A GLN 117.A NE2 HIS 146.A O no hydrogen 2.905 N/A ILE 118.A N TYR 114.A O no hydrogen 2.900 N/A CYS 119.A N ALA 115.A O no hydrogen 2.936 N/A CYS 119.A SG ALA 115.A O no hydrogen 3.336 N/A LYS 120.A N VAL 116.A O no hydrogen 2.810 N/A GLY 121.A N GLN 117.A O no hydrogen 2.979 N/A MET 122.A N ILE 118.A O no hydrogen 2.854 N/A ASP 123.A N CYS 119.A O no hydrogen 2.810 N/A TYR 124.A N LYS 120.A O no hydrogen 3.085 N/A LEU 125.A N GLY 121.A O no hydrogen 3.130 N/A GLY 126.A N MET 122.A O no hydrogen 2.913 N/A SER 127.A N.A ASP 123.A O no hydrogen 2.986 N/A SER 127.A N.B ASP 123.A O no hydrogen 2.988 N/A SER 127.A OG.A ASP 123.A O no hydrogen 3.557 N/A SER 127.A OG.A TYR 124.A O no hydrogen 2.559 N/A SER 127.A OG.B ASP 123.A O no hydrogen 2.847 N/A ARG 128.A N TYR 124.A O no hydrogen 3.249 N/A ARG 128.A N LEU 125.A O no hydrogen 2.951 N/A GLN 129.A N GLY 126.A O no hydrogen 2.880 N/A TYR 130.A N LEU 125.A O no hydrogen 3.338 N/A VAL 131.A N LYS 157.A O no hydrogen 2.804 N/A HIS 132.A N ASP 192.A OD2 no hydrogen 2.787 N/A HIS 132.A NE2 ASP 152.A O no hydrogen 2.741 N/A ARG 133.A N ASP 192.A OD1 no hydrogen 3.045 N/A ARG 133.A NH1 LEU 155.A O no hydrogen 2.864 N/A ASP 134.A N HIS 132.A ND1 no hydrogen 3.325 N/A ALA 137.A N GLU 202.A OE1 no hydrogen 2.941 N/A ARG 138.A NH1.B ASP 134.A OD1 no hydrogen 3.136 N/A ARG 138.A NH1.B ASP 134.A OD2 no hydrogen 3.339 N/A ARG 138.A NH2.B ASP 134.A OD1 no hydrogen 3.103 N/A ASN 139.A N ALA 136.A O no hydrogen 2.928 N/A ASN 139.A ND2 ASP 134.A O no hydrogen 2.848 N/A ASN 139.A ND2 ASP 134.A OD2 no hydrogen 2.948 N/A VAL 140.A N ALA 137.A O no hydrogen 3.163 N/A LEU 141.A N LYS 149.A O no hydrogen 2.702 N/A VAL 142.A N GLY 93.A O no hydrogen 2.684 N/A GLU 143.A N GLN 147.A O no hydrogen 2.811 N/A SER 144.A N GLN 147.A O no hydrogen 3.089 N/A HIS 146.A N SER 144.A OG no hydrogen 3.192 N/A GLN 147.A N SER 144.A O no hydrogen 3.232 N/A GLN 147.A NE2 GLU 66.A O no hydrogen 2.753 N/A VAL 148.A N GLN 117.A OE1 no hydrogen 2.741 N/A LYS 149.A N LEU 141.A O no hydrogen 2.831 N/A LYS 149.A NZ GLU 88.A OE2 no hydrogen 2.802 N/A ILE 150.A N ASN 67.A O no hydrogen 2.813 N/A GLY 151.A N ASN 139.A O no hydrogen 2.682 N/A GLY 154.A N ASP 152.A OD2 no hydrogen 3.057 N/A THR 156.A N PHE 153.A O no hydrogen 3.171 N/A THR 156.A OG1 HIS 132.A O no hydrogen 3.542 N/A LYS 157.A N VAL 131.A O no hydrogen 2.973 N/A ILE 159.A N GLN 129.A O no hydrogen 2.903 N/A LYS 163.A N GLU 160.A O no hydrogen 3.164 N/A VAL 166.A N.A SER 185.A O no hydrogen 2.966 N/A VAL 166.A N.B SER 185.A O no hydrogen 2.977 N/A SER 172.A N ASP 169.A O no hydrogen 3.257 N/A SER 172.A OG ASP 169.A O no hydrogen 2.463 N/A TRP 176.A N PRO 173.A O no hydrogen 3.017 N/A TRP 176.A NE1 GLU 202.A OE1 no hydrogen 2.884 N/A TYR 177.A N VAL 174.A O no hydrogen 3.144 N/A TYR 177.A OH ARG 133.A O no hydrogen 2.803 N/A GLU 180.A N GLU 180.A OE1 no hydrogen 2.777 N/A CYS 181.A N ALA 178.A O no hydrogen 2.978 N/A CYS 181.A SG LYS 186.A O no hydrogen 3.482 N/A CYS 181.A SG SER 191.A OG no hydrogen 3.518 N/A LEU 182.A N ALA 178.A O no hydrogen 3.188 N/A MET 183.A N PRO 179.A O no hydrogen 2.735 N/A GLN 184.A N GLU 180.A O no hydrogen 2.934 N/A SER 185.A N CYS 181.A O no hydrogen 3.057 N/A LYS 186.A N GLU 180.A O no hydrogen 3.393 N/A TYR 188.A N SER 191.A OG no hydrogen 2.905 N/A SER 191.A N TYR 188.A O no hydrogen 3.040 N/A SER 191.A OG GLU 180.A OE2 no hydrogen 2.590 N/A VAL 193.A N ILE 189.A O no hydrogen 3.308 N/A TRP 194.A N ALA 190.A O no hydrogen 3.144 N/A SER 195.A N SER 191.A O no hydrogen 3.155 N/A SER 195.A OG TRP 176.A O no hydrogen 2.788 N/A SER 195.A OG SER 191.A O no hydrogen 3.285 N/A PHE 196.A N ASP 192.A O no hydrogen 2.841 N/A GLY 197.A N VAL 193.A O no hydrogen 3.040 N/A VAL 198.A N TRP 194.A O no hydrogen 3.322 N/A THR 199.A N SER 195.A O no hydrogen 2.897 N/A THR 199.A OG1 SER 195.A O no hydrogen 2.926 N/A LEU 200.A N PHE 196.A O no hydrogen 2.696 N/A HIS 201.A N GLY 197.A O no hydrogen 3.092 N/A HIS 201.A NE2 PRO 244.A O no hydrogen 2.747 N/A GLU 202.A N VAL 198.A O no hydrogen 3.066 N/A LEU 203.A N THR 199.A O no hydrogen 2.973 N/A LEU 204.A N LEU 200.A O no hydrogen 2.858 N/A THR 205.A N HIS 201.A O no hydrogen 3.026 N/A THR 205.A OG1 HIS 201.A O no hydrogen 3.365 N/A THR 205.A OG1 GLU 202.A O no hydrogen 3.078 N/A TYR 206.A N LEU 203.A O no hydrogen 3.103 N/A TYR 206.A OH ILE 106.A O no hydrogen 2.653 N/A CYS 207.A N GLU 202.A O no hydrogen 2.775 N/A CYS 207.A SG GLU 202.A O no hydrogen 3.982 N/A ASP 208.A N THR 205.A O no hydrogen 3.213 N/A SER 211.A N ASP 208.A O no hydrogen 3.209 N/A SER 212.A N SER 209.A O no hydrogen 3.094 N/A SER 212.A OG SER 209.A O no hydrogen 3.106 N/A ALA 215.A N SER 212.A OG no hydrogen 3.292 N/A LEU 216.A N SER 212.A O no hydrogen 2.809 N/A PHE 217.A N PRO 213.A O no hydrogen 3.019 N/A LEU 218.A N MET 214.A O no hydrogen 2.919 N/A LYS 219.A N ALA 215.A O no hydrogen 3.038 N/A MET 220.A N LEU 216.A O no hydrogen 3.205 N/A ILE 221.A N PHE 217.A O no hydrogen 2.893 N/A GLY 222.A N LEU 218.A O no hydrogen 2.855 N/A HIS 225.A NE2 ILE 221.A O no hydrogen 2.969 N/A MET 228.A N HIS 225.A O no hydrogen 3.016 N/A THR 229.A N GLY 226.A O no hydrogen 3.265 N/A THR 229.A OG1 GLY 226.A O no hydrogen 2.633 N/A ARG 232.A N MET 228.A O no hydrogen 3.053 N/A LEU 233.A N THR 229.A O no hydrogen 2.782 N/A VAL 234.A N VAL 230.A O no hydrogen 2.883 N/A ASN 235.A N THR 231.A O no hydrogen 2.891 N/A THR 236.A N ARG 232.A O no hydrogen 2.968 N/A THR 236.A OG1 ARG 232.A O no hydrogen 2.757 N/A LEU 237.A N LEU 233.A O no hydrogen 2.954 N/A LYS 238.A N VAL 234.A O no hydrogen 2.863 N/A GLU 239.A N ASN 235.A O no hydrogen 3.178 N/A GLY 240.A N LEU 237.A O no hydrogen 2.919 N/A LYS 241.A N THR 236.A O no hydrogen 3.359 N/A ARG 242.A NE TRP 261.A O no hydrogen 2.925 N/A ARG 242.A NH1 LEU 237.A O no hydrogen 2.919 N/A ARG 242.A NH1 LYS 241.A O no hydrogen 2.935 N/A ARG 242.A NH2 TRP 261.A O no hydrogen 2.968 N/A CYS 245.A SG PRO 246.A O no hydrogen 3.537 N/A CYS 245.A SG CYS 249.A O no hydrogen 3.354 N/A CYS 249.A N PRO 246.A O no hydrogen 3.286 N/A CYS 249.A SG PRO 250.A O no hydrogen 3.518 N/A GLU 252.A N GLU 252.A OE2 no hydrogen 2.947 N/A TYR 254.A N PRO 250.A O no hydrogen 3.098 N/A TYR 254.A OH LEU 243.A O no hydrogen 2.729 N/A GLN 255.A N ASP 251.A O no hydrogen 2.693 N/A GLN 255.A NE2 ASP 251.A OD1 no hydrogen 2.911 N/A LEU 256.A N GLU 252.A O no hydrogen 3.429 N/A MET 257.A N VAL 253.A O no hydrogen 3.052 N/A ARG 258.A N TYR 254.A O no hydrogen 2.821 N/A ARG 258.A NH1 TYR 254.A OH no hydrogen 3.195 N/A LYS 259.A N GLN 255.A O no hydrogen 3.227 N/A LYS 259.A N LEU 256.A O no hydrogen 3.252 N/A CYS 260.A N MET 257.A O no hydrogen 3.113 N/A CYS 260.A SG LEU 256.A O no hydrogen 3.649 N/A TRP 261.A N ARG 258.A O no hydrogen 3.009 N/A ASN 267.A N GLN 264.A O no hydrogen 3.172 N/A ARG 268.A N PRO 265.A O no hydrogen 3.400 N/A ARG 268.A NE GLU 262.A O no hydrogen 2.742 N/A ARG 268.A NH1 GLU 180.A OE1 no hydrogen 3.545 N/A ARG 268.A NH1 GLU 180.A OE2 no hydrogen 2.707 N/A ARG 268.A NH1 ALA 190.A O no hydrogen 3.055 N/A ARG 268.A NH2 GLU 180.A OE1 no hydrogen 2.750 N/A ARG 268.A NH2 GLU 180.A OE2 no hydrogen 3.509 N/A ARG 268.A NH2 GLU 262.A O no hydrogen 3.349 N/A ARG 268.A NH2 PHE 263.A O no hydrogen 2.878 N/A THR 269.A N LYS 259.A O no hydrogen 3.432 N/A THR 269.A OG1 SER 270.A O no hydrogen 3.299 N/A GLN 272.A NE2 ASP 123.A OD2 no hydrogen 2.917 N/A ASN 273.A N SER 270.A OG no hydrogen 3.005 N/A ASN 273.A ND2 THR 269.A OG1 no hydrogen 2.686 N/A LEU 274.A N SER 270.A O no hydrogen 3.018 N/A ILE 275.A N PHE 271.A O no hydrogen 2.984 N/A GLU 276.A N GLN 272.A O no hydrogen 3.112 N/A GLY 277.A N ASN 273.A O no hydrogen 3.036 N/A PHE 278.A N LEU 274.A O no hydrogen 2.846 N/A GLU 279.A N ILE 275.A O no hydrogen 2.906 N/A ALA 280.A N GLU 276.A O no hydrogen 3.020 N/A LEU 281.A N GLY 277.A O no hydrogen 3.443 N/A LEU 282.A N PHE 278.A O no hydrogen 3.063 N/A LYS 283.A N GLU 279.A O no hydrogen 3.104 N/A