Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6xg3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 4.A N VAL 20.A O no hydrogen 3.007 N/A LYS 5.A N GLU 50.A OE2 no hydrogen 3.421 N/A VAL 6.A N GLN 18.A O no hydrogen 3.004 N/A PHE 7.A N LYS 52.A O no hydrogen 3.003 N/A THR 8.A N HIS 16.A O no hydrogen 2.950 N/A THR 8.A OG1 HIS 16.A O no hydrogen 3.455 N/A THR 9.A OG1 ASN 14.A O no hydrogen 2.756 N/A ASN 12.A N THR 9.A OG1 no hydrogen 2.893 N/A ILE 13.A N ASP 11.A OD1 no hydrogen 2.831 N/A ASN 14.A N ASP 11.A OD1 no hydrogen 2.896 N/A ASN 14.A ND2 ASP 11.A OD2 no hydrogen 2.654 N/A HIS 16.A N THR 8.A O no hydrogen 2.967 N/A HIS 16.A NE2 GLU 66.A OE1 no hydrogen 2.545 N/A GLN 18.A N VAL 6.A O no hydrogen 2.922 N/A GLN 18.A NE2 THR 8.A OG1 no hydrogen 3.346 N/A VAL 20.A N ILE 4.A O no hydrogen 2.840 N/A ASP 21.A N GLN 29.A OE1 no hydrogen 2.809 N/A MET 22.A N ARG 2.A O no hydrogen 2.956 N/A SER 23.A N ASP 21.A OD1 no hydrogen 2.939 N/A SER 23.A OG ASP 21.A OD1 no hydrogen 2.658 N/A THR 25.A N GLN 28.A OE1 no hydrogen 3.497 N/A THR 25.A OG1 GLN 28.A OE1 no hydrogen 3.245 N/A TYR 26.A N ILE 43.A O no hydrogen 3.128 N/A TYR 26.A OH HIS 49.A ND1 no hydrogen 2.744 N/A GLY 27.A N THR 41.A O no hydrogen 2.736 N/A GLN 28.A N THR 25.A OG1 no hydrogen 3.164 N/A GLN 29.A N TYR 26.A O no hydrogen 2.952 N/A GLN 29.A NE2 ASP 21.A O no hydrogen 2.816 N/A GLN 29.A NE2 MET 24.A O no hydrogen 3.169 N/A GLN 29.A NE2 THR 25.A O no hydrogen 3.242 N/A PHE 30.A N TYR 26.A O no hydrogen 2.777 N/A GLY 31.A N GLY 27.A O no hydrogen 2.970 N/A THR 33.A N THR 41.A OG1 no hydrogen 3.275 N/A THR 33.A OG1 GLY 31.A O no hydrogen 2.732 N/A TYR 34.A N TYR 55.A O no hydrogen 2.889 N/A LEU 35.A N ALA 38.A O no hydrogen 2.803 N/A ALA 38.A N LEU 35.A O no hydrogen 2.944 N/A VAL 40.A N THR 33.A O no hydrogen 2.845 N/A THR 41.A N ASP 39.A OD1 no hydrogen 2.908 N/A THR 41.A OG1 ASP 39.A OD1 no hydrogen 2.411 N/A ILE 43.A N VAL 40.A O no hydrogen 3.198 N/A LYS 44.A NZ SER 23.A O no hydrogen 3.229 N/A HIS 46.A N HIS 49.A ND1 no hydrogen 3.300 N/A HIS 49.A N HIS 46.A O no hydrogen 3.132 N/A GLU 50.A N ASN 47.A O no hydrogen 2.907 N/A GLY 51.A N LYS 5.A O no hydrogen 2.878 N/A LYS 52.A N HIS 49.A O no hydrogen 2.974 N/A PHE 54.A N PHE 7.A O no hydrogen 2.780 N/A TYR 55.A N TYR 34.A O no hydrogen 2.945 N/A VAL 56.A N THR 9.A O no hydrogen 3.092 N/A LEU 63.A N ASP 60.A OD1 no hydrogen 3.069 N/A ARG 64.A N ASP 60.A O no hydrogen 3.072 N/A VAL 65.A N ASP 61.A O no hydrogen 3.204 N/A GLU 66.A N THR 62.A O no hydrogen 2.889 N/A ALA 67.A N LEU 63.A O no hydrogen 2.932 N/A PHE 68.A N ARG 64.A O no hydrogen 2.916 N/A GLU 69.A N VAL 65.A O no hydrogen 2.906 N/A TYR 70.A N GLU 66.A O no hydrogen 3.132 N/A TYR 70.A OH ASP 133.A OD2 no hydrogen 2.604 N/A TYR 71.A N ALA 67.A O no hydrogen 3.035 N/A TYR 71.A OH VAL 10.A O no hydrogen 2.533 N/A HIS 72.A N PHE 68.A O no hydrogen 2.749 N/A ASP 75.A N THR 73.A OG1 no hydrogen 3.131 N/A SER 77.A OG ASP 75.A OD2 no hydrogen 3.492 N/A PHE 78.A N ASP 75.A O no hydrogen 3.213 N/A ARG 81.A N SER 77.A O no hydrogen 3.072 N/A ARG 81.A NE SER 77.A OG no hydrogen 3.103 N/A ARG 81.A NH1 ALA 152.A O no hydrogen 2.633 N/A ARG 81.A NH2 ASP 75.A OD2 no hydrogen 2.753 N/A ARG 81.A NH2 ALA 152.A O no hydrogen 3.507 N/A TYR 82.A N PHE 78.A O no hydrogen 2.857 N/A MET 83.A N LEU 79.A O no hydrogen 2.940 N/A SER 84.A N GLY 80.A O no hydrogen 2.962 N/A SER 84.A OG.A GLY 80.A O no hydrogen 3.095 N/A ALA 85.A N ARG 81.A O no hydrogen 3.031 N/A LEU 86.A N TYR 82.A O no hydrogen 2.793 N/A ASN 87.A N MET 83.A O no hydrogen 3.067 N/A HIS 88.A N ALA 85.A O no hydrogen 2.905 N/A THR 89.A N ALA 85.A O no hydrogen 2.915 N/A THR 89.A OG1 ALA 85.A O no hydrogen 3.535 N/A THR 89.A OG1 LEU 86.A O no hydrogen 3.488 N/A THR 89.A OG1 ALA 144.A O no hydrogen 2.743 N/A LYS 90.A N LEU 86.A O no hydrogen 2.972 N/A LYS 90.A NZ ASP 36.A O no hydrogen 2.634 N/A LYS 90.A NZ ASN 87.A OD1 no hydrogen 3.252 N/A LYS 91.A N HIS 88.A O no hydrogen 2.925 N/A LYS 91.A NZ ASN 87.A O no hydrogen 3.511 N/A TRP 92.A N THR 89.A O no hydrogen 3.353 N/A TRP 92.A NE1 ASP 107.A OD2 no hydrogen 2.805 N/A TYR 94.A OH THR 89.A O no hydrogen 2.632 N/A GLN 96.A NE2 THR 101.A OG1 no hydrogen 2.903 N/A VAL 97.A N LEU 100.A O no hydrogen 2.828 N/A LEU 100.A N VAL 97.A O no hydrogen 3.162 N/A THR 101.A N GLN 120.A OE1 no hydrogen 2.782 N/A THR 101.A OG1 ALA 138.A O no hydrogen 3.102 N/A THR 101.A OG1 ARG 139.A O no hydrogen 3.347 N/A SER 102.A N PRO 95.A O no hydrogen 2.977 N/A SER 102.A OG GLY 286.A O no hydrogen 2.689 N/A ILE 103.A N SER 102.A OG no hydrogen 2.758 N/A LYS 104.A N LYS 93.A O no hydrogen 2.989 N/A ALA 106.A N ASN 109.A OD1 no hydrogen 3.241 N/A ASN 109.A N ALA 106.A O no hydrogen 3.070 N/A ASN 109.A ND2 LYS 104.A O no hydrogen 3.363 N/A LEU 112.A N ASN 109.A O no hydrogen 2.952 N/A ALA 113.A N ASN 109.A O no hydrogen 2.994 N/A THR 114.A N SER 110.A O no hydrogen 3.180 N/A THR 114.A OG1.A SER 261.A OG no hydrogen 3.142 N/A THR 114.A OG1.A HIS 274.A ND1 no hydrogen 2.986 N/A THR 114.A OG1.B SER 110.A O no hydrogen 3.236 N/A ALA 115.A N TYR 111.A O no hydrogen 3.121 N/A LEU 116.A N LEU 112.A O no hydrogen 2.794 N/A LEU 117.A N ALA 113.A O no hydrogen 2.935 N/A THR 118.A N THR 114.A O no hydrogen 2.922 N/A THR 118.A OG1 THR 114.A O no hydrogen 2.697 N/A LEU 119.A N ALA 115.A O no hydrogen 2.919 N/A GLN 120.A N LEU 117.A O no hydrogen 3.297 N/A GLN 120.A NE2 THR 101.A O no hydrogen 2.804 N/A GLN 120.A NE2 LEU 116.A O no hydrogen 2.725 N/A GLN 121.A N THR 118.A O no hydrogen 2.846 N/A GLN 121.A NE2 THR 276.A OG1 no hydrogen 2.784 N/A PHE 126.A N GLN 132.A OE1.B no hydrogen 2.862 N/A ASN 127.A N HIS 174.A O no hydrogen 2.843 N/A ALA 130.A N TYR 70.A O no hydrogen 2.932 N/A LEU 131.A N PRO 128.A O no hydrogen 2.981 N/A GLN 132.A N PRO 128.A O no hydrogen 3.206 N/A GLN 132.A NE2.A PHE 126.A O no hydrogen 3.004 N/A GLN 132.A NE2.B GLN 132.A O no hydrogen 3.248 N/A ASP 133.A N PRO 129.A O no hydrogen 2.899 N/A ALA 134.A N ALA 130.A O no hydrogen 3.021 N/A TYR 135.A N LEU 131.A O no hydrogen 2.855 N/A TYR 136.A N GLN 132.A O no hydrogen 3.188 N/A ARG 137.A N ASP 133.A O no hydrogen 3.346 N/A ARG 137.A NH1 ASN 145.A OD1 no hydrogen 3.097 N/A ARG 137.A NH2 GLU 142.A OE1 no hydrogen 2.954 N/A ALA 138.A N ALA 134.A O no hydrogen 2.930 N/A ARG 139.A N TYR 135.A O no hydrogen 2.891 N/A GLY 141.A N ALA 138.A O no hydrogen 2.921 N/A GLU 142.A N ARG 137.A O no hydrogen 2.841 N/A ASN 145.A ND2 TYR 82.A OH no hydrogen 2.536 N/A CYS 147.A N ALA 143.A O no hydrogen 2.869 N/A CYS 147.A SG ALA 143.A O no hydrogen 3.397 N/A ALA 148.A N ALA 144.A O no hydrogen 3.127 N/A LEU 149.A N ASN 145.A O no hydrogen 2.885 N/A ILE 150.A N PHE 146.A O no hydrogen 2.946 N/A LEU 151.A N CYS 147.A O no hydrogen 3.060 N/A ALA 152.A N ALA 148.A O no hydrogen 2.924 N/A TYR 153.A N LEU 149.A O no hydrogen 2.674 N/A TYR 153.A OH TYR 71.A O no hydrogen 2.629 N/A CYS 154.A N ILE 150.A O no hydrogen 2.897 N/A CYS 154.A SG ILE 150.A O no hydrogen 3.261 N/A ASN 155.A N ALA 152.A O no hydrogen 3.222 N/A LYS 156.A N LEU 151.A O no hydrogen 2.959 N/A THR 157.A N GLU 160.A OE1 no hydrogen 3.074 N/A THR 157.A OG1 GLU 160.A OE1 no hydrogen 2.955 N/A GLU 160.A N THR 157.A O no hydrogen 3.194 N/A VAL 164.A N TYR 272.A OH no hydrogen 3.223 N/A ARG 165.A NH2 GLU 166.A OE1 no hydrogen 2.861 N/A GLU 166.A N ASP 163.A OD2 no hydrogen 2.758 N/A THR 167.A N ASP 163.A O no hydrogen 3.053 N/A THR 167.A OG1 ASP 163.A O no hydrogen 2.658 N/A MET 168.A N VAL 164.A O no hydrogen 2.896 N/A SER 169.A N ARG 165.A O no hydrogen 2.976 N/A TYR 170.A N GLU 166.A O no hydrogen 3.168 N/A LEU 171.A N THR 167.A O no hydrogen 3.163 N/A PHE 172.A N MET 168.A O no hydrogen 2.838 N/A GLN 173.A N SER 169.A O no hydrogen 3.172 N/A GLN 173.A NE2 SER 169.A O no hydrogen 3.490 N/A HIS 174.A N LEU 171.A O no hydrogen 3.196 N/A ALA 175.A N PHE 172.A O no hydrogen 3.002 N/A ASN 176.A N LYS 125.A O no hydrogen 2.982 N/A ASP 178.A N ASN 176.A OD1 no hydrogen 3.428 N/A CYS 180.A N LEU 177.A O no hydrogen 3.191 N/A LYS 181.A N GLU 237.A O no hydrogen 2.911 N/A ARG 182.A N LEU 198.A O no hydrogen 2.784 N/A ARG 182.A NE GLN 236.A OE1 no hydrogen 2.781 N/A ARG 182.A NH1 MET 205.A O no hydrogen 3.016 N/A ARG 182.A NH2 GLN 236.A OE1 no hydrogen 3.047 N/A VAL 183.A N GLN 235.A O no hydrogen 2.945 N/A LEU 184.A N THR 196.A O no hydrogen 2.804 N/A ASN 185.A N TYR 232.A O no hydrogen 3.015 N/A ASN 185.A ND2 GLN 193.A OE1 no hydrogen 3.253 N/A VAL 186.A N GLN 194.A O no hydrogen 3.010 N/A VAL 187.A N THR 230.A O no hydrogen 2.803 N/A CYS 188.A N GLY 192.A O no hydrogen 3.218 N/A GLY 192.A N CYS 188.A O no hydrogen 2.979 N/A GLN 194.A N VAL 186.A O no hydrogen 3.189 N/A GLN 194.A NE2 GLN 195.A O no hydrogen 3.257 N/A THR 196.A N LEU 184.A O no hydrogen 2.985 N/A LEU 198.A N ARG 182.A O no hydrogen 2.720 N/A GLY 200.A N CYS 180.A O no hydrogen 3.280 N/A ALA 203.A N GLY 200.A O no hydrogen 2.978 N/A VAL 204.A N VAL 201.A O no hydrogen 3.080 N/A TYR 206.A N MET 242.A O no hydrogen 3.059 N/A GLY 208.A N SER 244.A O no hydrogen 2.792 N/A SER 211.A N THR 209.A OG1 no hydrogen 3.347 N/A TYR 212.A OH GLU 306.A OE1 no hydrogen 2.616 N/A GLN 214.A N SER 211.A OG no hydrogen 2.993 N/A GLN 214.A NE2 GLN 214.A O no hydrogen 3.433 N/A GLN 214.A NE2 GLY 218.A O no hydrogen 2.776 N/A PHE 215.A N SER 211.A O no hydrogen 3.221 N/A LYS 216.A N TYR 212.A O no hydrogen 3.023 N/A LYS 216.A NZ GLU 213.A OE2 no hydrogen 3.545 N/A LYS 217.A N GLU 213.A O no hydrogen 3.062 N/A GLY 218.A N GLN 214.A O no hydrogen 2.737 N/A VAL 219.A N LYS 231.A O no hydrogen 3.020 N/A ILE 221.A N ALA 229.A O no hydrogen 2.990 N/A CYS 223.A N LYS 227.A O no hydrogen 2.832 N/A GLY 226.A N CYS 223.A O no hydrogen 3.055 N/A ALA 229.A N ILE 221.A O no hydrogen 2.849 N/A THR 230.A N VAL 187.A O no hydrogen 2.968 N/A THR 230.A OG1 GLN 220.A OE1 no hydrogen 3.346 N/A LYS 231.A N VAL 219.A O no hydrogen 3.063 N/A TYR 232.A N ASN 185.A O no hydrogen 2.908 N/A LEU 233.A N PHE 215.A O no hydrogen 3.234 N/A VAL 234.A N VAL 183.A O no hydrogen 2.880 N/A GLN 235.A N VAL 183.A O no hydrogen 3.354 N/A GLN 236.A N TYR 309.A O no hydrogen 2.861 N/A GLN 236.A NE2 ALA 203.A O no hydrogen 2.744 N/A GLN 236.A NE2 SER 238.A OG no hydrogen 2.601 N/A GLU 237.A N LYS 181.A O no hydrogen 2.922 N/A SER 238.A OG PHE 240.A O no hydrogen 2.893 N/A VAL 241.A N TYR 304.A O no hydrogen 2.938 N/A MET 242.A N VAL 204.A O no hydrogen 2.734 N/A MET 243.A N VAL 302.A O no hydrogen 2.862 N/A SER 244.A N TYR 206.A O no hydrogen 2.904 N/A SER 244.A OG ASP 301.A OD1 no hydrogen 2.632 N/A ALA 245.A N THR 300.A O no hydrogen 2.900 N/A ALA 248.A N ILE 299.A O no hydrogen 3.379 N/A TYR 250.A N GLY 297.A O no hydrogen 3.020 N/A LEU 252.A N TYR 295.A O no hydrogen 2.848 N/A HIS 254.A NE2 LYS 278.A O no hydrogen 2.567 N/A GLY 255.A N SER 277.A OG no hydrogen 2.853 N/A THR 256.A N LYS 253.A O no hydrogen 3.287 N/A THR 256.A OG1 LYS 253.A O no hydrogen 2.607 N/A THR 258.A N PHE 303.A O no hydrogen 2.894 N/A CYS 259.A N PHE 303.A O no hydrogen 3.458 N/A ALA 260.A N ILE 275.A O no hydrogen 2.664 N/A SER 261.A N ASP 301.A O no hydrogen 2.851 N/A SER 261.A OG THR 114.A OG1.A no hydrogen 3.142 N/A GLU 262.A N LYS 273.A O no hydrogen 2.793 N/A TYR 263.A N PRO 298.A O no hydrogen 2.992 N/A TYR 263.A OH ASN 266.A O no hydrogen 2.624 N/A THR 264.A N HIS 271.A O no hydrogen 3.102 N/A ASN 266.A N CYS 269.A O no hydrogen 2.839 N/A GLN 268.A N ASN 266.A OD1 no hydrogen 2.957 N/A CYS 269.A N ASN 266.A O no hydrogen 3.383 N/A HIS 271.A N THR 264.A O no hydrogen 2.965 N/A HIS 271.A NE2 ASP 285.A OD1 no hydrogen 2.678 N/A TYR 272.A N SER 110.A OG no hydrogen 2.907 N/A LYS 273.A N GLU 262.A O no hydrogen 2.926 N/A HIS 274.A N ILE 284.A O no hydrogen 2.973 N/A HIS 274.A ND1 THR 114.A OG1.A no hydrogen 2.986 N/A HIS 274.A NE2 GLN 121.A OE1 no hydrogen 2.857 N/A ILE 275.A N ALA 260.A O no hydrogen 2.987 N/A THR 276.A N TYR 282.A O no hydrogen 2.966 N/A SER 277.A N THR 258.A O no hydrogen 3.126 N/A LYS 278.A N THR 280.A O no hydrogen 2.990 N/A GLU 279.A N GLU 279.A OE1 no hydrogen 2.798 N/A THR 280.A OG1 SER 292.A O no hydrogen 2.797 N/A LEU 281.A N SER 292.A O no hydrogen 3.226 N/A TYR 282.A N THR 276.A O no hydrogen 2.959 N/A TYR 282.A OH GLU 279.A OE2 no hydrogen 2.918 N/A CYS 283.A N THR 290.A O no hydrogen 2.768 N/A CYS 283.A SG HIS 274.A O no hydrogen 4.015 N/A ILE 284.A N HIS 274.A O no hydrogen 2.711 N/A ASP 285.A N LEU 288.A O no hydrogen 2.959 N/A LEU 288.A N ASP 285.A O no hydrogen 3.016 N/A THR 290.A N CYS 283.A O no hydrogen 3.047 N/A SER 292.A N LEU 281.A O no hydrogen 3.000 N/A SER 292.A OG GLU 294.A O no hydrogen 2.969 N/A TYR 295.A OH GLU 262.A OE1 no hydrogen 3.158 N/A TYR 295.A OH GLU 262.A OE2 no hydrogen 2.611 N/A GLY 297.A N TYR 250.A O no hydrogen 3.279 N/A ILE 299.A N ALA 248.A O no hydrogen 3.148 N/A THR 300.A N SER 261.A O no hydrogen 2.987 N/A THR 300.A OG1 SER 261.A O no hydrogen 3.447 N/A THR 300.A OG1 ASP 301.A OD2 no hydrogen 3.151 N/A VAL 302.A N MET 243.A O no hydrogen 2.791 N/A PHE 303.A N CYS 259.A O no hydrogen 2.820 N/A TYR 304.A N VAL 241.A O no hydrogen 2.950 N/A TYR 304.A OH LEU 210.A O no hydrogen 2.516 N/A GLU 306.A N PRO 239.A O no hydrogen 3.168 N/A ASN 307.A N GLU 306.A OE2 no hydrogen 2.915 N/A SER 308.A N ASN 307.A OD1.A no hydrogen 2.939 N/A TYR 309.A N GLN 236.A O no hydrogen 2.789 N/A TYR 309.A OH THR 311.A OG1 no hydrogen 3.383 N/A THR 311.A N VAL 234.A O no hydrogen 2.814 N/A THR 311.A OG1 TYR 309.A OH no hydrogen 3.383 N/A