Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5a6j_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 4.A OG LEU 28.A O no hydrogen 2.250 N/A VAL 6.A N SER 4.A OG no hydrogen 3.168 N/A ARG 7.A N VAL 31.A O no hydrogen 2.774 N/A THR 9.A N VAL 33.A O no hydrogen 3.010 N/A SER 12.A N GLN 15.A OE1 no hydrogen 2.859 N/A SER 12.A OG GLN 15.A OE1 no hydrogen 2.991 N/A LYS 14.A NZ GLN 158.A O no hydrogen 2.938 N/A LYS 14.A NZ GLN 158.A OE1 no hydrogen 3.121 N/A LYS 14.A NZ ASP 161.A OD1 no hydrogen 2.567 N/A GLN 15.A N SER 12.A OG no hydrogen 3.200 N/A GLN 15.A NE2 TYR 56.A OH no hydrogen 3.008 N/A THR 16.A N SER 12.A O no hydrogen 3.053 N/A THR 16.A OG1 LEU 13.A O no hydrogen 2.670 N/A GLN 17.A N LEU 13.A O no hydrogen 3.043 N/A ALA 18.A N LYS 14.A O no hydrogen 3.043 N/A ILE 19.A N GLN 15.A O no hydrogen 2.947 N/A GLU 20.A N THR 16.A O no hydrogen 2.989 N/A VAL 21.A N GLN 17.A O no hydrogen 3.295 N/A LEU 22.A N ALA 18.A O no hydrogen 3.143 N/A LYS 23.A N ILE 19.A O no hydrogen 2.998 N/A LYS 23.A N GLU 20.A O no hydrogen 3.264 N/A LYS 23.A NZ GLU 20.A OE2 no hydrogen 2.530 N/A GLY 24.A N VAL 21.A O no hydrogen 2.964 N/A HIS 25.A N LEU 22.A O no hydrogen 2.822 N/A HIS 25.A NE2 GLU 112.A OE1 no hydrogen 2.535 N/A ILE 26.A N LEU 22.A O no hydrogen 2.957 N/A VAL 31.A N PRO 29.A O no hydrogen 3.071 N/A GLU 32.A N GLY 50.A O no hydrogen 2.937 N/A VAL 33.A N ARG 7.A O no hydrogen 2.769 N/A ALA 34.A N TYR 52.A O no hydrogen 2.763 N/A VAL 35.A N THR 9.A O no hydrogen 2.897 N/A THR 36.A N LEU 54.A O no hydrogen 2.993 N/A GLN 37.A NE2 ARG 57.A O no hydrogen 2.863 N/A SER 38.A N TYR 56.A O no hydrogen 2.776 N/A GLN 40.A N SER 38.A OG no hydrogen 3.013 N/A GLN 40.A NE2 GLU 82.A OE2 no hydrogen 2.620 N/A ILE 43.A N GLU 83.A O no hydrogen 3.175 N/A SER 44.A N THR 55.A O no hydrogen 2.855 N/A SER 44.A OG.A THR 55.A OG1 no hydrogen 2.188 N/A SER 44.A OG.B GLU 46.A OE2 no hydrogen 2.920 N/A SER 44.A OG.B ILE 81.A O no hydrogen 3.050 N/A ILE 45.A N ILE 81.A O no hydrogen 2.809 N/A GLU 46.A N GLN 53.A O no hydrogen 3.065 N/A GLU 48.A N HIS 51.A O no hydrogen 3.039 N/A GLU 49.A N ASP 77.A OD1 no hydrogen 3.017 N/A GLU 49.A N ASP 77.A OD2 no hydrogen 2.724 N/A HIS 51.A N GLU 48.A O no hydrogen 3.025 N/A TYR 52.A N GLU 32.A O no hydrogen 2.921 N/A TYR 52.A OH ASP 77.A O no hydrogen 2.455 N/A GLN 53.A N GLU 46.A O no hydrogen 2.694 N/A LEU 54.A N ALA 34.A O no hydrogen 2.670 N/A THR 55.A N SER 44.A O no hydrogen 2.840 N/A THR 55.A OG1 SER 44.A OG.A no hydrogen 2.188 N/A TYR 56.A N THR 36.A O no hydrogen 3.357 N/A ARG 57.A N SER 42.A O no hydrogen 2.967 N/A ARG 57.A NE ASP 39.A O no hydrogen 3.184 N/A ARG 57.A NE ASP 39.A OD1 no hydrogen 3.139 N/A ARG 57.A NH1 GLN 84.A OE1 no hydrogen 3.465 N/A ARG 57.A NH2 ASP 39.A O no hydrogen 2.833 N/A ARG 57.A NH2 GLN 84.A OE1 no hydrogen 3.092 N/A LYS 58.A N GLN 61.A OE1 no hydrogen 2.941 N/A LYS 58.A NZ GLU 88.A O no hydrogen 2.843 N/A GLN 61.A N LYS 58.A O no hydrogen 2.838 N/A GLN 61.A NE2 TYR 389.A OH no hydrogen 3.139 N/A LEU 62.A N PRO 59.A O no hydrogen 3.413 N/A TYR 63.A N HIS 60.A O no hydrogen 3.154 N/A ARG 64.A NE GLU 83.A OE1 no hydrogen 2.876 N/A ARG 64.A NH1 MET 117.A O no hydrogen 3.128 N/A ARG 64.A NH1 GLU 386.A OE2 no hydrogen 2.847 N/A ARG 64.A NH2 GLU 83.A OE1 no hydrogen 3.508 N/A ARG 64.A NH2 GLU 83.A OE2 no hydrogen 2.853 N/A ARG 64.A NH2 GLU 386.A OE1 no hydrogen 3.286 N/A ARG 64.A NH2 GLU 386.A OE2 no hydrogen 3.417 N/A ALA 65.A N GLN 61.A O no hydrogen 3.080 N/A LEU 66.A N LEU 62.A O no hydrogen 3.038 N/A SER 67.A N TYR 63.A O no hydrogen 3.298 N/A SER 67.A OG ASN 403.A OD1 no hydrogen 2.809 N/A LEU 68.A N ARG 64.A O no hydrogen 2.924 N/A LEU 69.A N ALA 65.A O no hydrogen 2.759 N/A VAL 70.A N LEU 66.A O no hydrogen 2.983 N/A THR 71.A N SER 67.A O no hydrogen 3.109 N/A THR 71.A OG1 SER 67.A O no hydrogen 2.637 N/A THR 71.A OG1 THR 402.A OG1 no hydrogen 2.665 N/A VAL 72.A N LEU 68.A O no hydrogen 2.896 N/A LEU 73.A N LEU 69.A O no hydrogen 3.041 N/A ALA 74.A N THR 71.A O no hydrogen 3.242 N/A GLU 75.A N VAL 72.A O no hydrogen 3.400 N/A VAL 79.A N GLY 47.A O no hydrogen 3.022 N/A ILE 81.A N ILE 45.A O no hydrogen 2.873 N/A GLU 83.A N ILE 43.A O no hydrogen 2.700 N/A GLN 84.A NE2 GLN 40.A O no hydrogen 3.029 N/A ALA 85.A N SER 42.A OG no hydrogen 3.004 N/A ALA 86.A N SER 388.A O no hydrogen 2.969 N/A TYR 87.A OH ASN 349.A OD1 no hydrogen 2.549 N/A ASP 89.A N LYS 358.A O no hydrogen 3.364 N/A LEU 90.A N SER 120.A OG no hydrogen 3.244 N/A ALA 91.A N VAL 360.A O no hydrogen 2.900 N/A TYR 92.A N THR 121.A O no hydrogen 3.105 N/A MET 93.A N VAL 362.A O no hydrogen 2.966 N/A VAL 94.A N GLU 123.A O no hydrogen 2.906 N/A ASP 95.A N GLY 364.A O no hydrogen 3.329 N/A CYS 96.A N TYR 125.A O no hydrogen 2.911 N/A CYS 96.A SG VAL 94.A O no hydrogen 4.038 N/A CYS 96.A SG TYR 145.A OH no hydrogen 3.349 N/A SER 97.A N ASP 95.A OD1 no hydrogen 2.822 N/A SER 97.A OG TYR 125.A O no hydrogen 2.739 N/A ARG 98.A NE ASP 95.A OD2 no hydrogen 2.755 N/A ARG 98.A NH2 ASP 95.A OD2 no hydrogen 3.542 N/A ASN 103.A N GLU 541.A O no hydrogen 2.981 N/A ASN 103.A ND2 LYS 540.A O no hydrogen 3.020 N/A ASN 103.A ND2 ASN 542.A O no hydrogen 3.193 N/A SER 106.A N ASN 103.A OD1 no hydrogen 2.923 N/A SER 106.A OG ASN 103.A OD1 no hydrogen 2.933 N/A SER 106.A OG LYS 540.A O no hydrogen 2.969 N/A SER 106.A OG GLU 541.A O no hydrogen 3.452 N/A ALA 107.A N ASN 103.A O no hydrogen 3.014 N/A LYS 108.A N VAL 104.A O no hydrogen 3.102 N/A LYS 108.A NZ GLU 152.A OE2 no hydrogen 2.749 N/A GLN 109.A N ALA 105.A O no hydrogen 3.156 N/A MET 110.A N SER 106.A O no hydrogen 2.954 N/A ILE 111.A N ALA 107.A O no hydrogen 2.964 N/A GLU 112.A N LYS 108.A O no hydrogen 3.078 N/A ILE 113.A N GLN 109.A O no hydrogen 3.068 N/A LEU 114.A N MET 110.A O no hydrogen 2.816 N/A ALA 115.A N ILE 111.A O no hydrogen 2.937 N/A LEU 116.A N GLU 112.A O no hydrogen 3.079 N/A MET 117.A N ILE 113.A O no hydrogen 2.982 N/A MET 117.A N LEU 114.A O no hydrogen 3.227 N/A GLY 118.A N LEU 114.A O no hydrogen 3.059 N/A TYR 119.A N LEU 114.A O no hydrogen 3.028 N/A TYR 119.A OH LEU 381.A O no hydrogen 2.826 N/A SER 120.A N LEU 90.A O no hydrogen 3.016 N/A SER 120.A OG ASP 89.A OD1 no hydrogen 2.528 N/A SER 120.A OG LEU 90.A O no hydrogen 3.403 N/A SER 120.A OG THR 121.A OG1 no hydrogen 2.830 N/A THR 121.A N LEU 90.A O no hydrogen 3.312 N/A THR 121.A OG1 ASP 89.A OD1 no hydrogen 3.478 N/A THR 121.A OG1 SER 120.A OG no hydrogen 2.830 N/A THR 121.A OG1 THR 163.A OG1 no hydrogen 2.990 N/A PHE 122.A N THR 163.A O no hydrogen 2.800 N/A GLU 123.A N TYR 92.A O no hydrogen 2.811 N/A TYR 125.A N VAL 94.A O no hydrogen 2.739 N/A TYR 125.A OH GLU 127.A OE2 no hydrogen 2.450 N/A MET 126.A N CYS 167.A O no hydrogen 2.738 N/A GLU 127.A N SER 97.A OG no hydrogen 2.744 N/A THR 129.A OG1 CYS 96.A O no hydrogen 2.790 N/A GLN 131.A N TYR 145.A O no hydrogen 3.031 N/A GLN 131.A NE2 ALA 144.A O no hydrogen 3.530 N/A GLN 135.A N ILE 132.A O no hydrogen 3.158 N/A PHE 138.A N GLN 135.A O no hydrogen 3.127 N/A TYR 140.A N TYR 137.A O no hydrogen 3.452 N/A ARG 142.A N GLY 139.A O no hydrogen 2.821 N/A ARG 142.A NE ASP 128.A OD2 no hydrogen 2.664 N/A ARG 142.A NH2 SER 97.A O no hydrogen 2.902 N/A ARG 142.A NH2 ASP 128.A OD1 no hydrogen 2.852 N/A ARG 142.A NH2 ASP 128.A OD2 no hydrogen 3.361 N/A TYR 145.A N THR 129.A O no hydrogen 3.011 N/A TYR 145.A OH LEU 102.A O no hydrogen 2.572 N/A SER 146.A N GLU 149.A OE1 no hydrogen 3.018 N/A SER 146.A OG GLU 148.A OE1 no hydrogen 3.363 N/A GLU 149.A N SER 146.A OG no hydrogen 2.982 N/A LEU 150.A N SER 146.A O no hydrogen 3.008 N/A GLN 151.A N ALA 147.A O no hydrogen 2.840 N/A GLN 151.A NE2 LYS 215.A O no hydrogen 2.819 N/A GLU 152.A N GLU 148.A O no hydrogen 2.914 N/A ILE 153.A N GLU 149.A O no hydrogen 3.041 N/A GLU 154.A N LEU 150.A O no hydrogen 2.908 N/A ALA 155.A N GLN 151.A O no hydrogen 2.803 N/A TYR 156.A N GLU 152.A O no hydrogen 3.062 N/A TYR 156.A OH GLU 112.A OE2 no hydrogen 2.528 N/A ALA 157.A N ILE 153.A O no hydrogen 3.043 N/A GLN 158.A N GLU 154.A O no hydrogen 2.820 N/A GLN 159.A N ALA 155.A O no hydrogen 3.118 N/A PHE 160.A N ALA 157.A O no hydrogen 2.878 N/A ASP 161.A N GLN 158.A O no hydrogen 2.978 N/A VAL 162.A N ALA 157.A O no hydrogen 3.091 N/A THR 163.A N SER 120.A O no hydrogen 2.740 N/A THR 163.A OG1 SER 120.A O no hydrogen 3.239 N/A VAL 165.A N PHE 122.A O no hydrogen 2.994 N/A CYS 167.A N LEU 124.A O no hydrogen 2.994 N/A CYS 167.A SG GLU 123.A OE1 no hydrogen 3.159 N/A ILE 168.A N ASN 222.A O no hydrogen 2.784 N/A GLN 169.A NE2 TYR 125.A OH no hydrogen 2.933 N/A THR 170.A OG1 ILE 223.A O no hydrogen 2.770 N/A HIS 173.A N ASP 193.A OD2 no hydrogen 2.923 N/A LEU 174.A N ASP 193.A O no hydrogen 3.292 N/A PHE 177.A N LEU 174.A O no hydrogen 2.967 N/A VAL 178.A N LEU 174.A O no hydrogen 2.963 N/A LYS 179.A NZ ALA 176.A O no hydrogen 2.862 N/A TRP 180.A N PHE 177.A O no hydrogen 3.437 N/A VAL 185.A N VAL 182.A O no hydrogen 2.923 N/A GLN 186.A N VAL 182.A O no hydrogen 2.942 N/A GLN 186.A NE2 VAL 178.A O no hydrogen 3.019 N/A GLN 186.A NE2 TRP 180.A O no hydrogen 2.659 N/A GLU 187.A N LYS 183.A O no hydrogen 2.957 N/A LEU 188.A N VAL 185.A O no hydrogen 3.006 N/A ARG 189.A N GLN 186.A O no hydrogen 3.187 N/A ARG 189.A NH1 GLN 186.A OE1 no hydrogen 3.124 N/A ARG 189.A NH2 GLU 192.A O no hydrogen 2.796 N/A ASP 190.A N ILE 194.A O no hydrogen 2.870 N/A ASP 193.A N ASP 193.A OD1 no hydrogen 2.614 N/A ILE 194.A N VAL 191.A O no hydrogen 2.975 N/A LEU 195.A N LEU 171.A O no hydrogen 2.896 N/A LEU 196.A N LEU 188.A O no hydrogen 2.699 N/A GLY 198.A N TYR 203.A OH no hydrogen 3.293 N/A GLU 199.A N LEU 196.A O no hydrogen 3.232 N/A LYS 201.A N GLU 199.A OE2 no hydrogen 3.061 N/A VAL 202.A N GLU 199.A O no hydrogen 2.782 N/A TYR 203.A N GLU 199.A O no hydrogen 3.414 N/A TYR 203.A OH HIS 252.A ND1 no hydrogen 2.601 N/A ASP 204.A N GLU 200.A O no hydrogen 2.890 N/A LEU 205.A N LYS 201.A O no hydrogen 3.133 N/A ILE 206.A N VAL 202.A O no hydrogen 2.917 N/A ASP 207.A N TYR 203.A O no hydrogen 2.820 N/A GLY 208.A N ASP 204.A O no hydrogen 3.116 N/A MET 209.A N LEU 205.A O no hydrogen 2.907 N/A PHE 210.A N ILE 206.A O no hydrogen 3.116 N/A ALA 211.A N ASP 207.A O no hydrogen 2.825 N/A THR 212.A N GLY 208.A O no hydrogen 3.101 N/A THR 212.A OG1 GLN 131.A O no hydrogen 2.997 N/A THR 212.A OG1 GLY 208.A O no hydrogen 3.392 N/A LEU 213.A N MET 209.A O no hydrogen 3.152 N/A SER 214.A N PHE 210.A O no hydrogen 2.856 N/A SER 214.A OG PHE 210.A O no hydrogen 3.332 N/A SER 214.A OG ALA 211.A O no hydrogen 2.838 N/A LEU 216.A N LEU 213.A O no hydrogen 2.938 N/A LYS 217.A N GLU 154.A OE1 no hydrogen 2.812 N/A THR 218.A N GLU 154.A OE2 no hydrogen 2.748 N/A THR 218.A OG1 PHE 164.A O no hydrogen 2.782 N/A ARG 219.A NH1 SER 214.A O no hydrogen 3.435 N/A ARG 219.A NH1 LEU 216.A O no hydrogen 2.860 N/A ARG 219.A NH1 THR 218.A O no hydrogen 2.700 N/A ARG 219.A NH2 SER 214.A O no hydrogen 2.750 N/A LYS 220.A N THR 218.A OG1 no hydrogen 3.258 N/A LYS 220.A NZ GLU 359.A OE1 no hydrogen 3.236 N/A LYS 220.A NZ GLU 359.A OE2 no hydrogen 3.378 N/A VAL 221.A N HIS 266.A O no hydrogen 3.037 N/A ASN 222.A N PRO 166.A O no hydrogen 3.000 N/A ILE 223.A N GLN 268.A O no hydrogen 3.047 N/A GLY 224.A N ASN 222.A OD1 no hydrogen 2.827 N/A VAL 231.A N ALA 228.A O no hydrogen 3.035 N/A GLY 232.A N ASP 190.A OD2 no hydrogen 2.888 N/A LEU 233.A N LEU 230.A O no hydrogen 2.966 N/A ARG 235.A N ASP 190.A O no hydrogen 2.967 N/A TYR 236.A N ASP 190.A OD1 no hydrogen 2.995 N/A ILE 238.A N GLY 234.A O no hydrogen 3.174 N/A LEU 239.A N ARG 235.A O no hydrogen 3.167 N/A ASN 240.A N TYR 236.A O no hydrogen 2.923 N/A ASN 240.A ND2 TYR 236.A O no hydrogen 3.305 N/A GLY 241.A N LEU 237.A O no hydrogen 2.873 N/A SER 246.A OG ASP 244.A OD1 no hydrogen 3.504 N/A SER 246.A OG ASP 244.A OD2 no hydrogen 3.462 N/A LEU 248.A N ASP 244.A O no hydrogen 2.807 N/A MET 249.A N ARG 245.A O no hydrogen 2.729 N/A CYS 250.A N SER 246.A O no hydrogen 2.970 N/A CYS 250.A SG SER 246.A O no hydrogen 3.137 N/A GLN 251.A N LEU 247.A O no hydrogen 2.972 N/A HIS 252.A N LEU 248.A O no hydrogen 3.028 N/A HIS 252.A ND1 TYR 203.A OH no hydrogen 2.601 N/A HIS 252.A NE2 THR 170.A O no hydrogen 2.875 N/A LEU 253.A N MET 249.A O no hydrogen 2.770 N/A GLU 254.A N CYS 250.A O no hydrogen 2.982 N/A ARG 255.A N GLN 251.A O no hydrogen 3.416 N/A ARG 255.A NH1 GLU 200.A OE2 no hydrogen 3.189 N/A ARG 255.A NH2 GLU 200.A OE1 no hydrogen 3.099 N/A ARG 255.A NH2 GLU 200.A OE2 no hydrogen 3.402 N/A VAL 256.A N HIS 252.A O no hydrogen 3.049 N/A LEU 257.A N LEU 253.A O no hydrogen 2.815 N/A ASP 258.A N GLU 254.A O no hydrogen 3.018 N/A ILE 259.A N ARG 255.A O no hydrogen 3.097 N/A ALA 260.A N VAL 256.A O no hydrogen 2.839 N/A ASP 261.A N LEU 257.A O no hydrogen 2.742 N/A LYS 262.A N ASP 258.A O no hydrogen 3.087 N/A LYS 262.A NZ ASP 207.A OD2 no hydrogen 2.805 N/A TYR 263.A N ILE 259.A O no hydrogen 3.347 N/A TYR 263.A N ALA 260.A O no hydrogen 2.906 N/A TYR 263.A OH ASP 207.A OD1 no hydrogen 2.692 N/A GLY 264.A N ASP 261.A O no hydrogen 2.966 N/A PHE 265.A N ALA 260.A O no hydrogen 3.122 N/A HIS 266.A N ARG 219.A O no hydrogen 2.852 N/A HIS 266.A NE2 THR 294.A OG1 no hydrogen 2.728 N/A GLN 268.A N VAL 221.A O no hydrogen 2.753 N/A GLN 268.A NE2 GLU 359.A OE2 no hydrogen 3.059 N/A MET 269.A N THR 294.A O no hydrogen 2.935 N/A TRP 270.A N GLY 224.A O no hydrogen 3.288 N/A SER 271.A N VAL 296.A O no hydrogen 3.092 N/A SER 271.A OG VAL 296.A O no hydrogen 3.425 N/A SER 271.A OG HIS 315.A NE2 no hydrogen 2.924 N/A PHE 274.A N SER 271.A O no hydrogen 2.932 N/A PHE 275.A N ASP 272.A O no hydrogen 2.932 N/A LEU 277.A N PHE 274.A O no hydrogen 3.078 N/A MET 278.A N PHE 275.A O no hydrogen 3.070 N/A THR 282.A N PRO 279.A O no hydrogen 2.813 N/A ARG 283.A N PRO 279.A O no hydrogen 3.109 N/A VAL 284.A N GLU 280.A O no hydrogen 2.939 N/A TYR 285.A N GLU 281.A O no hydrogen 3.455 N/A TYR 285.A OH GLU 254.A OE1 no hydrogen 2.476 N/A LEU 286.A N THR 282.A O no hydrogen 2.947 N/A ASP 287.A N ARG 283.A O no hydrogen 3.013 N/A ARG 288.A N VAL 284.A O no hydrogen 3.105 N/A ARG 288.A NH1 GLU 254.A OE2 no hydrogen 2.660 N/A LEU 289.A N TYR 285.A O no hydrogen 3.038 N/A LYS 290.A N LEU 286.A O no hydrogen 2.813 N/A LYS 290.A NZ ASP 287.A OD1 no hydrogen 3.516 N/A LYS 290.A NZ ASP 291.A OD1 no hydrogen 2.775 N/A ARG 292.A N LEU 289.A O no hydrogen 2.840 N/A ARG 292.A NH2 ASP 258.A OD1 no hydrogen 2.725 N/A ARG 292.A NH2 ASP 261.A OD2 no hydrogen 2.803 N/A THR 294.A N CYS 267.A O no hydrogen 3.006 N/A THR 294.A OG1 HIS 266.A NE2 no hydrogen 2.728 N/A THR 294.A OG1 ASP 321.A OD1 no hydrogen 2.716 N/A THR 294.A OG1 ASP 321.A OD2 no hydrogen 3.183 N/A LEU 295.A N ASP 321.A O no hydrogen 2.967 N/A VAL 296.A N MET 269.A O no hydrogen 2.681 N/A TYR 297.A N ALA 323.A O no hydrogen 2.844 N/A TYR 297.A OH ASP 299.A OD2 no hydrogen 2.703 N/A TRP 298.A NE1 ASP 272.A OD1 no hydrogen 2.956 N/A ASP 299.A N ALA 325.A O no hydrogen 3.046 N/A TYR 301.A N ASP 299.A OD1 no hydrogen 3.042 N/A GLN 302.A N ASP 299.A OD1 no hydrogen 3.338 N/A SER 304.A OG GLU 306.A OE2.B no hydrogen 3.302 N/A GLU 305.A N GLU 347.A OE1 no hydrogen 3.192 N/A LYS 307.A NZ ASP 303.A OD1 no hydrogen 2.858 N/A TYR 308.A OH GLN 302.A O no hydrogen 2.855 N/A ASN 309.A N GLU 305.A O no hydrogen 2.917 N/A ASN 309.A ND2 ASN 355.A OD1 no hydrogen 2.688 N/A ARG 310.A N GLU 306.A O no hydrogen 2.926 N/A ASN 311.A ND2 TYR 297.A OH no hydrogen 2.804 N/A PHE 312.A N TYR 308.A O no hydrogen 2.877 N/A ARG 313.A N ASN 309.A O no hydrogen 2.780 N/A ASN 314.A N ARG 310.A O no hydrogen 3.126 N/A HIS 315.A N ASN 311.A O no hydrogen 2.997 N/A HIS 315.A ND1 ASN 311.A O no hydrogen 2.634 N/A HIS 315.A NE2 SER 271.A OG no hydrogen 2.924 N/A HIS 316.A N PHE 312.A O no hydrogen 2.853 N/A LYS 317.A N ARG 313.A O no hydrogen 3.106 N/A ILE 318.A N HIS 315.A O no hydrogen 2.901 N/A SER 319.A N HIS 315.A O no hydrogen 2.910 N/A ASP 321.A N SER 319.A OG no hydrogen 3.271 N/A ALA 323.A N LEU 295.A O no hydrogen 2.821 N/A PHE 324.A N GLU 359.A O no hydrogen 2.886 N/A ALA 325.A N TYR 297.A O no hydrogen 2.830 N/A GLY 326.A N ILE 361.A O no hydrogen 2.839 N/A ALA 328.A N THR 363.A O no hydrogen 2.730 N/A TRP 329.A N SER 341.A OG no hydrogen 2.984 N/A TRP 329.A NE1 TYR 300.A O no hydrogen 3.028 N/A LYS 330.A NZ LYS 330.A O no hydrogen 3.329 N/A LYS 330.A NZ GLY 364.A O no hydrogen 3.132 N/A LYS 330.A NZ TRP 365.A O no hydrogen 2.802 N/A PHE 334.A N ASN 433.A OD1 no hydrogen 2.750 N/A HIS 337.A N TRP 329.A O no hydrogen 2.887 N/A ASN 338.A N ASP 415.A OD1 no hydrogen 2.967 N/A ASN 338.A ND2 SER 376.A O no hydrogen 2.854 N/A ASN 338.A ND2 ASP 415.A OD1 no hydrogen 3.000 N/A HIS 339.A N ASP 415.A OD2 no hydrogen 2.877 N/A HIS 339.A ND1 ASP 415.A OD2 no hydrogen 2.790 N/A PHE 340.A N HIS 337.A ND1 no hydrogen 3.120 N/A SER 341.A N HIS 337.A O no hydrogen 3.014 N/A SER 341.A OG HIS 337.A O no hydrogen 2.700 N/A ARG 342.A N ASN 338.A O no hydrogen 2.861 N/A LEU 343.A N HIS 339.A O no hydrogen 3.078 N/A VAL 344.A N PHE 340.A O no hydrogen 3.085 N/A ALA 345.A N SER 341.A O no hydrogen 2.941 N/A ILE 346.A N ARG 342.A O no hydrogen 3.072 N/A ALA 348.A N VAL 344.A O no hydrogen 2.953 N/A ASN 349.A N ALA 345.A O no hydrogen 2.793 N/A ASN 349.A ND2 ASN 391.A OD1 no hydrogen 2.928 N/A LYS 350.A N ILE 346.A O no hydrogen 3.385 N/A LYS 350.A NZ GLU 347.A OE2 no hydrogen 3.514 N/A ALA 351.A N GLU 347.A O no hydrogen 3.257 N/A CYS 352.A N ALA 348.A O no hydrogen 2.809 N/A CYS 352.A SG ALA 348.A O no hydrogen 3.236 N/A ARG 353.A N ASN 349.A O no hydrogen 2.993 N/A ARG 353.A NE ASN 349.A OD1 no hydrogen 3.160 N/A ARG 353.A NH2 LEU 387.A O no hydrogen 2.822 N/A ALA 354.A N LYS 350.A O no hydrogen 2.887 N/A ASN 355.A N ALA 351.A O no hydrogen 2.915 N/A GLN 356.A N ARG 353.A O no hydrogen 2.931 N/A ILE 357.A N CYS 352.A O no hydrogen 2.824 N/A VAL 360.A N ASP 89.A O no hydrogen 3.135 N/A ILE 361.A N PHE 324.A O no hydrogen 2.754 N/A VAL 362.A N ALA 91.A O no hydrogen 2.766 N/A THR 363.A N GLY 326.A O no hydrogen 2.825 N/A THR 363.A OG1 GLY 326.A O no hydrogen 2.676 N/A GLY 364.A N MET 93.A O no hydrogen 2.869 N/A TRP 365.A NE1 TYR 300.A OH no hydrogen 3.008 N/A GLY 366.A N ASP 95.A OD2 no hydrogen 2.882 N/A GLY 370.A N GLY 366.A O no hydrogen 2.848 N/A THR 372.A OG1 LYS 330.A O no hydrogen 3.357 N/A THR 372.A OG1 GLY 333.A O no hydrogen 2.704 N/A GLN 374.A N GLU 541.A OE1 no hydrogen 2.686 N/A GLN 374.A NE2 ASN 542.A OD1 no hydrogen 2.866 N/A PHE 375.A N GLU 541.A OE2 no hydrogen 3.215 N/A SER 376.A N ALA 373.A O no hydrogen 3.167 N/A SER 376.A OG ALA 373.A O no hydrogen 2.625 N/A LEU 378.A N PHE 375.A O no hydrogen 3.504 N/A SER 380.A N ASN 338.A OD1 no hydrogen 3.247 N/A SER 380.A OG ASN 338.A OD1 no hydrogen 2.635 N/A LEU 381.A N ILE 377.A O no hydrogen 3.234 N/A GLN 382.A N LEU 378.A O no hydrogen 3.077 N/A GLN 382.A NE2 GLU 386.A OE2 no hydrogen 3.003 N/A ILE 383.A N PRO 379.A O no hydrogen 2.873 N/A TRP 384.A N SER 380.A O no hydrogen 3.175 N/A ALA 385.A N LEU 381.A O no hydrogen 3.157 N/A GLU 386.A N GLN 382.A O no hydrogen 2.820 N/A LEU 387.A N ILE 383.A O no hydrogen 2.871 N/A SER 388.A N TRP 384.A O no hydrogen 2.979 N/A TYR 389.A N ALA 385.A O no hydrogen 3.007 N/A TYR 389.A OH GLY 118.A O no hydrogen 3.028 N/A ARG 390.A N GLU 386.A O no hydrogen 2.801 N/A ARG 390.A NE ASP 392.A OD1 no hydrogen 3.109 N/A ARG 390.A NH2 ASP 392.A OD1 no hydrogen 2.834 N/A ASN 391.A N GLU 386.A O no hydrogen 3.280 N/A ASN 391.A N LEU 387.A O no hydrogen 3.062 N/A ASP 394.A N ASP 392.A OD1 no hydrogen 2.949 N/A LEU 396.A N LEU 393.A O no hydrogen 2.912 N/A SER 397.A OG GLU 409.A OE1 no hydrogen 2.756 N/A HIS 399.A N GLY 395.A O no hydrogen 2.905 N/A HIS 399.A ND1 GLU 386.A OE1 no hydrogen 3.170 N/A HIS 399.A ND1 GLU 386.A OE2 no hydrogen 3.115 N/A PHE 400.A N LEU 396.A O no hydrogen 2.836 N/A LYS 401.A N SER 397.A O no hydrogen 2.860 N/A THR 402.A N ALA 398.A O no hydrogen 2.957 N/A THR 402.A OG1 THR 71.A OG1 no hydrogen 2.665 N/A THR 402.A OG1 ALA 398.A O no hydrogen 3.284 N/A ASN 403.A N HIS 399.A O no hydrogen 3.008 N/A ASN 403.A ND2 GLN 382.A OE1 no hydrogen 2.909 N/A THR 404.A N PHE 400.A O no hydrogen 2.803 N/A THR 404.A OG1 PHE 400.A O no hydrogen 2.929 N/A GLY 405.A N LYS 401.A O no hydrogen 2.880 N/A LEU 406.A N THR 404.A OG1 no hydrogen 3.121 N/A VAL 408.A N SER 397.A OG no hydrogen 3.325 N/A GLU 409.A N GLU 409.A OE1 no hydrogen 2.936 N/A ASP 410.A N THR 407.A OG1 no hydrogen 3.077 N/A PHE 411.A N THR 407.A O no hydrogen 3.051 N/A MET 412.A N VAL 408.A O no hydrogen 2.925 N/A GLN 413.A N ASP 410.A O no hydrogen 3.109 N/A GLN 413.A NE2 GLU 409.A O no hydrogen 3.653 N/A ILE 414.A N PHE 411.A O no hydrogen 2.963 N/A ASP 415.A N MET 412.A O no hydrogen 3.003 N/A LEU 416.A N GLN 413.A O no hydrogen 3.050 N/A ASN 418.A N ASP 415.A O no hydrogen 2.967 N/A ASN 418.A ND2 THR 335.A O no hydrogen 3.031 N/A ASN 418.A ND2 PRO 336.A O no hydrogen 3.097 N/A LEU 419.A N LEU 416.A O no hydrogen 2.942 N/A LEU 420.A N ASN 418.A O no hydrogen 2.968 N/A LEU 423.A N LEU 420.A O no hydrogen 3.195 N/A ASN 426.A ND2 ASP 303.A OD2 no hydrogen 3.539 N/A ASN 431.A N THR 601.A O no hydrogen 3.391 N/A ASN 431.A ND2 ILE 332.A O no hydrogen 3.368 N/A ASN 431.A ND2 ALA 603.A O no hydrogen 3.020 N/A ASN 433.A ND2 ILE 332.A O no hydrogen 3.104 N/A ASN 433.A ND2 ASN 418.A OD1 no hydrogen 2.803 N/A ARG 434.A N ASN 431.A O no hydrogen 3.007 N/A ARG 434.A NE GLU 371.A OE1 no hydrogen 3.275 N/A ARG 434.A NH1 ASN 368.A OD1 no hydrogen 2.790 N/A ARG 434.A NH1 ASN 604.A OD1 no hydrogen 2.918 N/A ARG 434.A NH2 ASN 368.A OD1 no hydrogen 2.863 N/A ARG 434.A NH2 GLU 371.A OE1 no hydrogen 2.941 N/A TYR 435.A N ASN 431.A O no hydrogen 3.500 N/A TYR 435.A OH THR 601.A O no hydrogen 3.358 N/A VAL 436.A N PRO 432.A O no hydrogen 3.108 N/A TYR 438.A N ARG 434.A O no hydrogen 3.006 N/A TYR 438.A OH GLU 371.A OE2 no hydrogen 2.542 N/A CYS 443.A N ASP 440.A OD2 no hydrogen 2.674 N/A LEU 446.A N GLN 439.A OE1 no hydrogen 2.666 N/A ASP 447.A N PRO 444.A O no hydrogen 3.045 N/A HIS 449.A N LEU 446.A O no hydrogen 3.034 N/A HIS 449.A ND1 ALA 599.A O no hydrogen 2.903 N/A MET 450.A N ASP 447.A O no hydrogen 3.226 N/A THR 451.A N ASP 455.A OD2 no hydrogen 2.833 N/A GLN 454.A N THR 451.A O no hydrogen 2.874 N/A GLN 454.A NE2.B ASP 422.A OD1 no hydrogen 3.051 N/A GLN 454.A NE2.B ASP 455.A OD1 no hydrogen 2.883 N/A ASP 455.A N THR 451.A O no hydrogen 2.781 N/A LYS 456.A N PRO 452.A O no hydrogen 3.034 N/A LYS 456.A NZ SER 491.A O no hydrogen 2.678 N/A LYS 456.A NZ ASP 495.A OD1 no hydrogen 2.928 N/A HIS 458.A N GLN 454.A O no hydrogen 3.217 N/A HIS 458.A NE2 LEU 416.A O no hydrogen 2.713 N/A PHE 459.A N ASP 455.A O no hydrogen 2.999 N/A ALA 460.A N LYS 456.A O no hydrogen 3.068 N/A GLN 461.A N PRO 457.A O no hydrogen 2.967 N/A ALA 462.A N HIS 458.A O no hydrogen 2.852 N/A ALA 463.A N PHE 459.A O no hydrogen 3.029 N/A GLU 464.A N ALA 460.A O no hydrogen 3.344 N/A THR 465.A N GLN 461.A O no hydrogen 2.944 N/A THR 465.A OG1 GLN 461.A O no hydrogen 3.033 N/A LEU 466.A N ALA 462.A O no hydrogen 2.923 N/A ALA 467.A N ALA 463.A O no hydrogen 2.965 N/A ASN 468.A N GLU 464.A O no hydrogen 3.074 N/A ILE 469.A N THR 465.A O no hydrogen 3.188 N/A LYS 470.A N LEU 466.A O no hydrogen 2.990 N/A LYS 472.A N ILE 469.A O no hydrogen 2.912 N/A LYS 472.A NZ ASP 410.A OD2 no hydrogen 3.314 N/A ALA 473.A N LYS 470.A O no hydrogen 3.192 N/A TYR 476.A N ALA 473.A O no hydrogen 2.848 N/A ALA 477.A N GLY 474.A O no hydrogen 3.090 N/A TYR 478.A OH GLU 541.A OE2 no hydrogen 2.721 N/A LEU 479.A N TYR 476.A O no hydrogen 3.041 N/A PHE 480.A N ALA 477.A O no hydrogen 2.930 N/A GLU 481.A N ALA 477.A O no hydrogen 2.886 N/A THR 482.A N TYR 478.A O no hydrogen 3.150 N/A THR 482.A OG1 TYR 478.A O no hydrogen 3.160 N/A GLN 483.A N LEU 479.A O no hydrogen 3.234 N/A GLN 483.A NE2 THR 335.A OG1 no hydrogen 2.763 N/A ALA 484.A N PHE 480.A O no hydrogen 2.771 N/A GLN 485.A N GLU 481.A O no hydrogen 3.154 N/A GLN 485.A NE2 GLN 526.A O no hydrogen 2.972 N/A LEU 486.A N THR 482.A O no hydrogen 2.968 N/A ASN 487.A N GLN 483.A O no hydrogen 2.980 N/A ASN 487.A ND2 GLN 483.A O no hydrogen 2.825 N/A ALA 488.A N ALA 484.A O no hydrogen 3.072 N/A ILE 489.A N GLN 485.A O no hydrogen 3.126 N/A LEU 490.A N LEU 486.A O no hydrogen 2.998 N/A SER 491.A N ASN 487.A O no hydrogen 3.024 N/A SER 491.A OG ALA 488.A O no hydrogen 2.707 N/A SER 492.A OG ILE 489.A O no hydrogen 3.300 N/A LYS 493.A N ILE 489.A O no hydrogen 2.938 N/A LYS 493.A NZ VAL 436.A O no hydrogen 2.774 N/A LYS 493.A NZ PHE 437.A O no hydrogen 3.046 N/A LYS 493.A NZ GLN 439.A O no hydrogen 2.761 N/A VAL 494.A N LEU 490.A O no hydrogen 2.935 N/A ASP 495.A N SER 492.A O no hydrogen 3.362 N/A ARG 498.A N ASP 495.A O no hydrogen 3.022 N/A ARG 498.A NE ASP 447.A OD2 no hydrogen 2.891 N/A ARG 498.A NH2 ASP 447.A O no hydrogen 2.688 N/A ARG 498.A NH2 ASP 447.A OD2 no hydrogen 3.494 N/A ARG 498.A NH2 MET 450.A O no hydrogen 3.136 N/A ARG 499.A N ASP 495.A O no hydrogen 2.808 N/A ARG 499.A NE ASP 495.A OD1 no hydrogen 3.173 N/A ARG 499.A NE ASP 495.A OD2 no hydrogen 3.169 N/A ARG 499.A NH1 GLU 519.A OE1 no hydrogen 2.621 N/A ARG 499.A NH1 GLU 519.A OE2 no hydrogen 3.406 N/A ARG 499.A NH2 SER 492.A O no hydrogen 3.259 N/A ARG 499.A NH2 ASP 495.A OD1 no hydrogen 3.135 N/A ARG 499.A NH2 GLU 519.A OE2 no hydrogen 2.700 N/A ILE 500.A N VAL 496.A O no hydrogen 2.948 N/A ARG 501.A N GLY 497.A O no hydrogen 3.304 N/A ARG 501.A NH1 VAL 584.A O no hydrogen 2.855 N/A ARG 501.A NH2 LEU 442.A O no hydrogen 2.856 N/A ARG 501.A NH2 GLU 581.A O no hydrogen 2.882 N/A GLN 502.A N ARG 498.A O no hydrogen 2.875 N/A ALA 503.A N ARG 499.A O no hydrogen 3.061 N/A TYR 504.A N ILE 500.A O no hydrogen 2.715 N/A TYR 504.A OH GLU 583.A OE2 no hydrogen 2.327 N/A GLN 505.A N ARG 501.A O no hydrogen 2.822 N/A ALA 506.A N GLN 502.A O no hydrogen 2.989 N/A ASP 507.A N TYR 504.A O no hydrogen 3.222 N/A ASP 508.A N ALA 503.A O no hydrogen 2.871 N/A SER 511.A N ASP 508.A OD1 no hydrogen 2.910 N/A LEU 512.A N ASP 508.A O no hydrogen 3.284 N/A GLN 513.A N LYS 509.A O no hydrogen 3.051 N/A GLN 514.A N GLU 510.A O no hydrogen 2.989 N/A ILE 515.A N SER 511.A O no hydrogen 2.875 N/A ALA 516.A N LEU 512.A O no hydrogen 2.962 N/A ARG 517.A N GLN 513.A O no hydrogen 2.842 N/A GLN 518.A N GLN 514.A O no hydrogen 2.839 N/A GLU 519.A N GLN 514.A O no hydrogen 3.220 N/A LEU 520.A N ILE 515.A O no hydrogen 2.917 N/A GLU 522.A N GLN 518.A O no hydrogen 3.124 N/A LEU 523.A N GLU 519.A O no hydrogen 2.702 N/A ARG 524.A N LEU 520.A O no hydrogen 2.880 N/A ARG 524.A NE GLU 565.A OE2 no hydrogen 2.918 N/A ARG 524.A NH2 GLU 565.A OE1 no hydrogen 2.899 N/A ARG 524.A NH2 GLU 565.A OE2 no hydrogen 3.447 N/A SER 525.A N PRO 521.A O no hydrogen 3.065 N/A GLN 526.A N GLU 522.A O no hydrogen 2.850 N/A ILE 527.A N LEU 523.A O no hydrogen 2.965 N/A GLU 528.A N ARG 524.A O no hydrogen 2.888 N/A ASP 529.A N SER 525.A O no hydrogen 3.020 N/A PHE 530.A N GLN 526.A O no hydrogen 2.870 N/A HIS 531.A N ILE 527.A O no hydrogen 2.762 N/A HIS 531.A NE2 ASP 551.A OD1 no hydrogen 2.741 N/A ALA 532.A N GLU 528.A O no hydrogen 3.082 N/A LEU 533.A N ASP 529.A O no hydrogen 2.912 N/A PHE 534.A N PHE 530.A O no hydrogen 2.651 N/A SER 535.A N HIS 531.A O no hydrogen 2.896 N/A SER 535.A OG HIS 531.A O no hydrogen 2.712 N/A HIS 536.A N ALA 532.A O no hydrogen 2.956 N/A GLN 537.A N LEU 533.A O no hydrogen 2.970 N/A TRP 538.A N PHE 534.A O no hydrogen 2.789 N/A TRP 538.A NE1 LYS 543.A O no hydrogen 2.787 N/A LEU 539.A N SER 535.A O no hydrogen 2.890 N/A LYS 540.A N HIS 536.A O no hydrogen 3.060 N/A GLU 541.A N GLN 537.A O no hydrogen 3.034 N/A ASN 542.A N TRP 538.A O no hydrogen 2.670 N/A ASN 542.A ND2 TRP 538.A O no hydrogen 3.669 N/A LYS 543.A N VAL 101.A O no hydrogen 2.820 N/A LYS 543.A NZ GLY 143.A O no hydrogen 2.973 N/A LYS 543.A NZ GLU 149.A OE1 no hydrogen 2.752 N/A LYS 543.A NZ GLU 149.A OE2 no hydrogen 3.401 N/A LEU 547.A N VAL 544.A O no hydrogen 3.160 N/A THR 549.A N GLY 546.A O no hydrogen 3.298 N/A THR 549.A N ASP 548.A OD1 no hydrogen 2.864 N/A ASP 551.A N LEU 547.A O no hydrogen 2.966 N/A ILE 552.A N ASP 548.A O no hydrogen 2.957 N/A ARG 553.A N THR 549.A O no hydrogen 2.945 N/A ARG 553.A NH1 ASN 368.A O no hydrogen 2.930 N/A ARG 553.A NH1 GLU 371.A OE2 no hydrogen 3.268 N/A ARG 553.A NH2 ASN 368.A O no hydrogen 3.542 N/A MET 554.A N VAL 550.A O no hydrogen 2.885 N/A GLY 555.A N ASP 551.A O no hydrogen 2.840 N/A GLY 556.A N ILE 552.A O no hydrogen 3.068 N/A LEU 557.A N ARG 553.A O no hydrogen 3.131 N/A LEU 558.A N MET 554.A O no hydrogen 2.967 N/A GLN 559.A N GLY 555.A O no hydrogen 3.004 N/A ARG 560.A N GLY 556.A O no hydrogen 2.916 N/A ARG 560.A NE ASP 440.A OD1 no hydrogen 2.824 N/A ARG 560.A NH2 ASP 440.A OD1 no hydrogen 3.364 N/A ARG 560.A NH2 ASP 440.A OD2 no hydrogen 2.917 N/A ILE 561.A N LEU 557.A O no hydrogen 3.017 N/A LYS 562.A N LEU 558.A O no hydrogen 3.060 N/A ARG 563.A N GLN 559.A O no hydrogen 2.981 N/A ALA 564.A N ARG 560.A O no hydrogen 3.096 N/A GLU 565.A N ILE 561.A O no hydrogen 3.087 N/A SER 566.A N LYS 562.A O no hydrogen 2.841 N/A SER 566.A OG LYS 562.A O no hydrogen 3.236 N/A SER 566.A OG ARG 563.A O no hydrogen 3.031 N/A ARG 567.A N ARG 563.A O no hydrogen 2.856 N/A ARG 567.A NE GLU 581.A OE2 no hydrogen 2.977 N/A ARG 567.A NH2 GLU 581.A OE1 no hydrogen 2.843 N/A ARG 567.A NH2 GLU 581.A OE2 no hydrogen 3.510 N/A ILE 568.A N ALA 564.A O no hydrogen 2.981 N/A GLU 569.A N GLU 565.A O no hydrogen 2.977 N/A VAL 570.A N SER 566.A O no hydrogen 2.924 N/A TYR 571.A N ARG 567.A O no hydrogen 3.148 N/A LEU 572.A N ILE 568.A O no hydrogen 2.860 N/A ALA 573.A N GLU 569.A O no hydrogen 2.922 N/A GLY 574.A N TYR 571.A O no hydrogen 3.110 N/A ILE 579.A N TYR 504.A OH no hydrogen 3.209 N/A GLU 581.A N GLU 581.A OE1 no hydrogen 2.539 N/A LEU 582.A N ILE 579.A O no hydrogen 2.987 N/A GLU 583.A N ASP 580.A O no hydrogen 2.940 N/A VAL 584.A N GLU 581.A O no hydrogen 3.461 N/A PHE 589.A N HIS 449.A NE2 no hydrogen 3.062 N/A PHE 592.A N THR 590.A OG1 no hydrogen 3.144 N/A TYR 593.A OH SER 428.A O no hydrogen 2.822 N/A ALA 594.A N ASP 591.A O no hydrogen 3.040 N/A LYS 596.A N TYR 593.A O no hydrogen 3.327 N/A THR 601.A N TYR 435.A OH no hydrogen 3.091 N/A THR 602.A OG1 GLY 429.A O no hydrogen 2.737 N/A ALA 603.A N ASN 431.A OD1 no hydrogen 2.949 N/A ASN 604.A ND2 TRP 331.A O no hydrogen 2.792 N/A TRP 606.A N ASN 368.A OD1 no hydrogen 2.972 N/A THR 608.A N GLN 605.A O no hydrogen 3.058 N/A THR 608.A OG1 GLN 605.A O no hydrogen 3.237 N/A ILE 609.A N GLN 605.A O no hydrogen 2.969 N/A ALA 610.A N TRP 606.A O no hydrogen 3.007 N/A SER 613.A N THR 611.A OG1 no hydrogen 2.881 N/A SER 613.A OG THR 611.A OG1 no hydrogen 3.315 N/A