Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5a0u_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 4.A N MET 1.A O no hydrogen 3.085 N/A THR 5.A OG1 GLU 311.A OE2 no hydrogen 2.684 N/A ARG 7.A NE GLU 311.A OE2 no hydrogen 2.830 N/A ARG 7.A NH1 ASP 64.A O no hydrogen 2.915 N/A ARG 7.A NH1 GLU 240.A OE1 no hydrogen 3.274 N/A ARG 7.A NH2 GLU 240.A OE2 no hydrogen 2.839 N/A MET 8.A N THR 5.A OG1 no hydrogen 2.908 N/A GLN 9.A N THR 5.A O no hydrogen 3.067 N/A GLN 9.A NE2 LEU 4.A O no hydrogen 3.355 N/A GLN 9.A NE2 THR 5.A O no hydrogen 3.691 N/A ARG 10.A N PRO 6.A O no hydrogen 3.046 N/A ARG 10.A NH1 ASP 64.A OD2 no hydrogen 3.058 N/A LEU 11.A N ARG 7.A O no hydrogen 2.984 N/A ARG 12.A N MET 8.A O no hydrogen 2.850 N/A ARG 12.A NE VAL 371.A O no hydrogen 2.743 N/A ARG 12.A NH1 ASP 760.A OD2 no hydrogen 3.107 N/A ARG 12.A NH2 VAL 371.A O no hydrogen 3.397 N/A ARG 12.A NH2 LYS 372.A O no hydrogen 2.910 N/A ARG 12.A NH2 ASP 760.A OD1 no hydrogen 2.931 N/A ARG 12.A NH2 ASP 760.A OD2 no hydrogen 3.342 N/A ASN 13.A N GLN 9.A O no hydrogen 2.649 N/A HIS 14.A N ARG 10.A O no hydrogen 2.940 N/A HIS 14.A NE2 GLN 62.A OE1 no hydrogen 2.848 N/A TYR 15.A N LEU 11.A O no hydrogen 3.104 N/A TYR 15.A OH ALA 321.A O no hydrogen 2.657 N/A LEU 16.A N ARG 12.A O no hydrogen 3.030 N/A THR 17.A N HIS 14.A O no hydrogen 2.829 N/A THR 17.A OG1 HIS 14.A O no hydrogen 2.938 N/A VAL 18.A N TYR 15.A O no hydrogen 3.111 N/A SER 21.A N ARG 76.A O no hydrogen 3.208 N/A VAL 22.A N GLU 105.A O no hydrogen 3.055 N/A SER 23.A N GLY 78.A O no hydrogen 2.895 N/A SER 23.A OG GLY 78.A O no hydrogen 2.795 N/A ARG 26.A NE ILE 275.A O no hydrogen 2.968 N/A ARG 26.A NE GLU 276.A O no hydrogen 3.392 N/A ARG 26.A NH1 ASP 83.A OD1 no hydrogen 3.018 N/A ARG 26.A NH2 ASP 83.A OD1 no hydrogen 3.521 N/A ARG 26.A NH2 ASP 83.A OD2 no hydrogen 2.958 N/A ARG 26.A NH2 GLU 276.A O no hydrogen 2.821 N/A LEU 28.A N ILE 24.A O no hydrogen 3.037 N/A ALA 29.A N TYR 25.A O no hydrogen 3.104 N/A PHE 30.A N ARG 26.A O no hydrogen 2.825 N/A THR 31.A N ALA 27.A O no hydrogen 2.950 N/A THR 31.A OG1 ALA 27.A O no hydrogen 2.677 N/A GLU 32.A N LEU 28.A O no hydrogen 2.858 N/A VAL 33.A N ALA 29.A O no hydrogen 3.057 N/A VAL 34.A N PHE 30.A O no hydrogen 2.879 N/A LYS 35.A N THR 31.A O no hydrogen 3.037 N/A ALA 36.A N GLU 32.A O no hydrogen 3.053 N/A ASN 37.A N VAL 34.A O no hydrogen 3.141 N/A ASN 37.A ND2 VAL 33.A O no hydrogen 3.001 N/A MET 40.A N ASN 37.A O no hydrogen 3.211 N/A LEU 45.A N PRO 41.A O no hydrogen 2.944 N/A ARG 46.A N THR 42.A O no hydrogen 2.937 N/A ARG 46.A NE PRO 522.A O no hydrogen 3.485 N/A ARG 46.A NH1 ASP 83.A OD2 no hydrogen 3.251 N/A ARG 46.A NH1 GLU 277.A OE1 no hydrogen 2.918 N/A ARG 46.A NH2 GLU 277.A OE1 no hydrogen 2.537 N/A ARG 46.A NH2 PRO 522.A O no hydrogen 3.212 N/A ALA 47.A N ILE 43.A O no hydrogen 3.059 N/A LYS 48.A N LEU 44.A O no hydrogen 3.078 N/A ALA 49.A N LEU 45.A O no hydrogen 2.928 N/A PHE 50.A N ARG 46.A O no hydrogen 2.884 N/A ARG 51.A N ALA 47.A O no hydrogen 2.964 N/A ARG 51.A NE GLU 55.A OE2 no hydrogen 2.808 N/A ARG 51.A NH1 GLU 209.A OE1 no hydrogen 2.713 N/A HIS 52.A N LYS 48.A O no hydrogen 2.993 N/A ALA 53.A N ALA 49.A O no hydrogen 3.014 N/A CYS 54.A N PHE 50.A O no hydrogen 2.841 N/A CYS 54.A SG PHE 50.A O no hydrogen 3.318 N/A GLU 55.A N ARG 51.A O no hydrogen 2.893 N/A THR 56.A N HIS 52.A O no hydrogen 2.981 N/A THR 56.A OG1 HIS 52.A O no hydrogen 2.865 N/A GLN 62.A N GLU 65.A OE1 no hydrogen 2.907 N/A GLN 62.A NE2 GLU 65.A OE2 no hydrogen 3.350 N/A GLU 65.A N GLN 62.A O no hydrogen 3.355 N/A VAL 68.A N GLN 264.A OE1 no hydrogen 2.870 N/A CYS 72.A SG ALA 77.A O no hydrogen 3.326 N/A GLY 73.A N HIS 70.A O no hydrogen 2.885 N/A ARG 76.A N GLU 322.A O no hydrogen 2.989 N/A ARG 76.A NH1 GLU 774.A OE2 no hydrogen 2.946 N/A ARG 76.A NH2 TYR 374.A OH no hydrogen 3.086 N/A ARG 76.A NH2 GLU 774.A OE1 no hydrogen 3.223 N/A GLY 78.A N SER 21.A O no hydrogen 2.966 N/A PHE 80.A N SER 23.A O no hydrogen 3.043 N/A SER 81.A OG ALA 79.A O no hydrogen 2.999 N/A ASP 83.A N ASP 83.A OD1 no hydrogen 2.473 N/A ILE 84.A N SER 81.A O no hydrogen 2.926 N/A ALA 85.A N SER 81.A O no hydrogen 3.013 N/A TRP 86.A NE1 GLU 129.A OE1 no hydrogen 3.071 N/A ARG 87.A NH2 GLU 132.A OE1 no hydrogen 2.659 N/A ARG 90.A N TRP 86.A O no hydrogen 2.982 N/A ARG 90.A NE ASP 91.A OD1 no hydrogen 2.769 N/A ARG 90.A NH2 ASP 91.A OD1 no hydrogen 3.302 N/A ASP 91.A N ARG 87.A O no hydrogen 2.952 N/A GLU 92.A N TRP 88.A O no hydrogen 2.881 N/A LEU 93.A N ARG 90.A O no hydrogen 3.416 N/A THR 95.A N GLU 92.A O no hydrogen 3.153 N/A THR 95.A OG1 GLU 92.A O no hydrogen 3.506 N/A MET 96.A N GLU 92.A O no hydrogen 2.769 N/A THR 98.A N THR 95.A O no hydrogen 2.856 N/A ARG 99.A N THR 95.A O no hydrogen 3.011 N/A ARG 99.A NE GLN 101.A O no hydrogen 3.269 N/A ARG 99.A NE ASP 102.A O no hydrogen 2.968 N/A ARG 99.A NH1 GLU 92.A OE1 no hydrogen 2.938 N/A ARG 99.A NH1 SER 327.A O no hydrogen 2.950 N/A ARG 99.A NH2 GLN 101.A O no hydrogen 3.452 N/A ARG 99.A NH2 ASP 102.A O no hydrogen 2.810 N/A ARG 99.A NH2 SER 327.A O no hydrogen 2.790 N/A GLN 101.A NE2 ASP 102.A OD1 no hydrogen 2.951 N/A GLN 101.A NE2 GLU 774.A O no hydrogen 2.858 N/A PHE 104.A N MET 96.A O no hydrogen 3.201 N/A GLU 105.A N PRO 20.A O no hydrogen 2.983 N/A ASP 110.A N SER 107.A OG no hydrogen 2.728 N/A LYS 111.A N SER 107.A O no hydrogen 2.970 N/A LYS 111.A NZ ASP 94.A OD1 no hydrogen 3.033 N/A LYS 111.A NZ GLU 108.A OE2 no hydrogen 3.018 N/A LYS 112.A N GLU 108.A O no hydrogen 3.193 N/A THR 113.A N ALA 109.A O no hydrogen 2.930 N/A THR 113.A OG1 ALA 109.A O no hydrogen 3.334 N/A ILE 114.A N ASP 110.A O no hydrogen 2.824 N/A ARG 115.A N LYS 111.A O no hydrogen 3.058 N/A ARG 115.A NH2 ASP 94.A OD2 no hydrogen 2.935 N/A GLU 116.A N LYS 112.A O no hydrogen 2.963 N/A GLU 117.A N THR 113.A O no hydrogen 2.901 N/A ILE 118.A N ILE 114.A O no hydrogen 3.356 N/A VAL 119.A N ILE 114.A O no hydrogen 2.947 N/A TRP 122.A N ILE 118.A O no hydrogen 3.074 N/A TRP 122.A NE1 THR 31.A OG1 no hydrogen 2.924 N/A GLU 123.A N VAL 119.A O no hydrogen 2.872 N/A GLY 124.A N GLU 129.A OE2 no hydrogen 2.621 N/A ARG 125.A N TRP 122.A O no hydrogen 2.627 N/A ARG 125.A NE PHE 121.A O no hydrogen 3.020 N/A ARG 125.A NH2 PHE 121.A O no hydrogen 3.256 N/A SER 126.A N GLU 129.A OE1 no hydrogen 2.968 N/A SER 126.A OG GLU 129.A OE1 no hydrogen 2.576 N/A LEU 127.A N ASP 83.A O no hydrogen 2.945 N/A ASP 128.A N ILE 84.A O no hydrogen 2.877 N/A GLU 129.A N SER 126.A OG no hydrogen 3.244 N/A ILE 130.A N SER 126.A O no hydrogen 3.056 N/A CYS 131.A N LEU 127.A O no hydrogen 2.732 N/A GLU 132.A N ASP 128.A O no hydrogen 2.993 N/A ALA 133.A N GLU 129.A O no hydrogen 3.001 N/A GLN 134.A N ILE 130.A O no hydrogen 3.379 N/A TYR 135.A N CYS 131.A O no hydrogen 2.995 N/A TYR 135.A OH LEU 152.A O no hydrogen 2.947 N/A ARG 136.A N GLU 132.A O no hydrogen 2.879 N/A ARG 136.A NE GLU 132.A OE2 no hydrogen 3.068 N/A ARG 136.A NH2 GLU 132.A OE2 no hydrogen 3.404 N/A GLU 137.A N ALA 133.A O no hydrogen 3.110 N/A ALA 138.A N GLN 134.A O no hydrogen 3.155 N/A GLY 139.A N ARG 136.A O no hydrogen 2.994 N/A VAL 140.A N TYR 135.A O no hydrogen 3.086 N/A SER 144.A N TRP 141.A O no hydrogen 3.223 N/A SER 144.A OG VAL 140.A O no hydrogen 3.349 N/A GLY 145.A N TRP 141.A O no hydrogen 2.723 N/A GLU 146.A N TRP 141.A O no hydrogen 3.287 N/A THR 147.A N ALA 142.A O no hydrogen 2.950 N/A THR 147.A OG1 ALA 142.A O no hydrogen 2.907 N/A THR 147.A OG1 PHE 143.A O no hydrogen 3.474 N/A VAL 149.A N PHE 143.A O no hydrogen 2.878 N/A SER 150.A OG SER 506.A OG no hydrogen 2.700 N/A ASP 151.A N TYR 452.A O no hydrogen 2.998 N/A SER 153.A N ASP 151.A OD1 no hydrogen 2.831 N/A SER 153.A OG ASP 151.A OD1 no hydrogen 2.413 N/A SER 153.A OG ASP 151.A OD2 no hydrogen 3.321 N/A TYR 154.A OH ASP 162.A OD1 no hydrogen 2.458 N/A HIS 155.A ND1 SER 449.A O no hydrogen 2.801 N/A HIS 155.A NE2 GLY 160.A O no hydrogen 2.764 N/A GLN 156.A N SER 153.A O no hydrogen 2.761 N/A ILE 157.A N SER 153.A O no hydrogen 2.996 N/A GLY 159.A N ASN 278.A O no hydrogen 2.955 N/A GLY 160.A N GLU 277.A OE2 no hydrogen 2.880 N/A ASP 162.A N THR 280.A O no hydrogen 3.083 N/A THR 163.A OG1 GLY 161.A O no hydrogen 2.828 N/A CYS 164.A SG LEU 432.A O no hydrogen 3.683 N/A GLY 166.A N LEU 529.A O no hydrogen 2.834 N/A TYR 167.A N PRO 165.A O no hydrogen 2.822 N/A TYR 167.A OH GLU 270.A OE1 no hydrogen 2.726 N/A LEU 170.A N GLY 166.A O no hydrogen 2.934 N/A LEU 171.A N GLY 166.A O no hydrogen 3.040 N/A PHE 172.A N TYR 167.A O no hydrogen 3.130 N/A THR 173.A OG1 VAL 169.A O no hydrogen 2.859 N/A THR 173.A OG1 LEU 170.A O no hydrogen 3.223 N/A LYS 174.A N LEU 170.A O no hydrogen 3.038 N/A LYS 174.A NZ ASP 182.A OD2 no hydrogen 2.535 N/A GLY 175.A N LEU 171.A O no hydrogen 2.870 N/A MET 176.A N PRO 252.A O no hydrogen 2.922 N/A ASN 177.A N ALA 253.A O no hydrogen 2.973 N/A GLY 178.A N LYS 174.A O no hydrogen 3.236 N/A ILE 179.A N GLY 175.A O no hydrogen 3.255 N/A LYS 180.A N MET 176.A O no hydrogen 2.882 N/A LYS 180.A NZ GLU 212.A OE2 no hydrogen 2.842 N/A ALA 181.A N ASN 177.A O no hydrogen 2.942 N/A ASP 182.A N GLY 178.A O no hydrogen 2.975 N/A ALA 183.A N ILE 179.A O no hydrogen 3.167 N/A GLU 184.A N LYS 180.A O no hydrogen 2.955 N/A ALA 185.A N ALA 181.A O no hydrogen 2.814 N/A HIS 186.A N ASP 182.A O no hydrogen 2.923 N/A HIS 186.A ND1 ASP 182.A O no hydrogen 3.163 N/A LEU 187.A N ALA 183.A O no hydrogen 2.793 N/A ALA 188.A N GLU 184.A O no hydrogen 2.978 N/A SER 189.A N HIS 186.A O no hydrogen 2.980 N/A SER 189.A OG HIS 186.A O no hydrogen 2.757 N/A LEU 190.A N LEU 187.A O no hydrogen 3.198 N/A SER 191.A N ASP 197.A OD2 no hydrogen 2.893 N/A ASN 194.A N SER 191.A O no hydrogen 3.006 N/A ASP 197.A N ASN 194.A O no hydrogen 3.072 N/A ILE 198.A N PRO 195.A O no hydrogen 3.438 N/A ILE 201.A N ASP 197.A O no hydrogen 3.011 N/A TYR 202.A N ILE 198.A O no hydrogen 3.218 N/A TYR 203.A N ASP 199.A O no hydrogen 3.112 N/A TYR 204.A N ARG 200.A O no hydrogen 2.779 N/A TYR 204.A OH MET 534.A O no hydrogen 2.619 N/A LYS 205.A N ILE 201.A O no hydrogen 3.035 N/A ALA 206.A N TYR 202.A O no hydrogen 2.914 N/A ALA 207.A N TYR 203.A O no hydrogen 2.905 N/A ILE 208.A N TYR 204.A O no hydrogen 3.138 N/A GLU 209.A N LYS 205.A O no hydrogen 3.153 N/A THR 210.A N ALA 206.A O no hydrogen 3.141 N/A CYS 211.A N ALA 207.A O no hydrogen 3.080 N/A CYS 211.A SG MET 176.A O no hydrogen 3.488 N/A CYS 211.A SG ALA 207.A O no hydrogen 3.462 N/A GLU 212.A N ILE 208.A O no hydrogen 3.081 N/A GLY 213.A N GLU 209.A O no hydrogen 2.961 N/A VAL 214.A N THR 210.A O no hydrogen 3.053 N/A VAL 215.A N CYS 211.A O no hydrogen 3.096 N/A ASN 216.A N GLU 212.A O no hydrogen 2.794 N/A ASN 216.A ND2 GLU 55.A OE2 no hydrogen 2.916 N/A TYR 217.A N GLY 213.A O no hydrogen 3.077 N/A ALA 218.A N VAL 214.A O no hydrogen 3.050 N/A ARG 219.A N VAL 215.A O no hydrogen 3.013 N/A ARG 219.A NH2 GLU 249.A O no hydrogen 3.074 N/A ARG 220.A N ASN 216.A O no hydrogen 2.970 N/A ARG 220.A NH1 ALA 57.A O no hydrogen 3.216 N/A ARG 220.A NH2 CYS 54.A O no hydrogen 2.934 N/A ARG 220.A NH2 ALA 57.A O no hydrogen 2.454 N/A ILE 221.A N TYR 217.A O no hydrogen 3.021 N/A ALA 222.A N ALA 218.A O no hydrogen 3.177 N/A ALA 223.A N ARG 219.A O no hydrogen 2.991 N/A HIS 224.A N ARG 220.A O no hydrogen 3.264 N/A ALA 225.A N ILE 221.A O no hydrogen 3.008 N/A ARG 226.A N ALA 222.A O no hydrogen 2.957 N/A GLU 227.A N ALA 223.A O no hydrogen 3.202 N/A LEU 228.A N HIS 224.A O no hydrogen 2.945 N/A ALA 229.A N ALA 225.A O no hydrogen 2.821 N/A ALA 230.A N ARG 226.A O no hydrogen 3.103 N/A LYS 231.A N LEU 228.A O no hydrogen 2.877 N/A GLU 232.A N LEU 228.A O no hydrogen 2.993 N/A ASN 234.A N GLU 232.A OE2 no hydrogen 2.986 N/A ARG 237.A N ASN 234.A OD1 no hydrogen 2.873 N/A ARG 237.A NH1 GLU 65.A O no hydrogen 2.823 N/A ARG 237.A NH1 GLU 240.A OE1 no hydrogen 2.997 N/A ARG 237.A NH2 GLU 65.A O no hydrogen 3.075 N/A ARG 238.A N ASN 234.A O no hydrogen 3.075 N/A ALA 239.A N ALA 235.A O no hydrogen 3.141 N/A GLU 240.A N GLN 236.A O no hydrogen 3.103 N/A LEU 241.A N ARG 237.A O no hydrogen 2.934 N/A LEU 242.A N ARG 238.A O no hydrogen 3.069 N/A THR 243.A N ALA 239.A O no hydrogen 3.032 N/A THR 243.A OG1 ALA 239.A O no hydrogen 3.108 N/A ILE 244.A N GLU 240.A O no hydrogen 2.854 N/A ALA 245.A N LEU 241.A O no hydrogen 2.964 N/A GLU 246.A N LEU 242.A O no hydrogen 3.155 N/A VAL 247.A N THR 243.A O no hydrogen 2.871 N/A ASN 248.A N ILE 244.A O no hydrogen 3.165 N/A ASN 248.A ND2 ILE 244.A O no hydrogen 3.031 N/A ASN 248.A ND2 GLN 264.A OE1 no hydrogen 3.514 N/A GLU 249.A N ALA 245.A O no hydrogen 3.056 N/A ASN 250.A N GLU 246.A O no hydrogen 3.036 N/A ASN 250.A ND2 GLU 261.A OE2 no hydrogen 3.198 N/A VAL 251.A N VAL 247.A O no hydrogen 2.795 N/A ASN 254.A N ASN 250.A O no hydrogen 2.758 N/A ASN 254.A ND2 ASN 250.A O no hydrogen 3.064 N/A LYS 257.A N GLU 261.A OE1 no hydrogen 2.763 N/A LEU 259.A N ASP 298.A OD2 no hydrogen 2.680 N/A GLN 260.A NE2 LEU 66.A O no hydrogen 3.528 N/A GLU 261.A N THR 258.A OG1 no hydrogen 3.052 N/A ALA 262.A N THR 258.A O no hydrogen 2.925 N/A LEU 263.A N LEU 259.A O no hydrogen 2.936 N/A GLN 264.A N GLN 260.A O no hydrogen 2.948 N/A GLN 264.A NE2 VAL 68.A O no hydrogen 3.114 N/A GLN 264.A NE2 GLN 264.A O no hydrogen 3.163 N/A GLN 264.A NE2 THR 268.A OG1 no hydrogen 3.086 N/A SER 265.A N GLU 261.A O no hydrogen 2.847 N/A ILE 266.A N ALA 262.A O no hydrogen 2.991 N/A TRP 267.A N LEU 263.A O no hydrogen 2.953 N/A TRP 267.A NE1 GLY 69.A O no hydrogen 2.784 N/A THR 268.A N GLN 264.A O no hydrogen 2.944 N/A THR 268.A OG1 GLN 264.A O no hydrogen 3.058 N/A VAL 269.A N SER 265.A O no hydrogen 3.255 N/A GLU 270.A N ILE 266.A O no hydrogen 2.883 N/A SER 271.A N TRP 267.A O no hydrogen 2.800 N/A SER 271.A OG TRP 267.A O no hydrogen 3.258 N/A SER 271.A OG THR 268.A O no hydrogen 2.898 N/A LEU 272.A N THR 268.A O no hydrogen 3.160 N/A LEU 272.A N VAL 269.A O no hydrogen 2.945 N/A PHE 273.A N VAL 269.A O no hydrogen 3.199 N/A PHE 273.A N GLU 270.A O no hydrogen 3.323 N/A GLU 276.A N LEU 272.A O no hydrogen 2.897 N/A GLU 277.A N PHE 273.A O no hydrogen 3.077 N/A ASN 278.A N SER 81.A OG no hydrogen 2.926 N/A ASN 278.A ND2 MET 326.A O no hydrogen 3.056 N/A GLN 279.A N GLU 274.A OE1 no hydrogen 3.100 N/A THR 280.A OG1 GLN 339.A O no hydrogen 2.982 N/A GLY 281.A N PRO 340.A O no hydrogen 2.867 N/A SER 283.A N THR 163.A O no hydrogen 3.239 N/A SER 283.A OG GLY 281.A O no hydrogen 2.832 N/A SER 283.A OG PHE 341.A O no hydrogen 3.198 N/A LEU 284.A N ASN 343.A O no hydrogen 2.771 N/A ARG 286.A NH1 GLN 349.A O no hydrogen 2.827 N/A ARG 286.A NH1 ASP 429.A OD1 no hydrogen 2.901 N/A ARG 286.A NH2 GLY 347.A O no hydrogen 2.897 N/A ARG 286.A NH2 GLN 349.A O no hydrogen 2.774 N/A VAL 287.A N GLY 285.A O no hydrogen 3.079 N/A GLN 289.A N ARG 286.A O no hydrogen 2.981 N/A TYR 290.A N ARG 286.A O no hydrogen 3.310 N/A TYR 290.A OH LEU 284.A O no hydrogen 2.624 N/A TYR 292.A N GLN 289.A O no hydrogen 3.084 N/A PHE 295.A N CYS 291.A O no hydrogen 3.267 N/A GLU 296.A N TYR 292.A O no hydrogen 2.819 N/A ALA 297.A N PRO 293.A O no hydrogen 3.174 N/A ASP 298.A N MET 294.A O no hydrogen 2.969 N/A ILE 299.A N PHE 295.A O no hydrogen 2.938 N/A ARG 300.A N GLU 296.A O no hydrogen 3.154 N/A ARG 300.A NE GLU 296.A OE2 no hydrogen 3.293 N/A ARG 300.A NH1 GLU 301.A OE2 no hydrogen 2.958 N/A ARG 300.A NH2 GLU 296.A OE1 no hydrogen 2.899 N/A GLU 301.A N ALA 297.A O no hydrogen 2.887 N/A GLY 302.A N ILE 299.A O no hydrogen 3.305 N/A LEU 304.A N ASP 298.A O no hydrogen 3.053 N/A THR 305.A N THR 308.A OG1 no hydrogen 2.710 N/A THR 305.A OG1 THR 308.A OG1 no hydrogen 2.893 N/A THR 308.A N THR 305.A OG1 no hydrogen 3.107 N/A THR 308.A OG1 THR 305.A O no hydrogen 3.245 N/A THR 308.A OG1 THR 305.A OG1 no hydrogen 2.893 N/A ALA 309.A N THR 305.A O no hydrogen 2.853 N/A LEU 310.A N HIS 306.A O no hydrogen 2.928 N/A GLU 311.A N ASP 307.A O no hydrogen 3.124 N/A LEU 312.A N THR 308.A O no hydrogen 3.124 N/A LEU 313.A N ALA 309.A O no hydrogen 2.994 N/A GLN 314.A N LEU 310.A O no hydrogen 2.988 N/A GLN 314.A NE2 GLY 3.A O no hydrogen 3.496 N/A ALA 315.A N GLU 311.A O no hydrogen 3.014 N/A PHE 316.A N LEU 312.A O no hydrogen 3.053 N/A ILE 317.A N LEU 313.A O no hydrogen 2.990 N/A ILE 318.A N GLN 314.A O no hydrogen 3.074 N/A LYS 319.A N ALA 315.A O no hydrogen 3.132 N/A LYS 319.A NZ GLU 65.A OE2 no hydrogen 2.771 N/A LYS 319.A NZ GLY 69.A O no hydrogen 3.121 N/A LYS 319.A NZ GLU 322.A OE1 no hydrogen 2.758 N/A LYS 319.A NZ GLU 322.A OE2 no hydrogen 3.531 N/A CYS 320.A N PHE 316.A O no hydrogen 2.865 N/A CYS 320.A SG PHE 316.A O no hydrogen 3.590 N/A ALA 321.A N ILE 317.A O no hydrogen 3.165 N/A GLU 322.A N LYS 319.A O no hydrogen 2.959 N/A LEU 323.A N CYS 320.A O no hydrogen 3.022 N/A MET 326.A N ASN 278.A OD1 no hydrogen 2.958 N/A GLU 329.A N GLU 92.A OE2 no hydrogen 2.831 N/A GLY 331.A N SER 328.A OG no hydrogen 3.038 N/A ALA 332.A N SER 328.A O no hydrogen 2.830 N/A LYS 333.A N LEU 330.A O no hydrogen 3.237 N/A TYR 334.A N GLY 331.A O no hydrogen 2.915 N/A PHE 335.A N ALA 332.A O no hydrogen 3.009 N/A ALA 336.A N SER 647.A OG no hydrogen 2.800 N/A GLY 337.A N ASP 102.A OD1 no hydrogen 3.137 N/A TYR 338.A N ASP 102.A OD1 no hydrogen 3.049 N/A TYR 338.A N ASP 102.A OD2 no hydrogen 3.184 N/A TYR 338.A OH PRO 103.A O no hydrogen 2.529 N/A GLN 339.A NE2 GLY 337.A O no hydrogen 3.086 N/A GLN 339.A NE2 SER 769.A O no hydrogen 2.938 N/A ASN 343.A N SER 283.A OG no hydrogen 3.020 N/A ASN 343.A ND2 GLY 434.A O no hydrogen 3.207 N/A LEU 344.A N SER 377.A O no hydrogen 2.919 N/A THR 345.A N GLY 285.A O no hydrogen 2.924 N/A THR 345.A OG1 ASN 343.A OD1 no hydrogen 3.076 N/A VAL 346.A N ALA 379.A O no hydrogen 2.826 N/A GLY 347.A N ASP 288.A OD2 no hydrogen 2.678 N/A GLN 349.A NE2 ASP 410.A OD2 no hydrogen 3.183 N/A LYS 350.A N GLY 354.A O no hydrogen 2.929 N/A ARG 351.A NH1 ASP 426.A OD1 no hydrogen 2.783 N/A ARG 351.A NH1 ASP 429.A OD2 no hydrogen 2.931 N/A ARG 351.A NH2 ASP 426.A OD1 no hydrogen 3.325 N/A GLY 353.A N LYS 350.A O no hydrogen 3.132 N/A ALA 356.A N GLY 348.A O no hydrogen 2.911 N/A CYS 357.A N ASP 355.A OD2 no hydrogen 2.878 N/A CYS 357.A SG ASP 355.A OD1 no hydrogen 3.689 N/A ASN 358.A N THR 361.A OG1 no hydrogen 3.025 N/A ASN 358.A ND2 ASP 288.A O no hydrogen 3.168 N/A THR 361.A N ASN 358.A OD1 no hydrogen 2.851 N/A THR 361.A OG1 ASP 288.A OD2 no hydrogen 2.665 N/A THR 361.A OG1 ASN 358.A OD1 no hydrogen 3.308 N/A TYR 362.A N ASN 358.A O no hydrogen 3.302 N/A LEU 363.A N ASP 359.A O no hydrogen 2.949 N/A ILE 364.A N LEU 360.A O no hydrogen 2.848 N/A MET 365.A N THR 361.A O no hydrogen 3.187 N/A ASP 366.A N TYR 362.A O no hydrogen 2.902 N/A ALA 367.A N LEU 363.A O no hydrogen 2.778 N/A VAL 368.A N ILE 364.A O no hydrogen 2.988 N/A ARG 369.A N MET 365.A O no hydrogen 3.035 N/A ARG 369.A NE ASP 366.A OD1 no hydrogen 2.905 N/A ARG 369.A NH2 ASP 366.A OD1 no hydrogen 3.147 N/A PHE 370.A N ASP 366.A O no hydrogen 2.774 N/A PHE 370.A N ALA 367.A O no hydrogen 3.292 N/A VAL 371.A N ALA 367.A O no hydrogen 2.979 N/A LYS 372.A N VAL 368.A O no hydrogen 3.233 N/A TYR 374.A OH TYR 338.A O no hydrogen 2.445 N/A GLN 375.A NE2 GLN 339.A OE1 no hydrogen 3.363 N/A SER 377.A N ILE 342.A O no hydrogen 2.947 N/A ALA 379.A N LEU 344.A O no hydrogen 2.931 N/A CYS 380.A N ALA 406.A O no hydrogen 2.901 N/A ARG 381.A N VAL 346.A O no hydrogen 3.085 N/A ARG 381.A NE ASP 410.A OD1 no hydrogen 2.823 N/A ARG 381.A NH1 ARG 428.A O no hydrogen 2.946 N/A ARG 381.A NH1 TYR 430.A O no hydrogen 2.965 N/A ARG 381.A NH2 ASP 410.A OD1 no hydrogen 3.322 N/A ARG 381.A NH2 ASP 410.A OD2 no hydrogen 2.856 N/A ARG 381.A NH2 ARG 428.A O no hydrogen 2.853 N/A ILE 382.A N HIS 408.A O no hydrogen 2.811 N/A HIS 383.A N SER 386.A OG no hydrogen 2.952 N/A SER 386.A N HIS 383.A O no hydrogen 3.145 N/A SER 386.A OG HIS 383.A ND1 no hydrogen 3.018 N/A SER 386.A OG HIS 383.A O no hydrogen 3.264 N/A TYR 390.A OH VAL 346.A O no hydrogen 3.361 N/A TYR 390.A OH ARG 381.A O no hydrogen 2.746 N/A MET 391.A N PRO 387.A O no hydrogen 3.095 N/A GLU 392.A N GLN 388.A O no hydrogen 2.858 N/A LYS 393.A N LYS 389.A O no hydrogen 3.135 N/A LYS 393.A N TYR 390.A O no hydrogen 3.107 N/A LYS 393.A NZ ASP 366.A OD1 no hydrogen 2.487 N/A LYS 393.A NZ ASP 366.A OD2 no hydrogen 3.202 N/A ILE 394.A N TYR 390.A O no hydrogen 2.978 N/A VAL 395.A N MET 391.A O no hydrogen 3.326 N/A ASP 396.A N GLU 392.A O no hydrogen 3.151 N/A VAL 397.A N LYS 393.A O no hydrogen 2.889 N/A VAL 398.A N ILE 394.A O no hydrogen 2.901 N/A LYS 399.A N VAL 395.A O no hydrogen 2.829 N/A LYS 399.A NZ LEU 714.A O no hydrogen 3.514 N/A ALA 400.A N VAL 397.A O no hydrogen 3.036 N/A GLY 401.A N VAL 398.A O no hydrogen 3.004 N/A ALA 406.A N LEU 378.A O no hydrogen 2.866 N/A CYS 407.A N MET 738.A O no hydrogen 2.794 N/A CYS 407.A SG PRO 405.A O no hydrogen 3.771 N/A HIS 408.A N CYS 380.A O no hydrogen 3.122 N/A PHE 409.A N GLY 736.A O no hydrogen 3.050 N/A ASP 410.A N ILE 382.A O no hydrogen 2.709 N/A SER 412.A OG GLY 734.A O no hydrogen 2.965 N/A SER 412.A OG ASN 735.A O no hydrogen 2.571 N/A HIS 413.A N PHE 409.A O no hydrogen 3.273 N/A HIS 413.A NE2 GLY 736.A O no hydrogen 2.948 N/A ILE 414.A N ASP 410.A O no hydrogen 2.680 N/A LYS 415.A N ASP 411.A O no hydrogen 3.150 N/A MET 416.A N SER 412.A O no hydrogen 2.945 N/A MET 417.A N HIS 413.A O no hydrogen 2.929 N/A LEU 418.A N ILE 414.A O no hydrogen 2.903 N/A ARG 419.A N LYS 415.A O no hydrogen 3.062 N/A ARG 419.A NH1 ARG 419.A O no hydrogen 3.216 N/A LYS 420.A N MET 417.A O no hydrogen 3.112 N/A LYS 420.A NZ GLN 446.A OE1 no hydrogen 3.277 N/A LYS 420.A NZ ASN 700.A O no hydrogen 2.874 N/A LYS 420.A NZ ASN 700.A OD1 no hydrogen 2.534 N/A GLY 421.A N LEU 418.A O no hydrogen 3.083 N/A PHE 422.A N MET 417.A O no hydrogen 3.406 N/A PHE 424.A N ASP 423.A OD1 no hydrogen 2.719 N/A ALA 427.A N ASP 423.A O no hydrogen 3.048 N/A ARG 428.A N PHE 424.A O no hydrogen 2.738 N/A ARG 428.A NE ARG 351.A O no hydrogen 2.778 N/A ASP 429.A N ASP 426.A O no hydrogen 3.154 N/A TYR 430.A OH ASP 410.A OD1 no hydrogen 2.739 N/A CYS 431.A N GLN 439.A O no hydrogen 2.839 N/A CYS 431.A SG GLN 439.A O no hydrogen 3.880 N/A LEU 432.A N THR 345.A OG1 no hydrogen 3.021 N/A MET 433.A N GLU 437.A O no hydrogen 2.818 N/A GLY 434.A N SER 283.A OG no hydrogen 3.145 N/A CYS 435.A SG ALA 766.A O no hydrogen 3.581 N/A VAL 436.A N GLU 437.A OE2 no hydrogen 2.898 N/A GLU 437.A N MET 433.A O no hydrogen 3.047 N/A GLN 439.A N CYS 431.A O no hydrogen 2.901 N/A LYS 440.A NZ ASP 168.A OD2 no hydrogen 2.493 N/A LYS 440.A NZ SER 441.A O no hydrogen 3.086 N/A LYS 440.A NZ SER 441.A OG no hydrogen 2.835 N/A SER 441.A OG ASP 168.A OD1 no hydrogen 2.838 N/A SER 441.A OG ASP 168.A OD2 no hydrogen 3.258 N/A GLY 442.A N CYS 164.A O no hydrogen 3.071 N/A ARG 443.A N LYS 440.A O no hydrogen 3.012 N/A ARG 443.A NE GLU 531.A OE1 no hydrogen 2.887 N/A ARG 443.A NH1 ASP 426.A OD1 no hydrogen 3.040 N/A ARG 443.A NH2 GLU 531.A OE1 no hydrogen 3.500 N/A TYR 445.A N VAL 547.A O no hydrogen 3.027 N/A TRP 447.A NE1 TYR 445.A OH no hydrogen 2.933 N/A THR 448.A N ASP 162.A OD2 no hydrogen 2.994 N/A THR 448.A OG1 GLU 437.A OE1 no hydrogen 2.569 N/A SER 449.A OG GLY 451.A O no hydrogen 3.183 N/A THR 450.A OG1 SER 513.A OG no hydrogen 2.962 N/A TYR 452.A N ASP 151.A O no hydrogen 2.926 N/A THR 453.A N ILE 554.A O no hydrogen 2.817 N/A THR 453.A OG1 VAL 149.A O no hydrogen 2.884 N/A TRP 455.A N SER 556.A O no hydrogen 3.195 N/A TRP 455.A NE1 THR 625.A OG1 no hydrogen 2.838 N/A ALA 458.A N TRP 455.A O no hydrogen 3.044 N/A ILE 459.A N PRO 456.A O no hydrogen 2.950 N/A GLU 460.A N PRO 456.A O no hydrogen 3.338 N/A PHE 461.A N ILE 457.A O no hydrogen 2.887 N/A VAL 462.A N ALA 458.A O no hydrogen 3.251 N/A LEU 463.A N ILE 459.A O no hydrogen 3.156 N/A ASN 464.A N GLU 460.A O no hydrogen 2.999 N/A ARG 465.A N VAL 462.A O no hydrogen 3.093 N/A GLY 466.A N PHE 461.A O no hydrogen 2.562 N/A ARG 467.A N ASN 464.A O no hydrogen 3.255 N/A ARG 467.A NH1 ASP 472.A OD1 no hydrogen 2.800 N/A MET 468.A N SER 473.A O no hydrogen 2.935 N/A VAL 469.A N GLU 460.A OE2 no hydrogen 3.179 N/A PHE 471.A N MET 468.A O no hydrogen 3.310 N/A ASP 472.A N VAL 469.A O no hydrogen 2.926 N/A SER 473.A N MET 468.A O no hydrogen 3.321 N/A GLN 475.A NE2 SER 473.A OG no hydrogen 2.876 N/A GLY 476.A N GLY 466.A O no hydrogen 2.874 N/A LEU 477.A N GLN 498.A OE1 no hydrogen 2.680 N/A GLY 480.A N ASP 478.A OD1 no hydrogen 2.914 N/A ARG 483.A N ASP 481.A OD1 no hydrogen 2.716 N/A ARG 483.A NE ASP 481.A OD1 no hydrogen 2.736 N/A ARG 483.A NE ASP 481.A OD2 no hydrogen 3.329 N/A ARG 483.A NH2 ASP 481.A OD2 no hydrogen 3.057 N/A ASP 484.A N ASP 481.A O no hydrogen 3.062 N/A LEU 485.A N LEU 482.A O no hydrogen 2.980 N/A ARG 486.A N GLU 490.A OE1 no hydrogen 2.721 N/A GLU 490.A N THR 487.A OG1 no hydrogen 3.222 N/A PHE 491.A N THR 487.A O no hydrogen 2.956 N/A ASP 492.A N PHE 488.A O no hydrogen 2.730 N/A ALA 493.A N ASP 489.A O no hydrogen 3.157 N/A ALA 494.A N GLU 490.A O no hydrogen 3.114 N/A VAL 495.A N PHE 491.A O no hydrogen 3.060 N/A LYS 496.A N ASP 492.A O no hydrogen 2.986 N/A LYS 496.A NZ ASP 492.A OD1 no hydrogen 2.774 N/A LYS 496.A NZ ASP 492.A OD2 no hydrogen 2.950 N/A LYS 496.A NZ ASP 620.A OD2 no hydrogen 2.693 N/A GLN 497.A N ALA 493.A O no hydrogen 3.040 N/A GLN 498.A N ALA 494.A O no hydrogen 3.304 N/A GLN 498.A NE2 LEU 477.A O no hydrogen 3.134 N/A ILE 499.A N VAL 495.A O no hydrogen 3.041 N/A ALA 500.A N LYS 496.A O no hydrogen 2.766 N/A HIS 501.A N GLN 497.A O no hydrogen 3.202 N/A ILE 502.A N GLN 498.A O no hydrogen 3.340 N/A VAL 503.A N ILE 499.A O no hydrogen 2.878 N/A ARG 504.A N ALA 500.A O no hydrogen 2.917 N/A LEU 505.A N HIS 501.A O no hydrogen 3.092 N/A SER 506.A N ILE 502.A O no hydrogen 3.039 N/A SER 506.A OG SER 150.A OG no hydrogen 2.700 N/A SER 506.A OG ILE 502.A O no hydrogen 2.702 N/A ALA 507.A N VAL 503.A O no hydrogen 2.925 N/A ILE 508.A N ARG 504.A O no hydrogen 3.226 N/A GLY 509.A N LEU 505.A O no hydrogen 3.251 N/A THR 510.A N SER 506.A O no hydrogen 3.016 N/A THR 510.A OG1 SER 506.A O no hydrogen 2.603 N/A VAL 511.A N ALA 507.A O no hydrogen 3.088 N/A ILE 512.A N ILE 508.A O no hydrogen 2.947 N/A SER 513.A N GLY 509.A O no hydrogen 2.787 N/A SER 513.A OG THR 450.A OG1 no hydrogen 2.962 N/A SER 513.A OG GLY 509.A O no hydrogen 3.159 N/A SER 513.A OG THR 510.A O no hydrogen 2.564 N/A GLN 514.A N THR 510.A O no hydrogen 3.045 N/A ARG 515.A N VAL 511.A O no hydrogen 3.017 N/A VAL 516.A N ILE 512.A O no hydrogen 3.103 N/A HIS 517.A N SER 513.A O no hydrogen 2.991 N/A HIS 517.A ND1 SER 513.A O no hydrogen 3.235 N/A HIS 517.A NE2 ASN 158.A O no hydrogen 3.193 N/A ARG 518.A N GLN 514.A O no hydrogen 3.036 N/A ARG 518.A NE ASP 519.A OD1 no hydrogen 3.067 N/A ARG 518.A NH2 ASP 519.A OD1 no hydrogen 3.497 N/A ARG 518.A NH2 ASP 519.A OD2 no hydrogen 3.213 N/A ASP 519.A N ARG 515.A O no hydrogen 3.136 N/A VAL 520.A N VAL 516.A O no hydrogen 2.803 N/A ALA 521.A N HIS 517.A O no hydrogen 2.794 N/A LYS 523.A N ASP 539.A OD2 no hydrogen 3.119 N/A LYS 523.A NZ GLU 277.A OE1 no hydrogen 3.440 N/A LYS 523.A NZ GLU 277.A OE2 no hydrogen 2.738 N/A LYS 523.A NZ ALA 521.A O no hydrogen 2.582 N/A LEU 525.A N GLU 276.A OE2 no hydrogen 2.827 N/A MET 526.A N GLU 276.A OE2 no hydrogen 2.952 N/A SER 527.A N LYS 523.A O no hydrogen 3.053 N/A SER 527.A OG LYS 523.A O no hydrogen 2.757 N/A LEU 528.A N LEU 525.A O no hydrogen 3.061 N/A LEU 529.A N MET 526.A O no hydrogen 2.972 N/A GLU 531.A N GLY 442.A O no hydrogen 2.731 N/A GLY 532.A N GLU 535.A OE1 no hydrogen 3.054 N/A CYS 533.A SG VAL 530.A O no hydrogen 3.539 N/A CYS 533.A SG LYS 538.A O no hydrogen 3.530 N/A GLU 535.A N GLU 535.A OE1 no hydrogen 2.739 N/A SER 536.A N GLY 532.A O no hydrogen 2.824 N/A SER 536.A OG GLY 532.A O no hydrogen 2.645 N/A SER 536.A OG GLY 544.A O no hydrogen 2.967 N/A GLY 537.A N CYS 533.A O no hydrogen 2.885 N/A LYS 538.A N CYS 533.A O no hydrogen 3.289 N/A VAL 540.A N SER 527.A OG no hydrogen 3.005 N/A ALA 541.A N ASP 539.A OD2 no hydrogen 2.868 N/A ALA 542.A N ASP 539.A O no hydrogen 3.287 N/A ALA 542.A N ASP 539.A OD1 no hydrogen 3.171 N/A GLY 543.A N VAL 540.A O no hydrogen 3.003 N/A GLY 544.A N ASP 539.A O no hydrogen 2.887 N/A MET 546.A N GLU 531.A O no hydrogen 2.990 N/A ASN 548.A ND2 GLY 543.A O no hydrogen 3.389 N/A HIS 549.A N TYR 445.A O no hydrogen 3.130 N/A HIS 549.A ND1 GLN 446.A OE1 no hydrogen 2.824 N/A GLY 550.A N SER 637.A OG no hydrogen 3.257 N/A GLY 552.A N TRP 447.A O no hydrogen 3.267 N/A LEU 553.A N SER 640.A O no hydrogen 2.733 N/A ILE 554.A N GLY 451.A O no hydrogen 3.387 N/A PHE 555.A N GLY 642.A O no hydrogen 2.877 N/A SER 556.A N THR 453.A O no hydrogen 3.018 N/A SER 556.A OG ASN 648.A OD1 no hydrogen 2.602 N/A ALA 559.A N SER 670.A OG no hydrogen 3.253 N/A THR 560.A N SER 670.A OG no hydrogen 3.373 N/A TYR 561.A N GLY 557.A O no hydrogen 2.794 N/A VAL 562.A N LEU 558.A O no hydrogen 2.946 N/A ASP 563.A N ALA 559.A O no hydrogen 2.946 N/A SER 564.A N THR 560.A O no hydrogen 3.276 N/A SER 564.A OG THR 560.A O no hydrogen 2.685 N/A MET 565.A N TYR 561.A O no hydrogen 2.918 N/A ALA 566.A N VAL 562.A O no hydrogen 2.879 N/A ALA 567.A N ASP 563.A O no hydrogen 2.972 N/A ILE 568.A N SER 564.A O no hydrogen 3.183 N/A ARG 569.A N MET 565.A O no hydrogen 3.221 N/A ARG 569.A NE TYR 613.A OH no hydrogen 3.229 N/A LYS 570.A N ALA 566.A O no hydrogen 3.069 N/A LEU 571.A N ALA 567.A O no hydrogen 2.988 N/A VAL 572.A N ILE 568.A O no hydrogen 2.938 N/A PHE 573.A N ILE 568.A O no hydrogen 3.367 N/A PHE 573.A N ARG 569.A O no hydrogen 3.199 N/A GLU 574.A N ARG 569.A O no hydrogen 2.941 N/A GLU 575.A N LYS 570.A O no hydrogen 2.862 N/A LYS 577.A NZ GLU 575.A OE1 no hydrogen 3.012 N/A TYR 578.A N LEU 571.A O no hydrogen 3.259 N/A TYR 578.A OH ASP 600.A OD2 no hydrogen 2.753 N/A THR 579.A N GLN 582.A OE1 no hydrogen 2.705 N/A THR 579.A OG1 GLN 582.A OE1 no hydrogen 3.389 N/A GLN 582.A N THR 579.A OG1 no hydrogen 3.102 N/A ILE 583.A N THR 579.A O no hydrogen 3.068 N/A ARG 584.A N LEU 580.A O no hydrogen 2.956 N/A ARG 584.A NE ASP 585.A OD1 no hydrogen 3.108 N/A ARG 584.A NH2 ASP 585.A OD1 no hydrogen 3.227 N/A ARG 584.A NH2 ASP 585.A OD2 no hydrogen 3.367 N/A ASP 585.A N GLU 581.A O no hydrogen 3.094 N/A ALA 586.A N GLN 582.A O no hydrogen 2.952 N/A LEU 587.A N ILE 583.A O no hydrogen 3.155 N/A LEU 588.A N ARG 584.A O no hydrogen 3.070 N/A ALA 589.A N ASP 585.A O no hydrogen 2.980 N/A ASN 590.A N LEU 587.A O no hydrogen 2.804 N/A PHE 591.A N ALA 586.A O no hydrogen 2.815 N/A GLU 592.A N ALA 589.A O no hydrogen 3.028 N/A TYR 594.A N PHE 591.A O no hydrogen 3.091 N/A ARG 598.A N TYR 594.A O no hydrogen 3.067 N/A ARG 598.A NE GLY 662.A O no hydrogen 3.102 N/A ARG 598.A NH2 GLY 662.A O no hydrogen 3.155 N/A ARG 599.A N GLU 595.A O no hydrogen 2.777 N/A ASP 600.A N ALA 596.A O no hydrogen 3.089 N/A CYS 601.A N LEU 597.A O no hydrogen 2.876 N/A CYS 601.A SG LEU 597.A O no hydrogen 3.400 N/A CYS 601.A SG PRO 660.A O no hydrogen 3.226 N/A LEU 602.A N ARG 598.A O no hydrogen 2.739 N/A ASN 603.A N ARG 599.A O no hydrogen 2.896 N/A ALA 604.A N CYS 601.A O no hydrogen 3.101 N/A LYS 606.A NZ CYS 601.A O no hydrogen 2.790 N/A LYS 606.A NZ LEU 602.A O no hydrogen 2.890 N/A LYS 606.A NZ ALA 604.A O no hydrogen 2.846 N/A TYR 607.A N ASP 563.A OD1 no hydrogen 2.615 N/A TYR 607.A OH ILE 673.A O no hydrogen 2.720 N/A ASN 609.A ND2 LYS 606.A O no hydrogen 2.961 N/A ASN 609.A ND2 ALA 679.A O no hydrogen 2.861 N/A ASP 610.A N SER 690.A OG no hydrogen 2.723 N/A TYR 613.A N ASP 611.A OD1 no hydrogen 3.019 N/A TYR 613.A OH GLU 574.A OE1 no hydrogen 2.588 N/A VAL 614.A N ASP 611.A O no hydrogen 3.132 N/A ASP 615.A N ASP 611.A O no hydrogen 2.866 N/A GLN 616.A N ASN 612.A O no hydrogen 3.172 N/A TYR 617.A N VAL 614.A O no hydrogen 2.964 N/A ALA 618.A N ASP 615.A O no hydrogen 2.932 N/A ASP 620.A N GLN 616.A O no hydrogen 3.187 N/A ILE 621.A N TYR 617.A O no hydrogen 3.095 N/A THR 622.A OG1 ALA 618.A O no hydrogen 2.683 N/A THR 622.A OG1 LEU 619.A O no hydrogen 3.183 N/A GLU 623.A N LEU 619.A O no hydrogen 3.074 N/A TRP 624.A N ASP 620.A O no hydrogen 2.723 N/A THR 625.A N ILE 621.A O no hydrogen 2.634 N/A THR 625.A OG1 ILE 621.A O no hydrogen 2.554 N/A GLU 626.A N THR 622.A O no hydrogen 3.014 N/A LYS 627.A N GLU 623.A O no hydrogen 3.209 N/A GLU 628.A N TRP 624.A O no hydrogen 2.930 N/A CYS 629.A N THR 625.A O no hydrogen 2.904 N/A CYS 629.A SG THR 625.A O no hydrogen 3.374 N/A ARG 630.A N GLU 626.A O no hydrogen 2.879 N/A ARG 630.A NH1 HIS 549.A NE2 no hydrogen 3.125 N/A ARG 630.A NH2 HIS 549.A NE2 no hydrogen 3.381 N/A LYS 631.A N GLU 628.A O no hydrogen 3.199 N/A LYS 631.A NZ GLU 628.A OE1 no hydrogen 2.905 N/A TYR 632.A N CYS 629.A O no hydrogen 2.946 N/A MET 634.A N SER 637.A O no hydrogen 2.792 N/A LEU 635.A N GLN 514.A OE1 no hydrogen 2.969 N/A TYR 636.A OH ALA 541.A O no hydrogen 2.735 N/A THR 638.A N SER 637.A OG no hydrogen 2.497 N/A THR 638.A OG1 TYR 632.A O no hydrogen 3.531 N/A LEU 639.A N TYR 632.A O no hydrogen 3.065 N/A HIS 641.A N GLU 626.A OE1 no hydrogen 2.858 N/A GLY 642.A N LEU 553.A O no hydrogen 3.132 N/A THR 643.A N GLY 702.A O no hydrogen 3.157 N/A THR 643.A OG1 GLY 702.A O no hydrogen 3.331 N/A SER 647.A OG LYS 333.A O no hydrogen 2.632 N/A ASN 648.A N SER 645.A O no hydrogen 2.739 N/A ASN 649.A ND2 LEU 669.A O no hydrogen 3.038 N/A THR 650.A N SER 647.A O no hydrogen 3.361 N/A ILE 652.A N ASN 648.A O no hydrogen 2.782 N/A GLY 653.A N ASN 649.A O no hydrogen 3.217 N/A GLU 654.A N THR 650.A O no hydrogen 3.027 N/A LEU 655.A N ILE 652.A O no hydrogen 2.977 N/A THR 656.A N GLY 653.A O no hydrogen 2.729 N/A THR 656.A OG1 GLN 454.A OE1 no hydrogen 3.119 N/A THR 656.A OG1 ILE 652.A O no hydrogen 2.820 N/A ASN 657.A N GLU 460.A OE1 no hydrogen 2.821 N/A THR 659.A N ARG 663.A O no hydrogen 3.042 N/A THR 659.A OG1 ASN 661.A OD1 no hydrogen 2.752 N/A GLY 662.A N THR 659.A O no hydrogen 2.950 N/A ARG 663.A N ASN 661.A OD1 no hydrogen 3.261 N/A ARG 663.A NE THR 659.A OG1 no hydrogen 3.196 N/A ARG 663.A NH2 THR 656.A O no hydrogen 2.748 N/A ALA 665.A N ASN 590.A OD1 no hydrogen 3.005 N/A TRP 666.A N THR 656.A O no hydrogen 2.916 N/A MET 667.A N LEU 664.A O no hydrogen 3.382 N/A LEU 669.A N ASN 649.A O no hydrogen 2.976 N/A SER 670.A N THR 560.A OG1 no hydrogen 3.029 N/A GLY 672.A N SER 645.A OG no hydrogen 2.736 N/A ILE 673.A N VAL 704.A O no hydrogen 2.781 N/A SER 674.A N ASP 671.A O no hydrogen 2.707 N/A SER 674.A OG ASP 671.A OD1 no hydrogen 2.577 N/A SER 674.A OG HIS 705.A ND1 no hydrogen 3.310 N/A SER 674.A OG ASN 706.A O no hydrogen 3.472 N/A THR 676.A OG1 ASP 563.A OD2 no hydrogen 3.460 N/A GLN 677.A N GLN 677.A OE1 no hydrogen 2.629 N/A GLN 677.A NE2 LEU 669.A O no hydrogen 2.982 N/A GLN 677.A NE2 GLU 782.A OE2 no hydrogen 3.232 N/A GLY 678.A N THR 787.A OG1 no hydrogen 2.852 N/A ALA 679.A N THR 676.A O no hydrogen 2.974 N/A ASP 680.A N ASP 680.A OD1 no hydrogen 2.567 N/A LYS 681.A N ASN 609.A OD1 no hydrogen 2.834 N/A GLN 682.A N ASN 609.A OD1 no hydrogen 3.324 N/A ILE 687.A N GLY 683.A O no hydrogen 3.347 N/A ILE 688.A N PRO 684.A O no hydrogen 3.142 N/A LYS 689.A N THR 685.A O no hydrogen 3.126 N/A SER 690.A N ALA 686.A O no hydrogen 3.015 N/A SER 690.A OG ASP 615.A OD1 no hydrogen 3.165 N/A SER 690.A OG ASP 615.A OD2 no hydrogen 2.361 N/A VAL 691.A N ILE 687.A O no hydrogen 3.096 N/A SER 692.A N ILE 688.A O no hydrogen 3.052 N/A SER 692.A OG LYS 689.A O no hydrogen 2.765 N/A LYS 693.A N SER 690.A O no hydrogen 3.225 N/A LYS 693.A NZ ASP 610.A OD1 no hydrogen 2.699 N/A LYS 693.A NZ ASP 615.A OD2 no hydrogen 3.139 N/A MET 694.A N VAL 691.A O no hydrogen 2.994 N/A ASN 695.A ND2 GLU 623.A OE2 no hydrogen 3.288 N/A THR 698.A N ASN 695.A O no hydrogen 2.974 N/A THR 698.A OG1 GLU 623.A OE2 no hydrogen 2.721 N/A THR 698.A OG1 ASN 695.A O no hydrogen 3.430 N/A MET 699.A N VAL 696.A O no hydrogen 3.178 N/A ASN 700.A ND2 MET 416.A O no hydrogen 3.140 N/A ILE 701.A N HIS 641.A O no hydrogen 3.449 N/A GLY 702.A N MET 699.A O no hydrogen 3.012 N/A ASN 706.A N SER 674.A OG no hydrogen 2.830 N/A ASN 706.A ND2 ASP 671.A OD1 no hydrogen 3.048 N/A ASN 706.A ND2 VAL 765.A O no hydrogen 2.972 N/A PHE 707.A N GLN 739.A O no hydrogen 2.873 N/A LYS 708.A NZ ILE 783.A O no hydrogen 2.476 N/A LYS 708.A NZ ILE 784.A O no hydrogen 3.392 N/A LYS 708.A NZ ARG 786.A O no hydrogen 3.234 N/A PHE 709.A N SER 741.A O no hydrogen 2.958 N/A LEU 710.A N ILE 789.A O no hydrogen 2.817 N/A GLY 712.A N TYR 742.A OH no hydrogen 2.846 N/A LEU 713.A N LEU 710.A O no hydrogen 3.034 N/A LEU 714.A N TYR 742.A OH no hydrogen 3.152 N/A ASP 715.A N GLY 712.A O no hydrogen 3.256 N/A GLU 718.A N GLU 718.A OE1 no hydrogen 2.938 N/A GLY 719.A N THR 716.A OG1 no hydrogen 2.943 N/A ARG 720.A N THR 716.A O no hydrogen 3.210 N/A ARG 720.A NE GLU 392.A OE2 no hydrogen 2.730 N/A ARG 720.A NH1 ASP 396.A OD1 no hydrogen 3.131 N/A ARG 720.A NH2 GLU 392.A OE2 no hydrogen 3.447 N/A ARG 720.A NH2 ASP 396.A OD1 no hydrogen 2.822 N/A ARG 720.A NH2 ASP 396.A OD2 no hydrogen 3.419 N/A HIS 721.A N PRO 717.A O no hydrogen 3.054 N/A GLY 722.A N GLU 718.A O no hydrogen 2.814 N/A LEU 723.A N GLY 719.A O no hydrogen 3.227 N/A ILE 724.A N ARG 720.A O no hydrogen 3.148 N/A THR 725.A N HIS 721.A O no hydrogen 3.007 N/A THR 725.A OG1 HIS 721.A O no hydrogen 3.133 N/A LEU 726.A N GLY 722.A O no hydrogen 2.980 N/A LEU 727.A N LEU 723.A O no hydrogen 2.883 N/A ARG 728.A N ILE 724.A O no hydrogen 2.682 N/A ARG 728.A NH1 SER 386.A O no hydrogen 2.935 N/A ARG 728.A NH2 SER 386.A O no hydrogen 3.329 N/A THR 729.A N THR 725.A O no hydrogen 2.752 N/A THR 729.A OG1 THR 725.A O no hydrogen 2.725 N/A ALA 730.A N LEU 726.A O no hydrogen 2.918 N/A SER 731.A N LEU 727.A O no hydrogen 3.050 N/A SER 731.A OG ASN 384.A OD1 no hydrogen 2.492 N/A ILE 732.A N ARG 728.A O no hydrogen 3.116 N/A LEU 733.A N THR 729.A O no hydrogen 2.822 N/A GLY 734.A N SER 731.A O no hydrogen 3.174 N/A ASN 735.A N ALA 730.A O no hydrogen 2.958 N/A ASN 735.A ND2 ILE 688.A O no hydrogen 3.251 N/A MET 738.A N CYS 407.A O no hydrogen 2.860 N/A GLN 739.A N HIS 705.A O no hydrogen 3.182 N/A GLN 739.A NE2 GLN 737.A OE1 no hydrogen 2.936 N/A SER 741.A N PHE 707.A O no hydrogen 2.810 N/A TYR 742.A OH ASP 715.A OD1 no hydrogen 2.712 N/A GLU 746.A N ASP 744.A OD1 no hydrogen 2.975 N/A VAL 747.A N ASP 744.A O no hydrogen 3.173 N/A LEU 748.A N ASP 744.A O no hydrogen 3.187 N/A LYS 749.A N ASN 745.A O no hydrogen 2.802 N/A LYS 749.A NZ GLU 746.A OE2 no hydrogen 3.235 N/A LYS 750.A N GLU 746.A O no hydrogen 3.124 N/A ALA 751.A N VAL 747.A O no hydrogen 3.019 N/A GLN 752.A N LEU 748.A O no hydrogen 3.191 N/A GLN 752.A NE2 GLN 780.A OE1 no hydrogen 3.115 N/A GLN 752.A NE2 ASP 781.A OD1 no hydrogen 3.065 N/A GLN 753.A N LYS 749.A O no hydrogen 3.387 N/A GLU 754.A N LYS 750.A O no hydrogen 3.041 N/A LYS 757.A N GLU 754.A O no hydrogen 3.229 N/A LYS 757.A NZ GLU 754.A OE1 no hydrogen 3.427 N/A TYR 758.A N PRO 755.A O no hydrogen 2.992 N/A ARG 759.A NE LEU 16.A O no hydrogen 2.986 N/A ARG 759.A NH1 ARG 759.A O no hydrogen 2.687 N/A LEU 761.A N TYR 758.A O no hydrogen 3.113 N/A VAL 763.A N ALA 770.A O no hydrogen 2.840 N/A ARG 764.A NE GLN 739.A OE1 no hydrogen 2.941 N/A ARG 764.A NH1 SER 377.A OG no hydrogen 3.112 N/A ARG 764.A NH1 SER 769.A OG no hydrogen 3.238 N/A VAL 765.A N TYR 768.A O no hydrogen 2.976 N/A GLY 767.A N GLN 739.A OE1 no hydrogen 2.945 N/A TYR 768.A OH ALA 336.A O no hydrogen 2.626 N/A SER 769.A OG MET 402.A O no hydrogen 2.770 N/A ALA 770.A N VAL 763.A O no hydrogen 2.892 N/A PHE 772.A N LEU 761.A O no hydrogen 2.975 N/A GLU 774.A N TYR 771.A O no hydrogen 2.746 N/A LEU 775.A N PHE 772.A O no hydrogen 3.106 N/A CYS 776.A N GLN 101.A OE1 no hydrogen 2.821 N/A CYS 776.A SG GLN 101.A OE1 no hydrogen 3.350 N/A CYS 776.A SG GLU 778.A OE2 no hydrogen 3.523 N/A LYS 777.A NZ ASP 781.A OD2 no hydrogen 3.203 N/A GLN 780.A N CYS 776.A O no hydrogen 3.201 N/A GLN 780.A NE2 PHE 772.A O no hydrogen 2.975 N/A ASP 781.A N LYS 777.A O no hydrogen 2.831 N/A GLU 782.A N GLU 778.A O no hydrogen 2.985 N/A ILE 783.A N VAL 779.A O no hydrogen 3.045 N/A ILE 784.A N GLN 780.A O no hydrogen 3.010 N/A SER 785.A N ASP 781.A O no hydrogen 2.916 N/A SER 785.A OG GLU 782.A O no hydrogen 2.539 N/A ARG 786.A N ILE 783.A O no hydrogen 3.361 N/A ARG 786.A NE GLU 782.A OE2 no hydrogen 2.960 N/A ARG 786.A NH1 VAL 765.A O no hydrogen 2.836 N/A ARG 786.A NH2 VAL 765.A O no hydrogen 3.261 N/A ARG 786.A NH2 GLU 782.A OE1 no hydrogen 2.857 N/A ARG 786.A NH2 GLU 782.A OE2 no hydrogen 3.508 N/A THR 787.A OG1 ASP 680.A OD1 no hydrogen 2.625 N/A ILE 789.A N LYS 708.A O no hydrogen 2.907 N/A