Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1nl3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 7.A N ASP 4.A O no hydrogen 3.162 N/A ARG 11.A NE VAL 9.A O no hydrogen 3.410 N/A ARG 11.A NH1 ASP 77.A OD1 no hydrogen 2.964 N/A ARG 11.A NH2 ASP 77.A OD1 no hydrogen 3.260 N/A ALA 15.A N ARG 11.A O no hydrogen 3.105 N/A ASP 16.A N GLY 12.A O no hydrogen 3.191 N/A LEU 18.A N MET 14.A O no hydrogen 3.224 N/A SER 19.A N ALA 15.A O no hydrogen 2.736 N/A LYS 20.A N ASP 16.A O no hydrogen 2.808 N/A LYS 20.A NZ ASP 16.A OD2 no hydrogen 3.385 N/A LEU 21.A N ILE 17.A O no hydrogen 2.901 N/A LEU 22.A N SER 19.A O no hydrogen 3.202 N/A ARG 23.A N LYS 20.A O no hydrogen 3.176 N/A LEU 24.A N LEU 21.A O no hydrogen 3.287 N/A GLY 25.A N LEU 22.A O no hydrogen 2.932 N/A LYS 31.A N GLY 27.A O no hydrogen 3.390 N/A ARG 32.A N ARG 28.A O no hydrogen 3.268 N/A ARG 32.A NE LEU 8.A O no hydrogen 3.065 N/A ARG 32.A NH1 ASP 4.A OD2 no hydrogen 2.934 N/A ARG 32.A NH2 ASP 4.A OD1 no hydrogen 2.844 N/A ARG 32.A NH2 ASP 4.A OD2 no hydrogen 2.807 N/A ARG 32.A NH2 THR 7.A O no hydrogen 3.078 N/A ARG 32.A NH2 LEU 8.A O no hydrogen 3.458 N/A LEU 33.A N MET 29.A O no hydrogen 2.873 N/A LYS 34.A N VAL 30.A O no hydrogen 2.962 N/A LYS 34.A NZ ASP 38.A OD2 no hydrogen 2.985 N/A LYS 35.A N LYS 31.A O no hydrogen 3.069 N/A VAL 36.A N ARG 32.A O no hydrogen 2.942 N/A ALA 37.A N LEU 33.A O no hydrogen 2.788 N/A ASP 38.A N LYS 34.A O no hydrogen 2.908 N/A TYR 39.A N LYS 35.A O no hydrogen 3.225 N/A VAL 40.A N VAL 36.A O no hydrogen 3.183 N/A GLY 41.A N ALA 37.A O no hydrogen 3.069 N/A GLY 41.A N ASP 38.A O no hydrogen 2.805 N/A THR 42.A N ASP 38.A O no hydrogen 3.151 N/A THR 42.A OG1 TYR 39.A O no hydrogen 2.793 N/A LEU 43.A N VAL 40.A O no hydrogen 2.900 N/A SER 44.A N GLY 41.A O no hydrogen 3.253 N/A SER 44.A OG GLU 48.A OE2 no hydrogen 3.067 N/A GLU 48.A N SER 44.A O no hydrogen 2.664 N/A LYS 49.A N ASP 45.A O no hydrogen 3.230 N/A LEU 50.A N VAL 47.A O no hydrogen 3.100 N/A THR 51.A N GLU 54.A OE1 no hydrogen 2.845 N/A LEU 55.A N THR 51.A O no hydrogen 2.899 N/A ARG 56.A N ASP 52.A O no hydrogen 2.830 N/A ALA 57.A N ALA 53.A O no hydrogen 3.147 N/A LYS 58.A N LEU 55.A O no hydrogen 2.905 N/A LYS 58.A NZ GLU 61.A OE1 no hydrogen 3.310 N/A THR 59.A N ARG 56.A O no hydrogen 3.179 N/A THR 59.A OG1 TYR 132.A OH no hydrogen 2.372 N/A THR 59.A OG1 LEU 165.A O no hydrogen 2.802 N/A ASP 60.A N ALA 57.A O no hydrogen 2.794 N/A GLU 61.A N ALA 57.A O no hydrogen 3.043 N/A PHE 62.A N LYS 58.A O no hydrogen 2.871 N/A LYS 63.A N THR 59.A O no hydrogen 3.017 N/A ARG 64.A N ASP 60.A O no hydrogen 3.179 N/A ARG 65.A N GLU 61.A O no hydrogen 2.871 N/A ARG 65.A NE GLU 73.A OE1 no hydrogen 2.667 N/A ARG 65.A NH1 GLU 61.A OE2 no hydrogen 3.071 N/A ARG 65.A NH1 GLU 81.A OE1 no hydrogen 3.114 N/A ARG 65.A NH2 GLU 73.A OE1 no hydrogen 3.308 N/A ARG 65.A NH2 GLU 73.A OE2 no hydrogen 3.451 N/A ARG 65.A NH2 GLU 81.A OE1 no hydrogen 3.476 N/A ARG 65.A NH2 GLU 81.A OE2 no hydrogen 3.104 N/A LEU 66.A N PHE 62.A O no hydrogen 3.017 N/A LEU 66.A N LYS 63.A O no hydrogen 3.281 N/A ALA 67.A N LYS 63.A O no hydrogen 3.232 N/A ASN 71.A N ASP 68.A OD1 no hydrogen 3.022 N/A THR 74.A N ASP 77.A OD2 no hydrogen 2.865 N/A LEU 78.A N THR 74.A O no hydrogen 3.058 N/A LEU 79.A N ASP 76.A O no hydrogen 3.266 N/A ALA 82.A N LEU 78.A O no hydrogen 2.846 N/A PHE 83.A N LEU 79.A O no hydrogen 2.895 N/A ALA 84.A N PRO 80.A O no hydrogen 3.128 N/A VAL 85.A N GLU 81.A O no hydrogen 2.934 N/A ALA 86.A N ALA 82.A O no hydrogen 2.875 N/A ARG 87.A N PHE 83.A O no hydrogen 2.725 N/A ARG 87.A NE PRO 98.A O no hydrogen 2.694 N/A ARG 87.A NH2 PRO 98.A O no hydrogen 2.985 N/A ARG 87.A NH2 ASP 100.A OD1 no hydrogen 2.780 N/A GLU 88.A N ALA 84.A O no hydrogen 2.955 N/A ALA 89.A N VAL 85.A O no hydrogen 3.125 N/A ALA 90.A N ALA 86.A O no hydrogen 3.052 N/A TRP 91.A N ARG 87.A O no hydrogen 3.241 N/A ARG 92.A N GLU 88.A O no hydrogen 2.870 N/A ARG 92.A NE GLU 88.A OE2 no hydrogen 2.929 N/A ARG 92.A NH1 LEU 50.A O no hydrogen 2.809 N/A ARG 92.A NH1 ASP 52.A OD1 no hydrogen 2.695 N/A ARG 92.A NH2 LEU 50.A O no hydrogen 2.683 N/A ARG 92.A NH2 GLU 88.A OE2 no hydrogen 3.266 N/A VAL 93.A N ALA 89.A O no hydrogen 2.745 N/A VAL 93.A N ALA 90.A O no hydrogen 3.208 N/A LEU 94.A N ALA 90.A O no hydrogen 2.598 N/A ARG 97.A NH2 SER 44.A OG no hydrogen 2.729 N/A PHE 99.A N GLN 102.A OE1 no hydrogen 2.603 N/A GLN 102.A NE2 GLY 122.A O no hydrogen 3.288 N/A VAL 103.A N PHE 99.A O no hydrogen 2.966 N/A MET 104.A N ASP 100.A O no hydrogen 2.925 N/A GLY 105.A N VAL 101.A O no hydrogen 3.030 N/A ALA 106.A N GLN 102.A O no hydrogen 2.945 N/A ALA 107.A N VAL 103.A O no hydrogen 2.988 N/A ALA 108.A N MET 104.A O no hydrogen 2.945 N/A LEU 109.A N GLY 105.A O no hydrogen 2.875 N/A HIS 110.A N ALA 106.A O no hydrogen 2.896 N/A HIS 110.A ND1 ASN 134.A OD1 no hydrogen 2.950 N/A HIS 110.A NE2 ASP 76.A OD1 no hydrogen 2.781 N/A LEU 111.A N ALA 107.A O no hydrogen 3.010 N/A GLY 112.A N LEU 109.A O no hydrogen 3.299 N/A ASN 113.A N ALA 108.A O no hydrogen 3.245 N/A ASN 113.A ND2 ALA 108.A O no hydrogen 3.170 N/A VAL 114.A N GLY 405.A O no hydrogen 2.745 N/A GLU 116.A N VAL 407.A O no hydrogen 2.774 N/A GLU 121.A N LYS 118.A O no hydrogen 2.864 N/A LYS 123.A NZ ASP 224.A OD1 no hydrogen 2.695 N/A LYS 123.A NZ ASP 224.A OD2 no hydrogen 3.314 N/A LYS 123.A NZ GLU 225.A OE2 no hydrogen 3.161 N/A LEU 125.A N GLY 122.A O no hydrogen 2.928 N/A THR 126.A N GLY 122.A O no hydrogen 2.874 N/A THR 126.A OG1 GLY 122.A O no hydrogen 3.200 N/A CYS 127.A N LYS 123.A O no hydrogen 3.173 N/A VAL 128.A N LEU 125.A O no hydrogen 2.884 N/A LEU 129.A N THR 126.A O no hydrogen 3.082 N/A ALA 131.A N CYS 127.A O no hydrogen 3.146 N/A TYR 132.A N VAL 128.A O no hydrogen 2.899 N/A TYR 132.A OH THR 59.A OG1 no hydrogen 2.372 N/A LEU 133.A N LEU 129.A O no hydrogen 3.099 N/A ASN 134.A N PRO 130.A O no hydrogen 2.904 N/A ALA 135.A N ALA 131.A O no hydrogen 2.785 N/A LEU 136.A N TYR 132.A O no hydrogen 3.082 N/A LEU 136.A N LEU 133.A O no hydrogen 3.104 N/A ALA 137.A N ASN 134.A O no hydrogen 3.073 N/A GLY 138.A N ALA 135.A O no hydrogen 3.017 N/A VAL 141.A N ASP 188.A O no hydrogen 3.061 N/A HIS 142.A N TYR 220.A O no hydrogen 2.812 N/A HIS 142.A ND1 TYR 381.A OH no hydrogen 2.564 N/A ILE 143.A N THR 190.A O no hydrogen 2.799 N/A VAL 144.A N ILE 222.A O no hydrogen 2.959 N/A THR 145.A N GLY 192.A O no hydrogen 2.811 N/A THR 145.A OG1 GLY 192.A O no hydrogen 3.535 N/A LEU 150.A N ASN 147.A OD1 no hydrogen 2.668 N/A ALA 151.A N ASN 147.A O no hydrogen 2.878 N/A LYS 152.A N ASP 148.A O no hydrogen 2.844 N/A ARG 153.A N TYR 149.A O no hydrogen 2.909 N/A ARG 153.A NH1 TYR 149.A OH no hydrogen 2.942 N/A ARG 153.A NH1 THR 508.A OG1 no hydrogen 2.969 N/A ARG 153.A NH2 THR 508.A OG1 no hydrogen 3.331 N/A ASP 154.A N LEU 150.A O no hydrogen 2.993 N/A SER 155.A N ALA 151.A O no hydrogen 3.022 N/A SER 155.A OG LYS 152.A O no hydrogen 2.990 N/A GLU 156.A N LYS 152.A O no hydrogen 3.127 N/A GLU 156.A N ARG 153.A O no hydrogen 3.135 N/A TRP 157.A N ARG 153.A O no hydrogen 2.740 N/A MET 158.A N ASP 154.A O no hydrogen 2.817 N/A ARG 160.A NH1 VAL 93.A O no hydrogen 2.834 N/A ARG 160.A NH1 GLU 539.A OE1 no hydrogen 3.399 N/A ARG 160.A NH1 GLU 539.A OE2 no hydrogen 3.052 N/A VAL 161.A N MET 158.A O no hydrogen 2.690 N/A HIS 162.A N MET 158.A O no hydrogen 3.381 N/A ARG 163.A N GLY 159.A O no hydrogen 2.833 N/A ARG 163.A NH2 SER 155.A O no hydrogen 2.938 N/A ARG 163.A NH2 GLU 156.A O no hydrogen 3.107 N/A PHE 164.A N ARG 160.A O no hydrogen 3.299 N/A LEU 165.A N VAL 161.A O no hydrogen 3.090 N/A GLY 166.A N ARG 163.A O no hydrogen 3.035 N/A LEU 167.A N HIS 162.A O no hydrogen 2.793 N/A GLN 168.A N ASP 188.A OD2 no hydrogen 2.732 N/A GLY 170.A N ILE 189.A O no hydrogen 2.719 N/A ILE 172.A N TYR 191.A O no hydrogen 3.222 N/A ALA 174.A N ASP 148.A OD2 no hydrogen 2.835 N/A MET 176.A N LEU 173.A O no hydrogen 3.120 N/A THR 177.A N GLU 180.A OE1 no hydrogen 2.800 N/A THR 177.A OG1 GLU 180.A OE1 no hydrogen 2.846 N/A ARG 181.A N THR 177.A O no hydrogen 2.859 N/A ARG 181.A NE MET 176.A O no hydrogen 3.226 N/A ARG 181.A NH1 GLU 196.A OE1 no hydrogen 3.133 N/A ARG 181.A NH1 ASP 200.A OD2 no hydrogen 3.001 N/A ARG 181.A NH2 MET 176.A O no hydrogen 3.555 N/A ARG 181.A NH2 GLU 196.A OE1 no hydrogen 3.016 N/A ARG 182.A N PRO 178.A O no hydrogen 2.861 N/A ARG 182.A NE LEU 213.A O no hydrogen 3.037 N/A ARG 182.A NH1 ASP 179.A OD1 no hydrogen 2.760 N/A ARG 182.A NH2 ASP 212.A O no hydrogen 3.475 N/A VAL 183.A N ASP 179.A O no hydrogen 3.415 N/A ALA 184.A N GLU 180.A O no hydrogen 3.284 N/A TYR 185.A N ARG 181.A O no hydrogen 2.763 N/A TYR 185.A OH ASP 200.A OD2 no hydrogen 2.482 N/A ASN 186.A N ARG 182.A O no hydrogen 2.992 N/A ASN 186.A N VAL 183.A O no hydrogen 2.983 N/A ALA 187.A N VAL 183.A O no hydrogen 3.252 N/A ALA 187.A N ALA 184.A O no hydrogen 3.210 N/A ILE 189.A N GLN 168.A O no hydrogen 3.074 N/A THR 190.A N VAL 141.A O no hydrogen 2.801 N/A THR 190.A OG1 ALA 184.A O no hydrogen 2.712 N/A TYR 191.A N GLY 170.A O no hydrogen 2.850 N/A GLY 192.A N ILE 143.A O no hydrogen 2.844 N/A ASN 194.A ND2 GLU 233.A OE1 no hydrogen 2.942 N/A GLU 196.A N THR 193.A OG1 no hydrogen 3.168 N/A PHE 197.A N THR 193.A O no hydrogen 2.961 N/A GLY 198.A N ASN 194.A O no hydrogen 2.837 N/A PHE 199.A N ASN 195.A O no hydrogen 2.844 N/A ASP 200.A N GLU 196.A O no hydrogen 3.184 N/A TYR 201.A N PHE 197.A O no hydrogen 2.930 N/A LEU 202.A N GLY 198.A O no hydrogen 2.862 N/A ARG 203.A N PHE 199.A O no hydrogen 2.710 N/A ARG 203.A NH1 ASP 200.A OD1 no hydrogen 2.744 N/A ASP 204.A N ASP 200.A O no hydrogen 2.818 N/A ASN 205.A N TYR 201.A O no hydrogen 3.231 N/A ASN 205.A ND2 TYR 201.A O no hydrogen 2.842 N/A MET 206.A N ARG 203.A O no hydrogen 3.045 N/A ALA 207.A N ASP 204.A O no hydrogen 2.991 N/A ASP 212.A N SER 209.A O no hydrogen 2.904 N/A LEU 213.A N LEU 210.A O no hydrogen 3.311 N/A VAL 214.A N ASP 204.A OD1 no hydrogen 2.718 N/A GLN 215.A N ASP 204.A OD2 no hydrogen 3.097 N/A GLN 215.A NE2 TYR 185.A OH no hydrogen 3.062 N/A ARG 216.A NE TYR 185.A O no hydrogen 2.944 N/A ARG 216.A NH1 GLY 138.A O no hydrogen 3.188 N/A ARG 216.A NH2 ALA 187.A O no hydrogen 3.000 N/A HIS 218.A NE2 GLN 215.A OE1 no hydrogen 2.881 N/A TYR 220.A OH LEU 109.A O no hydrogen 2.580 N/A ALA 221.A N LYS 383.A O no hydrogen 3.336 N/A ILE 222.A N HIS 142.A O no hydrogen 2.860 N/A VAL 223.A N ALA 385.A O no hydrogen 2.773 N/A ASP 224.A N VAL 144.A O no hydrogen 2.546 N/A GLU 225.A N ASP 224.A OD1 no hydrogen 2.820 N/A VAL 226.A N MET 387.A O no hydrogen 2.896 N/A SER 228.A N GLU 225.A O no hydrogen 2.935 N/A ILE 229.A N GLU 225.A O no hydrogen 3.259 N/A LEU 230.A N VAL 226.A O no hydrogen 2.822 N/A ILE 231.A N ASP 227.A O no hydrogen 3.278 N/A ASP 232.A N ASP 227.A O no hydrogen 3.167 N/A GLU 233.A N SER 228.A O no hydrogen 2.888 N/A ALA 234.A N ILE 231.A O no hydrogen 3.222 N/A ARG 235.A NE ASP 232.A O no hydrogen 3.389 N/A THR 236.A N GLU 233.A O no hydrogen 3.332 N/A LEU 238.A N ILE 372.A O no hydrogen 2.875 N/A ILE 240.A N ALA 370.A O no hydrogen 2.808 N/A GLY 242.A N GLN 367.A O no hydrogen 3.074 N/A ALA 244.A N GLU 365.A O no hydrogen 2.906 N/A TYR 251.A N ALA 247.A O no hydrogen 3.223 N/A THR 252.A N SER 248.A O no hydrogen 3.109 N/A THR 252.A OG1 SER 248.A O no hydrogen 3.175 N/A GLU 253.A N ASN 249.A O no hydrogen 2.888 N/A PHE 254.A N TRP 250.A O no hydrogen 2.834 N/A ALA 255.A N TYR 251.A O no hydrogen 2.926 N/A ARG 256.A N THR 252.A O no hydrogen 3.163 N/A ARG 256.A NH1 GLU 253.A OE1 no hydrogen 2.998 N/A ARG 256.A NH2 GLN 289.A OE1 no hydrogen 2.684 N/A LEU 257.A N GLU 253.A O no hydrogen 3.143 N/A ALA 258.A N PHE 254.A O no hydrogen 2.938 N/A MET 261.A N ALA 258.A O no hydrogen 3.328 N/A ASP 264.A N TYR 267.A O no hydrogen 2.685 N/A VAL 265.A N GLU 262.A O no hydrogen 3.101 N/A HIS 266.A N GLU 262.A O no hydrogen 2.758 N/A TYR 267.A OH GLU 315.A OE2 no hydrogen 2.334 N/A GLU 268.A N GLY 277.A O no hydrogen 2.889 N/A ASP 270.A N THR 275.A O no hydrogen 2.839 N/A ARG 272.A N ASP 270.A OD1 no hydrogen 3.134 N/A LYS 273.A NZ GLY 702.A O no hydrogen 3.216 N/A ARG 274.A N ASP 270.A O no hydrogen 3.150 N/A ARG 274.A NH1 LEU 271.A O no hydrogen 2.812 N/A ARG 274.A NH2 LEU 316.A O no hydrogen 3.043 N/A THR 275.A N ASP 270.A O no hydrogen 3.325 N/A GLY 277.A N GLU 268.A O no hydrogen 2.902 N/A HIS 279.A N HIS 266.A O no hydrogen 2.650 N/A VAL 283.A N HIS 279.A O no hydrogen 3.085 N/A GLU 284.A N GLU 280.A O no hydrogen 3.422 N/A PHE 285.A N LYS 281.A O no hydrogen 2.862 N/A VAL 286.A N GLY 282.A O no hydrogen 2.936 N/A GLU 287.A N VAL 283.A O no hydrogen 2.880 N/A ASP 288.A N GLU 284.A O no hydrogen 2.922 N/A GLN 289.A N PHE 285.A O no hydrogen 2.981 N/A LEU 290.A N VAL 286.A O no hydrogen 3.075 N/A GLY 291.A N GLU 287.A O no hydrogen 2.802 N/A ILE 292.A N GLU 287.A O no hydrogen 2.868 N/A ASP 293.A N GLU 297.A OE1 no hydrogen 2.734 N/A ASN 294.A N GLU 297.A OE1 no hydrogen 3.089 N/A TYR 296.A N ASN 294.A OD1 no hydrogen 2.684 N/A GLU 297.A N ASN 294.A O no hydrogen 2.973 N/A ASN 300.A ND2 ASN 777.A O no hydrogen 3.466 N/A SER 301.A N ALA 298.A O no hydrogen 3.146 N/A LEU 303.A N SER 301.A O no hydrogen 2.654 N/A SER 305.A OG GLU 829.A OE2 no hydrogen 3.063 N/A TYR 306.A N PRO 302.A O no hydrogen 3.089 N/A LEU 307.A N LEU 303.A O no hydrogen 2.999 N/A ASN 308.A N VAL 304.A O no hydrogen 3.040 N/A ASN 308.A ND2 VAL 276.A O no hydrogen 3.064 N/A ASN 309.A N SER 305.A O no hydrogen 3.030 N/A ALA 310.A N TYR 306.A O no hydrogen 2.997 N/A LEU 311.A N LEU 307.A O no hydrogen 3.112 N/A LYS 312.A N ASN 308.A O no hydrogen 2.972 N/A ALA 313.A N ASN 309.A O no hydrogen 2.660 N/A LYS 314.A N ALA 310.A O no hydrogen 2.772 N/A LYS 314.A NZ ALA 258.A O no hydrogen 2.935 N/A LYS 314.A NZ TYR 267.A OH no hydrogen 2.975 N/A GLU 315.A N LEU 311.A O no hydrogen 2.844 N/A LEU 316.A N LYS 312.A O no hydrogen 2.771 N/A SER 318.A N ASP 322.A OD2 no hydrogen 2.952 N/A ARG 319.A NH1 GLU 358.A OE1 no hydrogen 2.585 N/A ASP 320.A N TYR 323.A O no hydrogen 2.631 N/A LYS 321.A N SER 318.A O no hydrogen 3.156 N/A ASP 322.A N SER 318.A O no hydrogen 2.822 N/A TYR 323.A OH GLU 358.A OE2 no hydrogen 2.434 N/A ILE 324.A N LEU 331.A O no hydrogen 2.852 N/A ARG 326.A N GLU 329.A O no hydrogen 3.359 N/A ARG 326.A NE VAL 325.A O no hydrogen 3.094 N/A ARG 326.A NH2 VAL 325.A O no hydrogen 3.203 N/A LEU 331.A N ILE 324.A O no hydrogen 2.986 N/A VAL 333.A N ASP 322.A O no hydrogen 3.223 N/A ASP 334.A N ARG 339.A O no hydrogen 3.235 N/A THR 337.A OG1 ASP 334.A OD2 no hydrogen 2.945 N/A GLY 338.A N ASP 334.A O no hydrogen 3.239 N/A ARG 345.A NH1 GLU 789.A OE1 no hydrogen 2.540 N/A TYR 346.A N HIS 351.A ND1 no hydrogen 3.101 N/A MET 350.A N ASN 347.A O no hydrogen 3.135 N/A GLN 352.A N GLN 352.A OE1 no hydrogen 2.618 N/A GLN 352.A NE2 GLU 789.A OE2 no hydrogen 2.949 N/A ALA 353.A N GLY 349.A O no hydrogen 2.986 N/A ILE 354.A N MET 350.A O no hydrogen 2.812 N/A GLU 355.A N HIS 351.A O no hydrogen 2.868 N/A ALA 356.A N GLN 352.A O no hydrogen 2.874 N/A LYS 357.A N ALA 353.A O no hydrogen 2.957 N/A LYS 357.A NZ ALA 313.A O no hydrogen 3.168 N/A LYS 357.A NZ TYR 323.A OH no hydrogen 2.665 N/A GLU 358.A N ILE 354.A O no hydrogen 3.006 N/A GLU 358.A N GLU 355.A O no hydrogen 3.111 N/A HIS 359.A N ALA 356.A O no hydrogen 2.968 N/A VAL 360.A N GLU 355.A O no hydrogen 3.141 N/A LYS 363.A NZ GLU 329.A OE1 no hydrogen 3.054 N/A GLN 367.A N GLY 242.A O no hydrogen 2.641 N/A GLN 367.A NE2 THR 368.A O no hydrogen 2.896 N/A GLN 367.A NE2 ARG 784.A O no hydrogen 2.852 N/A THR 368.A N ASP 791.A OD2 no hydrogen 2.747 N/A THR 368.A OG1 ASP 791.A OD1 no hydrogen 2.841 N/A THR 368.A OG1 ASP 791.A OD2 no hydrogen 3.462 N/A LEU 369.A N ILE 240.A O no hydrogen 2.654 N/A ALA 370.A N ILE 240.A O no hydrogen 3.237 N/A ILE 372.A N LEU 238.A O no hydrogen 3.210 N/A THR 373.A N ASP 661.A OD2 no hydrogen 3.293 N/A THR 373.A OG1 ASP 661.A OD2 no hydrogen 2.294 N/A GLN 375.A NE2 ALA 234.A O no hydrogen 3.523 N/A ASN 376.A N THR 373.A OG1 no hydrogen 3.364 N/A ASN 376.A ND2 THR 373.A OG1 no hydrogen 3.354 N/A ASN 376.A ND2 ASP 661.A OD2 no hydrogen 2.799 N/A ASN 376.A ND2 GLU 662.A OE1 no hydrogen 3.056 N/A TYR 377.A N THR 373.A O no hydrogen 2.933 N/A TYR 377.A OH TYR 381.A OH no hydrogen 2.609 N/A PHE 378.A N LEU 374.A O no hydrogen 2.802 N/A ARG 379.A N GLN 375.A O no hydrogen 3.078 N/A ARG 379.A NE ILE 401.A O no hydrogen 3.001 N/A ARG 379.A NH1 ASN 376.A OD1 no hydrogen 3.046 N/A ARG 379.A NH1 GLU 662.A OE2 no hydrogen 2.942 N/A ARG 379.A NH2 ILE 401.A O no hydrogen 3.023 N/A LEU 380.A N TYR 377.A O no hydrogen 3.061 N/A TYR 381.A N PHE 378.A O no hydrogen 3.441 N/A TYR 381.A OH HIS 142.A ND1 no hydrogen 2.564 N/A TYR 381.A OH TYR 377.A OH no hydrogen 2.609 N/A ASP 382.A N HIS 218.A O no hydrogen 3.096 N/A LYS 383.A N HIS 219.A O no hydrogen 3.106 N/A LYS 383.A NZ HIS 110.A O no hydrogen 2.484 N/A ALA 385.A N ALA 221.A O no hydrogen 2.840 N/A GLY 386.A N ASN 113.A O no hydrogen 3.195 N/A MET 387.A N VAL 223.A O no hydrogen 3.032 N/A THR 388.A OG1 ASP 227.A OD1 no hydrogen 2.630 N/A THR 388.A OG1 THR 390.A O no hydrogen 3.475 N/A THR 390.A N THR 388.A OG1 no hydrogen 2.963 N/A THR 390.A OG1 ASP 227.A OD2 no hydrogen 3.233 N/A ALA 391.A N GLU 116.A OE2 no hydrogen 2.592 N/A GLN 392.A N GLU 116.A OE2 no hydrogen 2.744 N/A GLN 392.A NE2 VAL 406.A O no hydrogen 3.024 N/A GLN 392.A NE2 SER 408.A OG no hydrogen 2.836 N/A THR 393.A OG1 GLU 394.A OE2 no hydrogen 2.493 N/A GLU 394.A N ALA 391.A O no hydrogen 2.661 N/A LEU 398.A N GLU 394.A O no hydrogen 2.971 N/A HIS 399.A N ALA 395.A O no hydrogen 2.923 N/A HIS 399.A N ALA 396.A O no hydrogen 3.149 N/A GLU 400.A N ALA 396.A O no hydrogen 2.881 N/A ILE 401.A N GLU 397.A O no hydrogen 3.035 N/A TYR 402.A N LEU 398.A O no hydrogen 3.181 N/A TYR 402.A OH LEU 230.A O no hydrogen 3.174 N/A LYS 403.A N HIS 399.A O no hydrogen 2.946 N/A LYS 403.A NZ HIS 399.A O no hydrogen 3.545 N/A LEU 404.A N LEU 398.A O no hydrogen 3.089 N/A VAL 407.A N VAL 114.A O no hydrogen 2.817 N/A SER 408.A OG GLU 116.A OE1 no hydrogen 3.024 N/A ILE 409.A N GLU 116.A O no hydrogen 2.992 N/A THR 411.A OG1 MET 413.A O no hydrogen 2.864 N/A ASN 412.A N GLU 121.A OE1 no hydrogen 2.618 N/A ARG 417.A NE ASP 419.A OD2 no hydrogen 2.957 N/A ARG 417.A NH1 SER 587.A O no hydrogen 2.694 N/A ARG 417.A NH2 ASP 419.A OD2 no hydrogen 3.454 N/A GLU 418.A N GLY 594.A O no hydrogen 2.750 N/A GLN 420.A N SER 596.A O no hydrogen 2.706 N/A LEU 423.A N PHE 598.A O no hydrogen 3.082 N/A TYR 425.A N LEU 600.A O no hydrogen 2.799 N/A LYS 426.A NZ THR 620.A OG1 no hydrogen 2.648 N/A LYS 426.A NZ LEU 624.A O no hydrogen 3.179 N/A ALA 430.A N THR 427.A OG1 no hydrogen 3.101 N/A LYS 431.A N THR 427.A O no hydrogen 3.263 N/A LYS 431.A NZ THR 571.A O no hydrogen 2.906 N/A LYS 431.A NZ ASP 604.A OD1 no hydrogen 2.673 N/A TYR 432.A N GLU 428.A O no hydrogen 3.245 N/A ILE 433.A N GLU 429.A O no hydrogen 3.301 N/A ALA 434.A N ALA 430.A O no hydrogen 3.066 N/A VAL 435.A N LYS 431.A O no hydrogen 2.931 N/A VAL 436.A N TYR 432.A O no hydrogen 2.913 N/A ASP 437.A N ILE 433.A O no hydrogen 2.912 N/A ASP 438.A N ALA 434.A O no hydrogen 3.020 N/A VAL 439.A N VAL 435.A O no hydrogen 2.869 N/A ALA 440.A N VAL 436.A O no hydrogen 2.736 N/A GLU 441.A N ASP 437.A O no hydrogen 3.074 N/A ARG 442.A N ASP 438.A O no hydrogen 3.023 N/A ARG 442.A NE ASP 438.A OD1 no hydrogen 2.907 N/A ARG 442.A NH1 GLN 447.A OE1 no hydrogen 2.671 N/A ARG 442.A NH2 GLU 595.A OE2 no hydrogen 2.591 N/A TYR 443.A N VAL 439.A O no hydrogen 2.982 N/A ALA 444.A N ALA 440.A O no hydrogen 3.142 N/A LYS 445.A N ARG 442.A O no hydrogen 3.293 N/A GLY 446.A N TYR 443.A O no hydrogen 3.015 N/A GLN 447.A NE2 GLY 565.A O no hydrogen 2.849 N/A VAL 449.A N GLY 496.A O no hydrogen 2.863 N/A LEU 450.A N TYR 567.A O no hydrogen 2.881 N/A ILE 451.A N THR 498.A O no hydrogen 2.761 N/A GLY 452.A N LEU 569.A O no hydrogen 2.958 N/A THR 453.A N ALA 500.A O no hydrogen 3.322 N/A THR 453.A OG1 SER 455.A O no hydrogen 3.188 N/A THR 453.A OG1 SER 459.A OG no hydrogen 2.703 N/A ARG 458.A N SER 455.A OG no hydrogen 3.245 N/A SER 459.A N SER 455.A O no hydrogen 3.371 N/A SER 459.A OG THR 453.A OG1 no hydrogen 2.703 N/A GLU 460.A N VAL 456.A O no hydrogen 2.803 N/A TYR 461.A N GLU 457.A O no hydrogen 2.741 N/A LEU 462.A N ARG 458.A O no hydrogen 2.966 N/A SER 463.A N SER 459.A O no hydrogen 3.047 N/A SER 463.A OG HIS 473.A NE2 no hydrogen 2.641 N/A ARG 464.A N GLU 460.A O no hydrogen 3.159 N/A GLN 465.A N TYR 461.A O no hydrogen 3.128 N/A PHE 466.A N LEU 462.A O no hydrogen 3.055 N/A THR 467.A N SER 463.A O no hydrogen 2.898 N/A THR 467.A OG1 SER 463.A O no hydrogen 3.455 N/A LYS 468.A N ARG 464.A O no hydrogen 2.717 N/A ARG 469.A N PHE 466.A O no hydrogen 2.794 N/A ARG 469.A NH2 ASP 437.A OD1 no hydrogen 2.089 N/A ARG 470.A N THR 467.A O no hydrogen 2.942 N/A ILE 471.A N PHE 466.A O no hydrogen 3.293 N/A HIS 473.A ND1 ILE 471.A O no hydrogen 3.045 N/A HIS 473.A NE2 SER 463.A OG no hydrogen 2.641 N/A ASN 474.A N VAL 497.A O no hydrogen 2.974 N/A LEU 476.A N VAL 499.A O no hydrogen 2.879 N/A LYS 479.A N GLU 484.A OE1 no hydrogen 3.162 N/A GLU 484.A N TYR 480.A O no hydrogen 3.035 N/A ALA 485.A N HIS 481.A O no hydrogen 2.940 N/A THR 486.A N GLU 482.A O no hydrogen 3.272 N/A THR 486.A OG1 GLU 482.A O no hydrogen 3.303 N/A ILE 487.A N GLN 483.A O no hydrogen 3.044 N/A ILE 488.A N GLU 484.A O no hydrogen 2.930 N/A ALA 489.A N ALA 485.A O no hydrogen 2.947 N/A VAL 490.A N ILE 487.A O no hydrogen 3.110 N/A ALA 491.A N ILE 488.A O no hydrogen 2.890 N/A ARG 493.A N VAL 490.A O no hydrogen 3.165 N/A ARG 494.A N GLU 556.A OE2 no hydrogen 2.879 N/A GLY 495.A N GLY 446.A O no hydrogen 2.589 N/A GLY 496.A N ARG 493.A O no hydrogen 3.145 N/A THR 498.A N VAL 449.A O no hydrogen 2.877 N/A VAL 499.A N ASN 474.A O no hydrogen 2.505 N/A ALA 500.A N ILE 451.A O no hydrogen 2.795 N/A THR 501.A N LEU 476.A O no hydrogen 3.212 N/A ASN 502.A N THR 453.A O no hydrogen 2.846 N/A ALA 504.A N THR 501.A O no hydrogen 3.291 N/A ARG 506.A NH1 GLN 582.A OE1 no hydrogen 2.766 N/A ARG 506.A NH2 GLN 582.A OE1 no hydrogen 2.910 N/A GLY 513.A N GLY 492.A O no hydrogen 2.776 N/A GLY 514.A N VAL 511.A O no hydrogen 2.994 N/A ASN 515.A N ALA 489.A O no hydrogen 2.707 N/A ASN 515.A ND2 ASP 509.A O no hydrogen 3.342 N/A VAL 516.A N GLY 514.A O no hydrogen 2.980 N/A PHE 518.A N ASN 515.A OD1 no hydrogen 3.120 N/A LEU 519.A N ASN 515.A O no hydrogen 2.849 N/A THR 520.A N VAL 516.A O no hydrogen 2.991 N/A THR 520.A OG1 VAL 516.A O no hydrogen 3.083 N/A GLN 522.A N PHE 518.A O no hydrogen 3.107 N/A GLN 522.A N LEU 519.A O no hydrogen 3.122 N/A ARG 523.A N LEU 519.A O no hydrogen 3.033 N/A ARG 523.A NH1 GLU 545.A OE2 no hydrogen 2.839 N/A ARG 523.A NH1 GLU 552.A OE1 no hydrogen 3.489 N/A ARG 523.A NH2 GLU 552.A OE1 no hydrogen 2.693 N/A LEU 524.A N THR 520.A O no hydrogen 2.952 N/A ARG 525.A N ASP 521.A O no hydrogen 2.861 N/A ARG 525.A NE ASP 521.A OD1 no hydrogen 3.304 N/A ARG 525.A NE ASP 521.A OD2 no hydrogen 3.072 N/A ARG 525.A NH2 GLU 156.A OE2 no hydrogen 2.968 N/A GLU 526.A N GLN 522.A O no hydrogen 2.995 N/A ARG 527.A N LEU 524.A O no hydrogen 3.255 N/A ARG 527.A NH1 GLU 545.A OE1 no hydrogen 3.083 N/A ARG 527.A NH2 GLU 545.A OE2 no hydrogen 3.443 N/A GLY 528.A N ARG 525.A O no hydrogen 3.104 N/A LEU 529.A N LEU 524.A O no hydrogen 3.107 N/A ASP 530.A N THR 534.A OG1 no hydrogen 2.985 N/A GLU 533.A N ASP 530.A OD1 no hydrogen 2.669 N/A THR 534.A N ASP 530.A O no hydrogen 2.662 N/A THR 534.A OG1 ASP 530.A O no hydrogen 3.201 N/A TYR 538.A N THR 534.A O no hydrogen 2.834 N/A TYR 538.A OH ASP 521.A OD1 no hydrogen 2.314 N/A GLU 539.A N PRO 535.A O no hydrogen 2.943 N/A ALA 540.A N GLU 536.A O no hydrogen 3.147 N/A ALA 541.A N GLU 537.A O no hydrogen 3.121 N/A TRP 542.A N TYR 538.A O no hydrogen 2.835 N/A HIS 543.A N GLU 539.A O no hydrogen 3.020 N/A HIS 543.A ND1 ASP 95.A OD2 no hydrogen 2.761 N/A SER 544.A N ALA 540.A O no hydrogen 3.381 N/A SER 544.A OG ALA 541.A O no hydrogen 3.472 N/A GLU 545.A N ALA 541.A O no hydrogen 2.796 N/A LEU 546.A N TRP 542.A O no hydrogen 3.090 N/A ILE 548.A N GLU 545.A O no hydrogen 3.039 N/A VAL 549.A N GLU 545.A O no hydrogen 2.942 N/A LYS 550.A N LEU 546.A O no hydrogen 2.953 N/A GLU 551.A N PRO 547.A O no hydrogen 3.156 N/A GLU 552.A N ILE 548.A O no hydrogen 3.080 N/A ALA 553.A N VAL 549.A O no hydrogen 2.987 N/A SER 554.A N LYS 550.A O no hydrogen 2.871 N/A GLU 556.A N ALA 553.A O no hydrogen 2.818 N/A ALA 557.A N ALA 553.A O no hydrogen 3.413 N/A LYS 558.A N SER 554.A O no hydrogen 3.206 N/A VAL 560.A N GLU 556.A O no hydrogen 2.846 N/A ILE 561.A N ALA 557.A O no hydrogen 2.963 N/A GLU 562.A N LYS 558.A O no hydrogen 3.063 N/A ALA 563.A N GLU 559.A O no hydrogen 3.087 N/A ALA 563.A N VAL 560.A O no hydrogen 3.207 N/A GLY 564.A N ILE 561.A O no hydrogen 3.125 N/A GLY 565.A N VAL 560.A O no hydrogen 2.937 N/A TYR 567.A N PRO 448.A O no hydrogen 2.971 N/A TYR 567.A OH ASP 438.A OD2 no hydrogen 2.498 N/A VAL 568.A N GLU 595.A O no hydrogen 2.942 N/A LEU 569.A N LEU 450.A O no hydrogen 2.813 N/A GLY 570.A N ARG 597.A O no hydrogen 2.778 N/A ARG 573.A NH1 GLN 643.A OE1 no hydrogen 3.158 N/A ARG 573.A NH2 ASP 422.A OD2 no hydrogen 2.607 N/A HIS 574.A N ASP 580.A OD2 no hydrogen 2.845 N/A ARG 577.A N GLU 647.A OE2 no hydrogen 3.185 N/A ARG 578.A NH1 ASP 227.A OD2 no hydrogen 2.461 N/A ARG 578.A NH1 ASP 232.A OD2 no hydrogen 2.916 N/A ARG 578.A NH2 ASP 232.A OD1 no hydrogen 2.794 N/A ARG 578.A NH2 ASP 232.A OD2 no hydrogen 3.257 N/A ILE 579.A N SER 576.A OG no hydrogen 3.291 N/A ASP 580.A N SER 576.A O no hydrogen 3.379 N/A ASN 581.A N ARG 577.A O no hydrogen 2.923 N/A GLN 582.A N ARG 578.A O no hydrogen 3.060 N/A GLN 582.A NE2 THR 390.A OG1 no hydrogen 3.119 N/A LEU 583.A N ILE 579.A O no hydrogen 3.159 N/A ARG 584.A N ASP 580.A O no hydrogen 3.298 N/A ARG 584.A NH1 ASN 581.A OD1 no hydrogen 3.150 N/A GLY 585.A N ASN 581.A O no hydrogen 2.917 N/A ARG 586.A N LEU 583.A O no hydrogen 2.817 N/A ARG 586.A NH1 THR 508.A O no hydrogen 3.205 N/A ARG 586.A NH2 GLY 505.A O no hydrogen 2.929 N/A SER 587.A N ARG 584.A O no hydrogen 3.206 N/A SER 587.A OG LEU 566.A O no hydrogen 2.794 N/A GLN 590.A NE2 GLY 120.A O no hydrogen 3.364 N/A ASP 592.A N ARG 589.A O no hydrogen 2.648 N/A GLU 595.A N LEU 566.A O no hydrogen 3.246 N/A SER 596.A N GLU 418.A O no hydrogen 2.914 N/A SER 596.A OG ASP 419.A OD1 no hydrogen 2.501 N/A ARG 597.A N VAL 568.A O no hydrogen 2.888 N/A ARG 597.A NE SER 421.A O no hydrogen 3.139 N/A TYR 599.A N GLY 570.A O no hydrogen 2.665 N/A TYR 599.A OH ASP 438.A OD2 no hydrogen 2.769 N/A LEU 600.A N LEU 423.A O no hydrogen 2.753 N/A SER 601.A N ASP 604.A OD2 no hydrogen 2.735 N/A SER 601.A OG ASP 604.A OD1 no hydrogen 2.629 N/A LEU 602.A N TYR 425.A O no hydrogen 3.151 N/A GLY 603.A N SER 601.A OG no hydrogen 3.364 N/A ASP 604.A N SER 601.A O no hydrogen 3.226 N/A ARG 608.A N ASP 604.A O no hydrogen 2.889 N/A ARG 609.A N GLU 605.A O no hydrogen 2.946 N/A ARG 609.A N LEU 606.A O no hydrogen 3.177 N/A PHE 610.A N MET 607.A O no hydrogen 2.909 N/A GLY 612.A N MET 607.A O no hydrogen 2.909 N/A LEU 615.A N ASN 611.A O no hydrogen 3.242 N/A THR 617.A N ALA 613.A O no hydrogen 3.266 N/A THR 617.A OG1 ALA 613.A O no hydrogen 2.727 N/A THR 617.A OG1 ALA 614.A O no hydrogen 2.839 N/A LEU 618.A N ALA 614.A O no hydrogen 3.240 N/A LEU 619.A N LEU 615.A O no hydrogen 2.845 N/A THR 620.A N GLU 616.A O no hydrogen 3.096 N/A THR 620.A OG1 GLU 616.A O no hydrogen 2.983 N/A THR 620.A OG1 GLU 616.A OE1 no hydrogen 3.281 N/A ARG 621.A N THR 617.A O no hydrogen 3.200 N/A LEU 622.A N LEU 618.A O no hydrogen 3.148 N/A LEU 622.A N LEU 619.A O no hydrogen 3.049 N/A ASN 623.A N THR 620.A O no hydrogen 2.890 N/A LEU 624.A N LEU 619.A O no hydrogen 3.426 N/A VAL 628.A N PRO 625.A O no hydrogen 3.178 N/A ILE 630.A N ILE 424.A O no hydrogen 2.813 N/A VAL 635.A N ALA 632.A O no hydrogen 2.922 N/A THR 636.A N ALA 632.A O no hydrogen 3.022 N/A THR 636.A OG1 ALA 632.A O no hydrogen 3.363 N/A ARG 637.A N LYS 633.A O no hydrogen 2.923 N/A ALA 638.A N MET 634.A O no hydrogen 3.243 N/A ILE 639.A N VAL 635.A O no hydrogen 3.074 N/A LYS 640.A N THR 636.A O no hydrogen 3.075 N/A SER 641.A N ARG 637.A O no hydrogen 3.037 N/A ALA 642.A N ALA 638.A O no hydrogen 2.998 N/A GLN 643.A N ILE 639.A O no hydrogen 3.246 N/A GLN 643.A NE2 HIS 574.A O no hydrogen 2.989 N/A GLN 643.A NE2 ASP 580.A OD1 no hydrogen 2.704 N/A THR 644.A N LYS 640.A O no hydrogen 2.835 N/A THR 644.A OG1 LYS 640.A O no hydrogen 2.906 N/A GLN 645.A N SER 641.A O no hydrogen 2.883 N/A GLN 645.A NE2 SER 641.A O no hydrogen 3.342 N/A VAL 646.A N ALA 642.A O no hydrogen 3.132 N/A GLU 647.A N GLN 643.A O no hydrogen 3.074 N/A GLN 648.A N THR 644.A O no hydrogen 2.896 N/A GLN 649.A N GLN 645.A O no hydrogen 2.884 N/A ASN 650.A N VAL 646.A O no hydrogen 2.892 N/A ASN 650.A ND2 GLU 575.A OE1 no hydrogen 2.914 N/A PHE 651.A N GLU 647.A O no hydrogen 2.804 N/A GLU 652.A N GLN 648.A O no hydrogen 3.055 N/A VAL 653.A N GLN 649.A O no hydrogen 3.085 N/A ARG 654.A N ASN 650.A O no hydrogen 3.013 N/A ARG 654.A NH1 GLU 397.A OE2 no hydrogen 2.820 N/A LYS 655.A N PHE 651.A O no hydrogen 2.921 N/A ASN 656.A N GLU 652.A O no hydrogen 2.797 N/A VAL 657.A N VAL 653.A O no hydrogen 2.788 N/A LEU 658.A N ARG 654.A O no hydrogen 3.394 N/A LYS 659.A N LYS 655.A O no hydrogen 3.171 N/A LYS 659.A NZ ASN 656.A OD1 no hydrogen 2.837 N/A TYR 660.A N ASN 656.A O no hydrogen 3.210 N/A ASP 661.A N VAL 657.A O no hydrogen 3.120 N/A GLU 662.A N LEU 658.A O no hydrogen 2.902 N/A ASN 665.A N ASP 661.A O no hydrogen 2.734 N/A GLN 666.A N GLU 662.A O no hydrogen 3.065 N/A GLN 667.A N VAL 663.A O no hydrogen 3.441 N/A GLN 667.A NE2 GLY 815.A O no hydrogen 3.347 N/A ARG 668.A N MET 664.A O no hydrogen 2.903 N/A ARG 668.A NH2 ASP 661.A OD1 no hydrogen 2.649 N/A LYS 669.A N ASN 665.A O no hydrogen 3.236 N/A VAL 670.A N GLN 666.A O no hydrogen 3.428 N/A ILE 671.A N GLN 667.A O no hydrogen 3.180 N/A TYR 672.A N ARG 668.A O no hydrogen 2.647 N/A ALA 673.A N LYS 669.A O no hydrogen 2.921 N/A GLU 674.A N VAL 670.A O no hydrogen 3.124 N/A ARG 675.A N ILE 671.A O no hydrogen 3.060 N/A ARG 675.A NE ASN 205.A O no hydrogen 3.130 N/A ARG 675.A NH1 ASP 780.A OD1 no hydrogen 2.882 N/A ARG 675.A NH2 ALA 207.A O no hydrogen 2.384 N/A ARG 676.A N TYR 672.A O no hydrogen 2.974 N/A ARG 676.A NH2 ASN 205.A OD1 no hydrogen 2.938 N/A ARG 677.A N ALA 673.A O no hydrogen 3.334 N/A ARG 677.A NH2 GLU 674.A OE1 no hydrogen 2.834 N/A ILE 678.A N GLU 674.A O no hydrogen 3.230 N/A LEU 679.A N ARG 675.A O no hydrogen 2.753 N/A GLU 680.A N ARG 676.A O no hydrogen 2.809 N/A GLU 680.A N ARG 677.A O no hydrogen 3.149 N/A GLY 681.A N ILE 678.A O no hydrogen 3.003 N/A LYS 685.A NZ GLU 755.A OE1 no hydrogen 3.130 N/A ALA 688.A N LEU 684.A O no hydrogen 2.697 N/A LEU 689.A N LYS 685.A O no hydrogen 3.035 N/A ASP 690.A N ASP 686.A O no hydrogen 2.858 N/A MET 691.A N GLN 687.A O no hydrogen 3.041 N/A VAL 692.A N ALA 688.A O no hydrogen 3.088 N/A ARG 693.A N LEU 689.A O no hydrogen 2.812 N/A ARG 693.A NH2 ASP 694.A OD1 no hydrogen 3.258 N/A ASP 694.A N ASP 690.A O no hydrogen 2.518 N/A VAL 695.A N MET 691.A O no hydrogen 2.733 N/A ILE 696.A N VAL 692.A O no hydrogen 3.145 N/A THR 697.A N ARG 693.A O no hydrogen 2.917 N/A THR 697.A OG1 ARG 693.A O no hydrogen 2.628 N/A ALA 698.A N ASP 694.A O no hydrogen 3.207 N/A TYR 699.A N VAL 695.A O no hydrogen 3.192 N/A VAL 700.A N ILE 696.A O no hydrogen 3.159 N/A ASP 701.A N THR 697.A O no hydrogen 2.788 N/A GLY 702.A N ALA 698.A O no hydrogen 2.887 N/A ALA 703.A N TYR 699.A O no hydrogen 3.025 N/A ALA 703.A N VAL 700.A O no hydrogen 2.952 N/A THR 704.A N VAL 700.A O no hydrogen 2.684 N/A TYR 708.A N GLU 706.A O no hydrogen 2.660 N/A ALA 709.A N GLY 707.A O no hydrogen 2.763 N/A TRP 712.A NE1 GLU 706.A O no hydrogen 2.741 N/A ALA 716.A N ASP 713.A OD1 no hydrogen 3.363 N/A LEU 717.A N ASP 713.A O no hydrogen 3.285 N/A TRP 718.A N LEU 714.A O no hydrogen 3.202 N/A THR 719.A N ASP 715.A O no hydrogen 3.012 N/A ALA 720.A N ALA 716.A O no hydrogen 2.960 N/A LEU 721.A N LEU 717.A O no hydrogen 2.952 N/A LYS 722.A N TRP 718.A O no hydrogen 2.868 N/A THR 723.A N ALA 720.A O no hydrogen 3.284 N/A THR 723.A OG1 ALA 720.A O no hydrogen 2.819 N/A LEU 724.A N LEU 721.A O no hydrogen 3.190 N/A TYR 725.A N LEU 721.A O no hydrogen 3.146 N/A TYR 725.A OH ASP 746.A OD2 no hydrogen 3.421 N/A VAL 727.A N TYR 725.A O no hydrogen 2.919 N/A GLY 728.A N ASP 746.A OD1 no hydrogen 3.302 N/A GLY 728.A N ASP 746.A OD2 no hydrogen 2.959 N/A SER 733.A OG ILE 729.A O no hydrogen 3.025 N/A SER 733.A OG THR 730.A O no hydrogen 3.315 N/A SER 733.A OG ALA 731.A O no hydrogen 3.428 N/A LEU 734.A N ALA 731.A O no hydrogen 2.633 N/A LEU 743.A N LEU 739.A O no hydrogen 2.850 N/A LEU 744.A N LEU 740.A O no hydrogen 3.056 N/A LYS 745.A N GLU 741.A O no hydrogen 3.190 N/A LYS 745.A NZ GLU 741.A OE2 no hydrogen 2.812 N/A ASP 746.A N ALA 742.A O no hydrogen 3.163 N/A ALA 747.A N LEU 743.A O no hydrogen 2.919 N/A GLU 748.A N LEU 744.A O no hydrogen 2.738 N/A ARG 749.A N LYS 745.A O no hydrogen 3.108 N/A ARG 749.A NH1 ASP 746.A OD1 no hydrogen 2.373 N/A ALA 750.A N ASP 746.A O no hydrogen 2.880 N/A TYR 751.A N ALA 747.A O no hydrogen 2.692 N/A TYR 751.A OH GLU 771.A OE2 no hydrogen 3.331 N/A ALA 752.A N GLU 748.A O no hydrogen 3.141 N/A ALA 753.A N ARG 749.A O no hydrogen 2.871 N/A ARG 754.A N ALA 750.A O no hydrogen 2.774 N/A ARG 754.A NE LEU 834.A O no hydrogen 2.476 N/A ARG 754.A NH2 LEU 834.A O no hydrogen 3.136 N/A ARG 754.A NH2 VAL 837.A O no hydrogen 2.993 N/A GLU 755.A N TYR 751.A O no hydrogen 2.721 N/A ALA 756.A N ALA 752.A O no hydrogen 3.138 N/A GLU 757.A N ALA 753.A O no hydrogen 2.985 N/A LEU 758.A N ARG 754.A O no hydrogen 3.059 N/A LEU 758.A N GLU 755.A O no hydrogen 3.052 N/A GLU 759.A N GLU 755.A O no hydrogen 3.066 N/A GLU 760.A N ALA 756.A O no hydrogen 2.724 N/A ILE 761.A N GLU 757.A O no hydrogen 3.103 N/A ILE 761.A N LEU 758.A O no hydrogen 2.795 N/A ALA 762.A N LEU 758.A O no hydrogen 2.657 N/A GLY 763.A N LEU 758.A O no hydrogen 3.300 N/A GLY 765.A N GLU 759.A OE1 no hydrogen 3.190 N/A GLY 765.A N GLU 759.A OE2 no hydrogen 3.241 N/A ALA 766.A N GLY 763.A O no hydrogen 2.784 N/A ARG 768.A N GLY 765.A O no hydrogen 2.880 N/A ARG 768.A NH1 GLU 771.A OE1 no hydrogen 2.572 N/A ARG 768.A NH2 GLU 755.A OE1 no hydrogen 2.720 N/A GLN 769.A NE2 GLN 769.A O no hydrogen 3.581 N/A GLN 769.A NE2 ASN 773.A OD1 no hydrogen 3.306 N/A LEU 770.A N ALA 766.A O no hydrogen 3.278 N/A LEU 770.A N MET 767.A O no hydrogen 3.039 N/A GLU 771.A N MET 767.A O no hydrogen 3.107 N/A ARG 772.A N ARG 768.A O no hydrogen 3.275 N/A ARG 772.A NE GLU 682.A O no hydrogen 2.886 N/A ASN 773.A N GLN 769.A O no hydrogen 3.012 N/A VAL 774.A N LEU 770.A O no hydrogen 2.966 N/A LEU 775.A N GLU 771.A O no hydrogen 3.123 N/A LEU 776.A N ARG 772.A O no hydrogen 3.004 N/A ASN 777.A N ASN 773.A O no hydrogen 2.974 N/A VAL 778.A N VAL 774.A O no hydrogen 3.006 N/A ILE 779.A N LEU 775.A O no hydrogen 2.973 N/A ASP 780.A N LEU 776.A O no hydrogen 3.016 N/A ARG 781.A N ASN 777.A O no hydrogen 3.350 N/A ARG 781.A NH2 GLU 829.A OE1 no hydrogen 2.033 N/A LYS 782.A N VAL 778.A O no hydrogen 2.961 N/A TRP 783.A N ILE 779.A O no hydrogen 2.739 N/A ARG 784.A N ASP 780.A O no hydrogen 2.945 N/A GLU 785.A N ARG 781.A O no hydrogen 3.187 N/A HIS 786.A N LYS 782.A O no hydrogen 3.043 N/A HIS 786.A NE2 GLN 667.A OE1 no hydrogen 2.778 N/A LEU 787.A N TRP 783.A O no hydrogen 2.891 N/A TYR 788.A N ARG 784.A O no hydrogen 3.322 N/A GLU 789.A N GLU 785.A O no hydrogen 3.311 N/A MET 790.A N HIS 786.A O no hydrogen 2.782 N/A ASP 791.A N LEU 787.A O no hydrogen 2.597 N/A TYR 792.A OH TYR 788.A OH no hydrogen 3.114 N/A LEU 793.A N GLU 789.A O no hydrogen 2.896 N/A LYS 794.A N MET 790.A O no hydrogen 3.131 N/A GLU 795.A N ASP 791.A O no hydrogen 3.459 N/A GLY 796.A N TYR 792.A O no hydrogen 3.430 N/A LEU 799.A N GLY 796.A O no hydrogen 3.306 N/A ARG 800.A N ILE 797.A O no hydrogen 2.884 N/A ARG 800.A NH1 GLU 814.A OE2 no hydrogen 3.233 N/A ARG 800.A NH2 GLU 814.A OE2 no hydrogen 2.999 N/A MET 802.A N ARG 800.A O no hydrogen 2.718 N/A ARG 805.A NH2 GLN 804.A OE1 no hydrogen 3.074 N/A VAL 809.A N ASP 806.A O no hydrogen 3.027 N/A TYR 811.A N PRO 807.A O no hydrogen 3.142 N/A GLN 812.A N LEU 808.A O no hydrogen 2.907 N/A ARG 813.A N VAL 809.A O no hydrogen 3.047 N/A ARG 813.A NE GLU 810.A OE2 no hydrogen 3.327 N/A ARG 813.A NH2 GLU 810.A OE1 no hydrogen 2.723 N/A GLU 814.A N GLU 810.A O no hydrogen 3.160 N/A GLY 815.A N TYR 811.A O no hydrogen 2.986 N/A TYR 816.A N GLN 812.A O no hydrogen 2.700 N/A ASP 817.A N ARG 813.A O no hydrogen 2.821 N/A MET 818.A N GLU 814.A O no hydrogen 3.048 N/A PHE 819.A N GLY 815.A O no hydrogen 2.998 N/A MET 820.A N TYR 816.A O no hydrogen 2.961 N/A ALA 821.A N ASP 817.A O no hydrogen 2.867 N/A MET 822.A N MET 818.A O no hydrogen 2.791 N/A LEU 823.A N PHE 819.A O no hydrogen 2.897 N/A ASP 824.A N MET 820.A O no hydrogen 3.011 N/A GLY 825.A N ALA 821.A O no hydrogen 2.976 N/A MET 826.A N LEU 823.A O no hydrogen 2.933 N/A LYS 827.A N LEU 823.A O no hydrogen 3.179 N/A LYS 827.A N ASP 824.A O no hydrogen 2.833 N/A LYS 827.A NZ ASP 694.A OD2 no hydrogen 3.013 N/A LYS 827.A NZ ASP 824.A OD1 no hydrogen 3.371 N/A GLU 828.A N ASP 824.A O no hydrogen 2.990 N/A GLU 829.A N GLY 825.A O no hydrogen 3.249 N/A SER 830.A N MET 826.A O no hydrogen 3.246 N/A SER 830.A OG MET 826.A O no hydrogen 3.123 N/A VAL 831.A N LYS 827.A O no hydrogen 3.104 N/A GLY 832.A N GLU 828.A O no hydrogen 3.125 N/A PHE 833.A N GLU 829.A O no hydrogen 3.125 N/A LEU 834.A N SER 830.A O no hydrogen 2.858 N/A PHE 835.A N VAL 831.A O no hydrogen 2.968 N/A PHE 835.A N GLY 832.A O no hydrogen 2.855 N/A ASN 836.A N GLY 832.A O no hydrogen 2.883 N/A ASN 836.A ND2 LEU 724.A O no hydrogen 3.093 N/A VAL 837.A N PHE 833.A O no hydrogen 2.911 N/A THR 838.A N GLU 297.A O no hydrogen 2.762 N/A THR 838.A OG1 GLU 297.A O no hydrogen 3.079 N/A