Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4ceh_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 1.A N GLU 221.A O no hydrogen 2.775 N/A ALA 2.A N ASP 264.A O no hydrogen 3.226 N/A GLU 3.A N ILE 223.A O no hydrogen 2.945 N/A PHE 4.A N THR 266.A O no hydrogen 2.963 N/A LEU 5.A N PHE 225.A O no hydrogen 2.925 N/A VAL 6.A N LYS 268.A O no hydrogen 2.968 N/A ARG 8.A NE GLU 286.A O no hydrogen 2.697 N/A ARG 8.A NH1 ASP 230.A OD2 no hydrogen 2.755 N/A ARG 8.A NH1 GLU 290.A OE2 no hydrogen 3.036 N/A ARG 8.A NH2 GLU 286.A O no hydrogen 2.711 N/A SER 9.A OG SER 647.A OG no hydrogen 2.830 N/A SER 11.A N ARG 8.A O no hydrogen 3.285 N/A SER 11.A OG ARG 8.A O no hydrogen 2.492 N/A GLY 12.A N GLU 274.A OE1 no hydrogen 2.347 N/A LYS 13.A N SER 11.A O no hydrogen 2.373 N/A LYS 13.A NZ LEU 5.A O no hydrogen 3.038 N/A LYS 13.A NZ SER 226.A OG no hydrogen 2.382 N/A LYS 13.A NZ LEU 227.A O no hydrogen 3.022 N/A LYS 15.A NZ ASN 19.A OD1 no hydrogen 2.340 N/A LEU 16.A N GLY 12.A O no hydrogen 3.086 N/A ILE 17.A N LYS 13.A O no hydrogen 3.426 N/A ILE 18.A N THR 14.A O no hydrogen 3.426 N/A ASN 19.A N LYS 15.A O no hydrogen 2.888 N/A ASN 19.A ND2 GLN 22.A OE1 no hydrogen 2.744 N/A SER 20.A N LEU 16.A O no hydrogen 2.975 N/A SER 20.A OG LEU 16.A O no hydrogen 2.566 N/A ILE 21.A N ILE 17.A O no hydrogen 2.895 N/A GLN 22.A N ILE 18.A O no hydrogen 2.726 N/A GLN 22.A NE2 GLU 49.A O no hydrogen 3.442 N/A ASP 23.A N ASN 19.A O no hydrogen 3.028 N/A GLU 24.A N SER 20.A O no hydrogen 2.935 N/A LEU 25.A N ILE 21.A O no hydrogen 2.974 N/A ARG 26.A N GLN 22.A O no hydrogen 2.952 N/A ARG 26.A NE ASP 55.A OD1 no hydrogen 2.988 N/A ARG 27.A N ASP 23.A O no hydrogen 2.991 N/A ALA 28.A N GLU 24.A O no hydrogen 3.392 N/A ILE 34.A N ARG 61.A O no hydrogen 2.968 N/A ILE 35.A N HIS 196.A O no hydrogen 2.619 N/A PHE 36.A N GLN 63.A O no hydrogen 2.872 N/A LEU 37.A N TYR 198.A O no hydrogen 2.517 N/A VAL 38.A N PHE 65.A O no hydrogen 3.092 N/A GLN 41.A N GLN 41.A OE1 no hydrogen 2.696 N/A MET 42.A N PRO 39.A O no hydrogen 2.914 N/A THR 43.A OG1 ASP 40.A O no hydrogen 3.306 N/A MET 46.A N MET 42.A O no hydrogen 3.250 N/A GLU 47.A N THR 43.A O no hydrogen 2.956 N/A TYR 48.A N PHE 44.A O no hydrogen 2.973 N/A TYR 48.A N LEU 45.A O no hydrogen 3.222 N/A GLU 49.A N LEU 45.A O no hydrogen 2.988 N/A LEU 50.A N MET 46.A O no hydrogen 2.882 N/A LYS 52.A N GLU 49.A O no hydrogen 3.114 N/A MET 56.A N THR 53.A O no hydrogen 3.280 N/A GLY 57.A N THR 53.A O no hydrogen 2.628 N/A GLY 57.A N THR 53.A OG1 no hydrogen 3.376 N/A ARG 61.A NE LYS 32.A O no hydrogen 2.343 N/A ARG 61.A NH1 ALA 28.A O no hydrogen 3.445 N/A ARG 61.A NH2 LYS 32.A O no hydrogen 3.105 N/A GLN 63.A N ILE 34.A O no hydrogen 2.866 N/A GLN 63.A NE2 ILE 34.A O no hydrogen 3.236 N/A PHE 65.A N PHE 36.A O no hydrogen 2.633 N/A ARG 69.A N SER 66.A OG no hydrogen 3.215 N/A LEU 70.A N SER 66.A O no hydrogen 2.844 N/A ALA 71.A N PHE 67.A O no hydrogen 2.922 N/A TRP 72.A N SER 68.A O no hydrogen 2.868 N/A ARG 73.A N ARG 69.A O no hydrogen 2.990 N/A ARG 73.A NH1 GLN 63.A OE1 no hydrogen 3.046 N/A ARG 73.A NH2 GLN 63.A OE1 no hydrogen 3.153 N/A VAL 74.A N LEU 70.A O no hydrogen 2.978 N/A LEU 75.A N ALA 71.A O no hydrogen 2.912 N/A GLN 76.A N ARG 73.A O no hydrogen 2.952 N/A HIS 77.A N VAL 74.A O no hydrogen 3.141 N/A THR 78.A N VAL 74.A O no hydrogen 2.851 N/A THR 78.A OG1 VAL 74.A O no hydrogen 2.886 N/A THR 78.A OG1 HIS 185.A ND1 no hydrogen 3.076 N/A GLY 79.A N LEU 75.A O no hydrogen 2.842 N/A ARG 83.A N GLY 80.A O no hydrogen 3.280 N/A THR 87.A OG1 GLU 538.A OE2 no hydrogen 2.253 N/A SER 88.A OG GLU 123.A OE2 no hydrogen 3.385 N/A THR 89.A OG1 GLU 538.A OE1 no hydrogen 3.447 N/A VAL 91.A N THR 87.A O no hydrogen 3.069 N/A GLN 92.A N SER 88.A O no hydrogen 2.930 N/A MET 93.A N THR 89.A O no hydrogen 2.924 N/A LEU 94.A N GLY 90.A O no hydrogen 3.030 N/A LEU 95.A N VAL 91.A O no hydrogen 2.883 N/A ARG 96.A N GLN 92.A O no hydrogen 2.845 N/A ARG 96.A NE ARG 96.A O no hydrogen 3.396 N/A ARG 96.A NH1 LYS 115.A O no hydrogen 3.245 N/A ARG 96.A NH2 SER 113.A O no hydrogen 2.320 N/A LYS 97.A N MET 93.A O no hydrogen 3.064 N/A LEU 98.A N LEU 94.A O no hydrogen 2.940 N/A ILE 99.A N LEU 95.A O no hydrogen 2.833 N/A GLU 100.A N ARG 96.A O no hydrogen 3.041 N/A GLU 101.A N LEU 98.A O no hydrogen 3.352 N/A HIS 102.A N ILE 99.A O no hydrogen 3.197 N/A HIS 102.A ND1 LEU 98.A O no hydrogen 3.054 N/A GLN 104.A N GLN 104.A OE1 no hydrogen 2.684 N/A GLN 104.A NE2 GLU 101.A O no hydrogen 3.080 N/A GLU 105.A N HIS 102.A O no hydrogen 3.308 N/A PHE 106.A N LYS 103.A O no hydrogen 3.330 N/A LYS 107.A N ASP 156.A OD1 no hydrogen 2.984 N/A LYS 107.A N ASP 156.A OD2 no hydrogen 3.253 N/A VAL 108.A N ASP 156.A OD2 no hydrogen 3.177 N/A TYR 109.A N ASP 156.A OD2 no hydrogen 2.882 N/A SER 113.A OG GLN 110.A O no hydrogen 2.923 N/A ASP 114.A N LYS 111.A O no hydrogen 3.471 N/A LYS 115.A N ALA 112.A O no hydrogen 3.219 N/A THR 119.A OG1 GLN 92.A O no hydrogen 3.161 N/A ALA 120.A N GLY 117.A O no hydrogen 3.207 N/A GLN 121.A N GLY 117.A O no hydrogen 3.083 N/A VAL 122.A N PHE 118.A O no hydrogen 2.884 N/A GLU 123.A N THR 119.A O no hydrogen 3.090 N/A ARG 124.A N ALA 120.A O no hydrogen 2.992 N/A MET 125.A N GLN 121.A O no hydrogen 3.044 N/A LEU 126.A N VAL 122.A O no hydrogen 2.858 N/A THR 127.A N GLU 123.A O no hydrogen 2.925 N/A THR 127.A OG1 GLU 123.A O no hydrogen 2.889 N/A THR 127.A OG1 GLU 123.A OE2 no hydrogen 3.321 N/A GLU 128.A N ARG 124.A O no hydrogen 3.033 N/A PHE 129.A N MET 125.A O no hydrogen 2.970 N/A LYS 130.A N LEU 126.A O no hydrogen 2.982 N/A LYS 130.A NZ GLU 165.A OE1 no hydrogen 2.930 N/A ARG 131.A N THR 127.A O no hydrogen 2.946 N/A ARG 131.A NE GLU 176.A OE1 no hydrogen 2.998 N/A ARG 131.A NH2 GLU 176.A OE2 no hydrogen 3.290 N/A CYS 133.A N LYS 130.A O no hydrogen 3.429 N/A LEU 134.A N PHE 129.A O no hydrogen 2.957 N/A GLU 135.A N ASP 138.A OD2 no hydrogen 3.158 N/A ASP 138.A N GLU 135.A O no hydrogen 2.803 N/A ILE 139.A N GLU 135.A O no hydrogen 3.330 N/A ARG 140.A N PRO 136.A O no hydrogen 2.941 N/A ARG 141.A N GLU 137.A O no hydrogen 2.960 N/A ARG 141.A NH1 ASP 138.A OD1 no hydrogen 2.562 N/A MET 142.A N ASP 138.A O no hydrogen 2.997 N/A ALA 143.A N ILE 139.A O no hydrogen 2.913 N/A GLU 144.A N ARG 140.A O no hydrogen 2.845 N/A SER 145.A N ARG 141.A O no hydrogen 3.077 N/A LEU 150.A N GLY 146.A O no hydrogen 3.198 N/A SER 151.A N GLU 147.A O no hydrogen 2.836 N/A SER 151.A OG GLU 147.A O no hydrogen 3.180 N/A SER 151.A OG ARG 148.A O no hydrogen 2.573 N/A GLU 152.A N ARG 148.A O no hydrogen 3.068 N/A LYS 153.A N VAL 149.A O no hydrogen 2.971 N/A LYS 153.A NZ TYR 109.A OH no hydrogen 3.458 N/A LYS 153.A NZ VAL 611.A O no hydrogen 2.886 N/A LEU 154.A N LEU 150.A O no hydrogen 2.983 N/A HIS 155.A N SER 151.A O no hydrogen 2.984 N/A HIS 155.A ND1 ASP 156.A OD1 no hydrogen 3.138 N/A ASP 156.A N GLU 152.A O no hydrogen 3.051 N/A LEU 157.A N LYS 153.A O no hydrogen 2.912 N/A SER 158.A N LEU 154.A O no hydrogen 2.886 N/A ILE 159.A N HIS 155.A O no hydrogen 3.116 N/A LEU 160.A N ASP 156.A O no hydrogen 3.119 N/A TYR 161.A N LEU 157.A O no hydrogen 2.781 N/A TYR 161.A OH LEU 134.A O no hydrogen 2.901 N/A GLN 162.A N SER 158.A O no hydrogen 2.872 N/A GLN 163.A N ILE 159.A O no hydrogen 3.008 N/A MET 164.A N LEU 160.A O no hydrogen 2.968 N/A GLU 165.A N TYR 161.A O no hydrogen 2.939 N/A LYS 166.A N GLN 162.A O no hydrogen 2.911 N/A SER 167.A N GLN 163.A O no hydrogen 2.981 N/A SER 167.A OG GLN 163.A O no hydrogen 2.727 N/A LEU 168.A N MET 164.A O no hydrogen 2.858 N/A TYR 172.A N LEU 168.A O no hydrogen 3.177 N/A HIS 174.A N ASP 177.A OD2 no hydrogen 3.287 N/A SER 175.A OG LEU 86.A O no hydrogen 2.574 N/A GLU 176.A N HIS 174.A ND1 no hydrogen 3.077 N/A ASP 177.A N HIS 174.A O no hydrogen 3.109 N/A THR 180.A OG1 ASP 177.A O no hydrogen 2.913 N/A LEU 181.A N ASP 177.A O no hydrogen 3.082 N/A LEU 182.A N TYR 178.A O no hydrogen 2.875 N/A ALA 183.A N LEU 179.A O no hydrogen 3.005 N/A HIS 185.A N LEU 182.A O no hydrogen 3.133 N/A HIS 185.A ND1 THR 78.A OG1 no hydrogen 3.076 N/A ILE 186.A N LEU 182.A O no hydrogen 3.054 N/A ALA 189.A N ILE 186.A O no hydrogen 3.074 N/A LYS 193.A N GLU 190.A O no hydrogen 3.127 N/A LYS 193.A NZ PRO 187.A O no hydrogen 3.566 N/A ALA 195.A N ILE 192.A O no hydrogen 3.285 N/A HIS 196.A N PRO 33.A O no hydrogen 3.085 N/A ILE 197.A N HIS 222.A O no hydrogen 3.146 N/A TYR 198.A N ILE 35.A O no hydrogen 2.627 N/A VAL 199.A N THR 224.A O no hydrogen 2.897 N/A ASP 200.A N LEU 37.A O no hydrogen 3.270 N/A THR 206.A N GLU 209.A OE1 no hydrogen 3.116 N/A THR 206.A OG1 ARG 131.A O no hydrogen 3.358 N/A GLN 208.A N ARG 131.A O no hydrogen 3.424 N/A GLU 209.A N THR 206.A OG1 no hydrogen 3.124 N/A PHE 210.A N THR 206.A O no hydrogen 2.740 N/A ARG 211.A N PRO 207.A O no hydrogen 2.997 N/A LEU 213.A N GLU 209.A O no hydrogen 2.882 N/A GLU 214.A N PHE 210.A O no hydrogen 2.900 N/A GLN 215.A N ARG 211.A O no hydrogen 3.079 N/A LEU 216.A N VAL 212.A O no hydrogen 2.945 N/A MET 217.A N LEU 213.A O no hydrogen 2.930 N/A VAL 218.A N GLU 214.A O no hydrogen 3.070 N/A HIS 219.A N GLN 215.A O no hydrogen 3.080 N/A HIS 222.A NE2 GLU 3.A OE1 no hydrogen 2.670 N/A THR 224.A N ILE 197.A O no hydrogen 3.150 N/A THR 224.A OG1 GLU 3.A OE1 no hydrogen 2.610 N/A PHE 225.A N GLU 3.A O no hydrogen 3.208 N/A SER 226.A N VAL 199.A O no hydrogen 2.833 N/A SER 226.A OG ASP 200.A OD1 no hydrogen 3.017 N/A LEU 227.A N LEU 5.A O no hydrogen 3.059 N/A LYS 231.A N GLU 269.A OE2 no hydrogen 3.196 N/A SER 233.A OG ARG 236.A O no hydrogen 2.901 N/A HIS 239.A N GLU 242.A OE1 no hydrogen 2.598 N/A LEU 241.A N HIS 239.A ND1 no hydrogen 3.035 N/A ARG 245.A N LEU 243.A O no hydrogen 3.021 N/A ARG 245.A NH1 ASP 637.A OD1 no hydrogen 2.467 N/A THR 247.A OG1 THR 228.A O no hydrogen 2.786 N/A GLY 248.A N PHE 244.A O no hydrogen 3.250 N/A LYS 249.A N ARG 245.A O no hydrogen 3.008 N/A LYS 249.A NZ GLU 237.A OE1 no hydrogen 2.479 N/A THR 250.A N MET 246.A O no hydrogen 3.045 N/A THR 250.A OG1 MET 246.A O no hydrogen 3.357 N/A THR 250.A OG1 THR 247.A O no hydrogen 2.634 N/A TYR 251.A N THR 247.A O no hydrogen 2.868 N/A TYR 252.A N GLY 248.A O no hydrogen 2.948 N/A ARG 253.A N LYS 249.A O no hydrogen 2.850 N/A LEU 254.A N THR 250.A O no hydrogen 2.908 N/A HIS 255.A N TYR 252.A O no hydrogen 3.194 N/A HIS 255.A ND1 TYR 251.A O no hydrogen 2.428 N/A LYS 257.A NZ GLU 214.A OE1 no hydrogen 2.979 N/A LYS 257.A NZ GLU 260.A OE2 no hydrogen 2.754 N/A ALA 258.A N LEU 254.A O no hydrogen 2.901 N/A LYS 259.A N HIS 255.A O no hydrogen 2.836 N/A GLU 260.A N GLN 256.A O no hydrogen 2.989 N/A ASN 262.A N LYS 259.A O no hydrogen 3.155 N/A LEU 263.A N ALA 258.A O no hydrogen 3.136 N/A THR 266.A N ALA 2.A O no hydrogen 3.187 N/A LYS 268.A NZ GLU 3.A OE2 no hydrogen 2.319 N/A ARG 275.A N GLY 10.A O no hydrogen 2.991 N/A ARG 275.A NE SER 647.A O no hydrogen 3.062 N/A ARG 275.A NH2 SER 647.A O no hydrogen 3.531 N/A HIS 276.A N THR 273.A O no hydrogen 3.186 N/A THR 277.A OG1 THR 273.A O no hydrogen 2.781 N/A THR 277.A OG1 GLU 274.A O no hydrogen 3.099 N/A LYS 278.A NZ SER 650.A OG no hydrogen 3.152 N/A LYS 278.A NZ ASP 651.A OD1 no hydrogen 3.270 N/A THR 279.A OG1 ASP 651.A O no hydrogen 3.213 N/A GLN 288.A N HIS 284.A O no hydrogen 3.096 N/A GLN 297.A NE2 LEU 300.A O no hydrogen 3.283 N/A GLN 297.A NE2 LYS 684.A O no hydrogen 3.137 N/A GLU 298.A N GLU 281.A OE2 no hydrogen 2.686 N/A ALA 299.A N GLU 281.A OE2 no hydrogen 3.302 N/A THR 301.A N LEU 653.A O no hydrogen 3.060 N/A MET 303.A N VAL 655.A O no hydrogen 2.798 N/A GLN 304.A N ARG 686.A O no hydrogen 2.889 N/A GLN 304.A NE2 TYR 657.A OH no hydrogen 2.874 N/A ALA 305.A N TYR 657.A O no hydrogen 2.921 N/A ARG 308.A NH1 TYR 343.A OH no hydrogen 3.179 N/A ARG 309.A NE GLU 313.A OE2 no hydrogen 2.623 N/A ALA 310.A N ASN 307.A OD1 no hydrogen 2.680 N/A GLU 311.A N ASN 307.A O no hydrogen 2.987 N/A LEU 312.A N ARG 308.A O no hydrogen 2.982 N/A GLU 313.A N ARG 309.A O no hydrogen 2.922 N/A GLY 314.A N ALA 310.A O no hydrogen 2.887 N/A GLY 314.A N GLU 311.A O no hydrogen 3.266 N/A ILE 315.A N GLU 311.A O no hydrogen 2.894 N/A ALA 316.A N LEU 312.A O no hydrogen 2.908 N/A ARG 317.A NH2 ASN 690.A OD1 no hydrogen 3.355 N/A GLU 318.A N GLY 314.A O no hydrogen 3.042 N/A ILE 319.A N ILE 315.A O no hydrogen 2.922 N/A HIS 320.A N ALA 316.A O no hydrogen 2.911 N/A HIS 320.A NE2 TYR 354.A O no hydrogen 2.823 N/A ALA 321.A N ARG 317.A O no hydrogen 2.877 N/A LEU 322.A N GLU 318.A O no hydrogen 2.896 N/A VAL 323.A N ILE 319.A O no hydrogen 3.071 N/A ARG 324.A N HIS 320.A O no hydrogen 2.917 N/A ARG 324.A NH2 HIS 320.A ND1 no hydrogen 2.967 N/A ARG 324.A NH2 VAL 705.A O no hydrogen 3.302 N/A GLU 325.A N ALA 321.A O no hydrogen 2.841 N/A LYS 326.A N ALA 321.A O no hydrogen 3.400 N/A TYR 328.A N LEU 322.A O no hydrogen 2.793 N/A TYR 328.A OH ASP 651.A OD2 no hydrogen 2.827 N/A ARG 329.A N ASP 332.A OD2 no hydrogen 2.716 N/A ARG 329.A NH2 ASP 574.A OD2 no hydrogen 3.487 N/A ASP 332.A N ARG 329.A O no hydrogen 3.057 N/A VAL 333.A N TYR 330.A O no hydrogen 3.274 N/A ALA 334.A N CYS 591.A O no hydrogen 2.699 N/A ILE 335.A N PHE 577.A O no hydrogen 2.773 N/A LEU 336.A N PHE 593.A O no hydrogen 2.772 N/A ALA 337.A N GLY 579.A O no hydrogen 3.064 N/A ARG 338.A NE GLU 638.A OE1 no hydrogen 2.778 N/A ARG 338.A NH1 ARG 338.A O no hydrogen 3.521 N/A ARG 338.A NH2 GLU 638.A OE1 no hydrogen 3.388 N/A ARG 338.A NH2 GLU 638.A OE2 no hydrogen 2.672 N/A ASP 342.A N GLN 339.A O no hydrogen 3.079 N/A TYR 343.A N PRO 340.A O no hydrogen 3.049 N/A TYR 343.A OH GLU 311.A OE1 no hydrogen 3.022 N/A LYS 344.A N PRO 340.A O no hydrogen 2.947 N/A MET 346.A N TYR 343.A O no hydrogen 2.971 N/A VAL 347.A N TYR 343.A O no hydrogen 2.552 N/A LYS 348.A N LYS 344.A O no hydrogen 3.030 N/A VAL 350.A N MET 346.A O no hydrogen 2.908 N/A PHE 351.A N VAL 347.A O no hydrogen 3.019 N/A ALA 352.A N LYS 348.A O no hydrogen 3.046 N/A ASP 353.A N GLU 349.A O no hydrogen 2.993 N/A TYR 354.A N VAL 350.A O no hydrogen 2.789 N/A TYR 354.A OH GLU 313.A OE1 no hydrogen 2.708 N/A ILE 356.A N PHE 351.A O no hydrogen 2.699 N/A PHE 359.A N VAL 576.A O no hydrogen 2.916 N/A ASP 361.A N VAL 578.A O no hydrogen 3.263 N/A GLY 362.A N ILE 360.A O no hydrogen 2.760 N/A HIS 369.A N MET 366.A O no hydrogen 2.796 N/A HIS 369.A NE2 HIS 525.A ND1 no hydrogen 3.124 N/A LEU 371.A N HIS 369.A ND1 no hydrogen 3.137 N/A GLU 373.A N HIS 369.A O no hydrogen 3.158 N/A PHE 374.A N PRO 370.A O no hydrogen 2.956 N/A ILE 375.A N LEU 371.A O no hydrogen 3.083 N/A ARG 376.A N ILE 372.A O no hydrogen 2.914 N/A SER 377.A N GLU 373.A O no hydrogen 2.899 N/A SER 377.A OG GLU 373.A O no hydrogen 2.668 N/A SER 377.A OG PHE 374.A O no hydrogen 3.485 N/A SER 378.A N PHE 374.A O no hydrogen 3.130 N/A SER 378.A OG PHE 374.A O no hydrogen 2.367 N/A SER 378.A OG TYR 496.A OH no hydrogen 3.162 N/A LEU 379.A N ILE 375.A O no hydrogen 3.084 N/A ASP 380.A N ARG 376.A O no hydrogen 2.963 N/A VAL 381.A N SER 377.A O no hydrogen 2.949 N/A LEU 382.A N SER 378.A O no hydrogen 3.100 N/A LYS 383.A N LEU 379.A O no hydrogen 2.948 N/A GLY 384.A N ASP 380.A O no hydrogen 2.909 N/A TRP 386.A N VAL 381.A O no hydrogen 2.729 N/A ARG 387.A NE GLY 384.A O no hydrogen 2.887 N/A ARG 387.A NE ASN 385.A O no hydrogen 3.143 N/A ARG 387.A NH2 ASN 385.A O no hydrogen 2.713 N/A TYR 388.A OH GLU 418.A OE2 no hydrogen 3.142 N/A VAL 391.A N ARG 387.A O no hydrogen 3.003 N/A PHE 392.A N TYR 388.A O no hydrogen 3.244 N/A ARG 393.A N GLU 389.A O no hydrogen 3.013 N/A ARG 393.A NH1 GLU 373.A OE2 no hydrogen 2.671 N/A ARG 393.A NH2 ASP 380.A OD2 no hydrogen 2.506 N/A CYS 394.A N ALA 390.A O no hydrogen 3.042 N/A CYS 394.A SG SER 378.A OG no hydrogen 3.249 N/A CYS 394.A SG TYR 496.A OH no hydrogen 3.586 N/A VAL 395.A N VAL 391.A O no hydrogen 2.984 N/A LYS 396.A N PHE 392.A O no hydrogen 3.011 N/A LYS 396.A NZ GLU 418.A OE1 no hydrogen 3.356 N/A THR 397.A OG1 CYS 394.A O no hydrogen 3.038 N/A GLU 398.A N VAL 395.A O no hydrogen 2.896 N/A PHE 401.A N GLU 398.A O no hydrogen 3.200 N/A LYS 409.A N PRO 406.A O no hydrogen 2.908 N/A VAL 410.A N PRO 406.A O no hydrogen 2.922 N/A ARG 411.A N LYS 407.A O no hydrogen 2.983 N/A ARG 411.A NH1 GLU 398.A OE2 no hydrogen 2.340 N/A GLN 413.A N LYS 409.A O no hydrogen 3.111 N/A GLN 413.A N VAL 410.A O no hydrogen 3.118 N/A VAL 414.A N VAL 410.A O no hydrogen 2.925 N/A ASP 415.A N ARG 411.A O no hydrogen 2.940 N/A LEU 417.A N GLN 413.A O no hydrogen 3.090 N/A GLU 418.A N VAL 414.A O no hydrogen 2.786 N/A ASN 419.A N ASP 415.A O no hydrogen 2.952 N/A TYR 420.A N GLN 416.A O no hydrogen 3.169 N/A TYR 420.A OH GLN 438.A O no hydrogen 2.859 N/A CYS 421.A N LEU 417.A O no hydrogen 2.851 N/A CYS 421.A SG LEU 417.A O no hydrogen 3.104 N/A ILE 422.A N GLU 418.A O no hydrogen 2.903 N/A ALA 423.A N ASN 419.A O no hydrogen 3.068 N/A TYR 424.A N TYR 420.A O no hydrogen 2.978 N/A ILE 426.A N CYS 421.A O no hydrogen 3.109 N/A GLY 428.A N TRP 386.A O no hydrogen 3.081 N/A ARG 430.A N LYS 427.A O no hydrogen 3.347 N/A ARG 430.A NH1 ASP 435.A O no hydrogen 3.399 N/A TRP 431.A N GLY 428.A O no hydrogen 3.077 N/A THR 432.A OG1 ASP 429.A O no hydrogen 3.132 N/A ARG 436.A NH2 ASN 460.A OD1 no hydrogen 2.704 N/A PHE 437.A N ASN 463.A OD1 no hydrogen 2.736 N/A ARG 441.A N GLU 455.A OE2 no hydrogen 3.191 N/A SER 444.A OG ASP 447.A OD2 no hydrogen 3.192 N/A ASP 447.A N SER 444.A O no hydrogen 3.280 N/A ILE 456.A N THR 452.A O no hydrogen 3.035 N/A GLU 457.A N ASP 453.A O no hydrogen 2.953 N/A MET 458.A N GLN 454.A O no hydrogen 2.861 N/A GLU 459.A N GLU 455.A O no hydrogen 2.884 N/A ASN 460.A N ILE 456.A O no hydrogen 2.904 N/A MET 461.A N GLU 457.A O no hydrogen 3.090 N/A LEU 462.A N MET 458.A O no hydrogen 2.901 N/A ASN 463.A N GLU 459.A O no hydrogen 2.928 N/A ASN 463.A ND2 PHE 437.A O no hydrogen 2.959 N/A ASN 463.A ND2 GLU 459.A O no hydrogen 2.809 N/A ASP 464.A N ASN 460.A O no hydrogen 2.868 N/A THR 465.A N MET 461.A O no hydrogen 3.004 N/A THR 465.A OG1 MET 461.A O no hydrogen 2.549 N/A ARG 466.A N LEU 462.A O no hydrogen 2.956 N/A ARG 466.A NE TRP 431.A O no hydrogen 3.320 N/A ARG 466.A NH1 ASP 435.A O no hydrogen 2.570 N/A ARG 466.A NH2 TRP 431.A O no hydrogen 2.909 N/A ARG 466.A NH2 LYS 433.A O no hydrogen 2.294 N/A ASP 467.A N ASN 463.A O no hydrogen 2.925 N/A TRP 468.A N ASP 464.A O no hydrogen 3.228 N/A TRP 468.A N THR 465.A O no hydrogen 3.407 N/A ILE 469.A N THR 465.A O no hydrogen 3.209 N/A ILE 469.A N ARG 466.A O no hydrogen 3.172 N/A VAL 470.A N ARG 466.A O no hydrogen 2.967 N/A PHE 474.A N VAL 470.A O no hydrogen 2.589 N/A GLN 475.A N PRO 471.A O no hydrogen 2.920 N/A LEU 476.A N PRO 472.A O no hydrogen 3.259 N/A GLN 477.A N PHE 474.A O no hydrogen 2.759 N/A LYS 478.A N PHE 474.A O no hydrogen 3.024 N/A ARG 479.A N GLN 475.A O no hydrogen 3.161 N/A ARG 479.A NH1 GLU 499.A OE2 no hydrogen 3.273 N/A ARG 479.A NH2 GLU 499.A OE2 no hydrogen 2.827 N/A MET 480.A N LEU 476.A O no hydrogen 3.136 N/A LYS 481.A N GLN 477.A O no hydrogen 3.165 N/A LYS 482.A N LYS 478.A O no hydrogen 3.342 N/A ALA 483.A N ARG 479.A O no hydrogen 2.689 N/A LYS 484.A N GLU 488.A OE2 no hydrogen 3.105 N/A THR 485.A N GLU 488.A OE2 no hydrogen 2.742 N/A THR 485.A OG1 GLU 488.A OE2 no hydrogen 2.788 N/A VAL 486.A N ASP 546.A O no hydrogen 3.038 N/A GLN 487.A N GLY 544.A O no hydrogen 3.111 N/A LYS 489.A NZ ILE 548.A O no hydrogen 2.416 N/A ALA 490.A N VAL 486.A O no hydrogen 2.873 N/A GLU 491.A N GLN 487.A O no hydrogen 2.820 N/A ALA 492.A N GLU 488.A O no hydrogen 2.948 N/A LEU 493.A N LYS 489.A O no hydrogen 2.934 N/A TYR 494.A N ALA 490.A O no hydrogen 2.926 N/A ARG 495.A N GLU 491.A O no hydrogen 2.920 N/A TYR 496.A N ALA 492.A O no hydrogen 3.062 N/A TYR 496.A OH SER 378.A OG no hydrogen 3.162 N/A LEU 497.A N LEU 493.A O no hydrogen 3.056 N/A GLU 498.A N TYR 494.A O no hydrogen 2.898 N/A GLU 499.A N ARG 495.A O no hydrogen 2.846 N/A THR 500.A OG1 TYR 496.A O no hydrogen 2.633 N/A THR 500.A OG1 LEU 497.A O no hydrogen 3.049 N/A ASP 501.A N GLU 498.A O no hydrogen 3.062 N/A VAL 502.A N LEU 497.A O no hydrogen 3.181 N/A LYS 505.A N ASP 501.A O no hydrogen 3.203 N/A LYS 505.A NZ LEU 399.A O no hydrogen 2.832 N/A LYS 505.A NZ PHE 401.A O no hydrogen 2.397 N/A LYS 505.A NZ THR 500.A O no hydrogen 3.202 N/A LEU 506.A N VAL 502.A O no hydrogen 2.914 N/A ASP 507.A N PRO 503.A O no hydrogen 2.941 N/A GLN 508.A N LEU 504.A O no hydrogen 2.884 N/A GLN 508.A NE2 ASN 404.A OD1 no hydrogen 3.224 N/A GLU 509.A N LYS 505.A O no hydrogen 3.090 N/A ARG 510.A N LEU 506.A O no hydrogen 2.979 N/A ARG 510.A NE GLU 514.A OE2 no hydrogen 3.340 N/A ARG 510.A NH2 GLU 514.A OE1 no hydrogen 3.112 N/A ARG 510.A NH2 GLU 514.A OE2 no hydrogen 3.437 N/A GLN 511.A N ASP 507.A O no hydrogen 3.113 N/A ARG 512.A N GLN 508.A O no hydrogen 3.015 N/A ALA 513.A N GLU 509.A O no hydrogen 2.930 N/A GLU 514.A N ARG 510.A O no hydrogen 2.949 N/A ASP 515.A N GLN 511.A O no hydrogen 2.940 N/A ASP 516.A N ARG 512.A O no hydrogen 3.019 N/A GLY 517.A N GLU 514.A O no hydrogen 3.072 N/A ARG 518.A NH1 ASP 516.A OD2 no hydrogen 2.834 N/A ILE 519.A N GLY 517.A O no hydrogen 2.920 N/A ALA 522.A N ARG 518.A O no hydrogen 3.114 N/A GLN 523.A N ILE 519.A O no hydrogen 3.132 N/A GLN 527.A N GLN 523.A O no hydrogen 3.172 N/A GLN 527.A NE2 GLN 523.A OE1 no hydrogen 3.091 N/A ALA 528.A N GLN 524.A O no hydrogen 2.927 N/A TRP 529.A N HIS 525.A O no hydrogen 3.059 N/A ASP 530.A N GLN 526.A O no hydrogen 3.104 N/A ALA 531.A N GLN 527.A O no hydrogen 2.947 N/A VAL 532.A N ALA 528.A O no hydrogen 2.997 N/A ILE 533.A N TRP 529.A O no hydrogen 2.983 N/A GLN 534.A N ASP 530.A O no hydrogen 2.912 N/A LEU 535.A N ALA 531.A O no hydrogen 2.944 N/A LEU 536.A N VAL 532.A O no hydrogen 3.004 N/A GLU 537.A N ILE 533.A O no hydrogen 2.981 N/A GLU 538.A N GLN 534.A O no hydrogen 2.940 N/A PHE 539.A N LEU 535.A O no hydrogen 3.011 N/A VAL 540.A N LEU 536.A O no hydrogen 3.003 N/A GLU 541.A N GLU 537.A O no hydrogen 2.925 N/A GLU 541.A N GLU 538.A O no hydrogen 3.204 N/A MET 542.A N GLU 538.A O no hydrogen 3.138 N/A MET 543.A N PHE 539.A O no hydrogen 3.027 N/A ASP 546.A N MET 543.A O no hydrogen 3.251 N/A ILE 548.A N LYS 484.A O no hydrogen 3.063 N/A LEU 552.A N SER 549.A OG no hydrogen 3.406 N/A PHE 553.A N SER 549.A O no hydrogen 2.972 N/A GLN 554.A N LEU 550.A O no hydrogen 3.010 N/A GLN 555.A N ASP 551.A O no hydrogen 2.869 N/A MET 556.A N LEU 552.A O no hydrogen 2.950 N/A ILE 557.A N PHE 553.A O no hydrogen 2.937 N/A GLU 558.A N GLN 554.A O no hydrogen 2.845 N/A ALA 559.A N GLN 555.A O no hydrogen 2.861 N/A GLY 560.A N MET 556.A O no hydrogen 2.859 N/A ALA 561.A N ILE 557.A O no hydrogen 2.892 N/A GLU 562.A N GLU 558.A O no hydrogen 3.042 N/A SER 563.A N GLY 560.A O no hydrogen 3.174 N/A SER 563.A OG GLY 560.A O no hydrogen 2.577 N/A LEU 564.A N ALA 561.A O no hydrogen 3.431 N/A PHE 566.A N ALA 364.A O no hydrogen 2.969 N/A SER 567.A N GLN 527.A OE1 no hydrogen 3.014 N/A ALA 572.A N GLN 575.A OE1 no hydrogen 2.871 N/A VAL 576.A N PRO 357.A O no hydrogen 2.927 N/A PHE 577.A N VAL 333.A O no hydrogen 3.292 N/A VAL 578.A N PHE 359.A O no hydrogen 3.106 N/A GLY 579.A N ILE 335.A O no hydrogen 2.831 N/A ASN 580.A N SER 584.A OG no hydrogen 2.928 N/A ASP 582.A N ASN 580.A OD1 no hydrogen 2.736 N/A LEU 583.A N ASN 580.A OD1 no hydrogen 2.663 N/A SER 584.A N ASN 580.A OD1 no hydrogen 2.893 N/A SER 584.A OG ASP 361.A OD2 no hydrogen 3.421 N/A SER 590.A N ASP 332.A O no hydrogen 3.118 N/A CYS 591.A N ASP 332.A O no hydrogen 3.470 N/A THR 592.A N ARG 652.A O no hydrogen 3.180 N/A PHE 593.A N ALA 334.A O no hydrogen 2.676 N/A VAL 594.A N TYR 654.A O no hydrogen 2.644 N/A LEU 595.A N LEU 336.A O no hydrogen 2.922 N/A GLY 596.A N GLU 311.A OE2 no hydrogen 3.363 N/A ALA 597.A N SER 656.A O no hydrogen 3.006 N/A ASN 598.A ND2 PRO 658.A O no hydrogen 2.548 N/A ASN 598.A ND2 LEU 668.A O no hydrogen 3.587 N/A ASP 599.A N LEU 668.A O no hydrogen 2.914 N/A VAL 601.A N ASN 598.A O no hydrogen 3.307 N/A LEU 602.A N ASN 598.A O no hydrogen 2.907 N/A ALA 604.A N GLU 638.A OE1 no hydrogen 3.451 N/A ASP 614.A N GLU 608.A OE1 no hydrogen 2.946 N/A ARG 617.A N SER 613.A O no hydrogen 3.047 N/A ARG 617.A NH1 GLU 128.A OE2 no hydrogen 2.792 N/A ARG 617.A NH2 GLU 128.A OE1 no hydrogen 3.541 N/A GLU 618.A N ASP 614.A O no hydrogen 2.906 N/A TRP 619.A N ASP 615.A O no hydrogen 3.047 N/A LEU 620.A N ASP 616.A O no hydrogen 2.896 N/A LYS 621.A N ARG 617.A O no hydrogen 2.865 N/A THR 622.A N GLU 618.A O no hydrogen 3.270 N/A THR 622.A N TRP 619.A O no hydrogen 3.078 N/A THR 622.A OG1 TRP 619.A O no hydrogen 2.454 N/A GLY 624.A N LEU 620.A O no hydrogen 3.356 N/A VAL 625.A N LEU 620.A O no hydrogen 2.967 N/A SER 628.A N GLU 128.A OE2 no hydrogen 3.059 N/A SER 629.A OG GLU 633.A OE2 no hydrogen 3.122 N/A GLY 631.A N ASP 614.A OD1 no hydrogen 3.298 N/A GLY 631.A N ASP 614.A OD2 no hydrogen 2.841 N/A ARG 634.A N GLY 630.A O no hydrogen 2.976 N/A LEU 635.A N GLY 631.A O no hydrogen 2.951 N/A LEU 636.A N ARG 632.A O no hydrogen 3.139 N/A LEU 636.A N GLU 633.A O no hydrogen 3.101 N/A ASP 637.A N GLU 633.A O no hydrogen 2.954 N/A PHE 640.A N ASP 637.A O no hydrogen 3.038 N/A LEU 641.A N ASP 637.A O no hydrogen 3.145 N/A ILE 642.A N GLU 638.A O no hydrogen 2.840 N/A TYR 643.A N HIS 639.A O no hydrogen 2.908 N/A MET 644.A N PHE 640.A O no hydrogen 2.917 N/A ALA 645.A N LEU 641.A O no hydrogen 3.006 N/A PHE 646.A N ILE 642.A O no hydrogen 2.913 N/A SER 647.A N TYR 643.A O no hydrogen 3.008 N/A SER 647.A OG SER 9.A OG no hydrogen 2.830 N/A SER 647.A OG TYR 643.A O no hydrogen 2.767 N/A SER 647.A OG MET 644.A O no hydrogen 3.340 N/A SER 648.A OG MET 644.A O no hydrogen 2.809 N/A SER 650.A N THR 589.A O no hydrogen 2.776 N/A SER 650.A OG ARG 275.A O no hydrogen 3.037 N/A SER 650.A OG ASP 651.A OD1 no hydrogen 3.061 N/A ASP 651.A N SER 590.A O no hydrogen 2.809 N/A ARG 652.A N SER 590.A O no hydrogen 3.184 N/A ARG 652.A NH1 TYR 654.A OH no hydrogen 3.229 N/A LEU 653.A N ALA 299.A O no hydrogen 2.996 N/A TYR 654.A N THR 592.A O no hydrogen 2.901 N/A TYR 654.A OH GLU 318.A OE1 no hydrogen 2.727 N/A VAL 655.A N THR 301.A O no hydrogen 2.980 N/A SER 656.A N VAL 594.A O no hydrogen 2.888 N/A SER 656.A OG GLU 311.A OE2 no hydrogen 2.707 N/A SER 656.A OG VAL 594.A O no hydrogen 2.806 N/A TYR 657.A N MET 303.A O no hydrogen 3.073 N/A ILE 659.A N ALA 305.A O no hydrogen 2.896 N/A ASP 661.A N LYS 665.A O no hydrogen 2.850 N/A GLY 664.A N ASP 661.A OD1 no hydrogen 2.668 N/A LYS 665.A N ASP 661.A OD1 no hydrogen 2.385 N/A LEU 667.A N ILE 659.A O no hydrogen 2.484 N/A SER 670.A N ALA 597.A O no hydrogen 2.966 N/A SER 670.A OG LEU 602.A O no hydrogen 2.248 N/A ILE 672.A N SER 670.A OG no hydrogen 3.381 N/A ARG 675.A N MET 671.A O no hydrogen 2.959 N/A ARG 675.A NH2 TYR 289.A O no hydrogen 3.095 N/A ARG 675.A NH2 ALA 291.A O no hydrogen 2.427 N/A LEU 676.A N ILE 672.A O no hydrogen 2.788 N/A GLU 677.A N VAL 673.A O no hydrogen 2.949 N/A GLU 678.A N ARG 675.A O no hydrogen 3.108 N/A LEU 679.A N ARG 675.A O no hydrogen 2.958 N/A PHE 680.A N LEU 676.A O no hydrogen 2.819 N/A HIS 683.A N PHE 680.A O no hydrogen 3.323 N/A HIS 683.A NE2 GLU 281.A OE1 no hydrogen 2.267 N/A LYS 684.A N GLN 297.A OE1 no hydrogen 2.565 N/A ARG 686.A N VAL 302.A O no hydrogen 2.984 N/A LEU 688.A N GLN 304.A O no hydrogen 2.858 N/A THR 689.A OG1 GLU 691.A O no hydrogen 3.524 N/A GLU 691.A N THR 689.A OG1 no hydrogen 2.709 N/A GLU 693.A N GLU 693.A OE1 no hydrogen 2.565 N/A GLN 694.A N GLU 691.A O no hydrogen 3.063 N/A VAL 695.A N PRO 692.A O no hydrogen 3.082 N/A SER 696.A N GLU 699.A OE1 no hydrogen 3.159 N/A SER 696.A OG GLU 699.A OE1 no hydrogen 2.715 N/A GLU 699.A N SER 696.A O no hydrogen 2.983 N/A GLU 699.A N SER 696.A OG no hydrogen 3.412 N/A GLN 700.A N SER 696.A O no hydrogen 2.779 N/A GLN 700.A NE2 VAL 695.A O no hydrogen 2.920 N/A LEU 701.A N ASP 697.A O no hydrogen 2.955 N/A MET 702.A N GLU 699.A O no hydrogen 3.131 N/A TYR 703.A N GLN 700.A O no hydrogen 3.342 N/A TYR 703.A OH THR 689.A O no hydrogen 2.517 N/A ASN 706.A ND2 ASP 353.A O no hydrogen 3.597 N/A LYS 707.A NZ ASP 743.A O no hydrogen 3.207 N/A VAL 709.A N ASN 706.A OD1 no hydrogen 3.185 N/A ALA 710.A N ASN 706.A O no hydrogen 3.183 N/A GLN 711.A N LYS 707.A O no hydrogen 3.040 N/A GLN 711.A NE2 SER 747.A OG no hydrogen 2.446 N/A SER 712.A N SER 708.A O no hydrogen 2.984 N/A PHE 713.A N VAL 709.A O no hydrogen 3.030 N/A THR 714.A N ALA 710.A O no hydrogen 2.898 N/A THR 714.A OG1 TRP 731.A O no hydrogen 3.535 N/A ALA 715.A N GLN 711.A O no hydrogen 3.167 N/A SER 716.A OG SER 712.A O no hydrogen 3.524 N/A GLN 717.A N PHE 713.A O no hydrogen 2.851 N/A GLN 717.A NE2 GLU 693.A OE1 no hydrogen 3.376 N/A LEU 718.A N THR 714.A O no hydrogen 2.993 N/A ARG 719.A N ALA 715.A O no hydrogen 3.193 N/A LEU 720.A N SER 716.A O no hydrogen 2.909 N/A TRP 721.A N GLN 717.A O no hydrogen 2.853 N/A THR 722.A N LEU 718.A O no hydrogen 3.010 N/A THR 722.A OG1 ARG 719.A O no hydrogen 2.350 N/A ARG 723.A N LEU 720.A O no hydrogen 3.136 N/A ILE 727.A N TYR 725.A O no hydrogen 2.921 N/A SER 728.A OG ASP 697.A OD1 no hydrogen 2.835 N/A TRP 731.A NE1 GLN 700.A OE1 no hydrogen 3.029 N/A SER 733.A N ASP 729.A O no hydrogen 2.909 N/A SER 733.A OG ASP 729.A O no hydrogen 3.048 N/A THR 734.A N VAL 730.A O no hydrogen 2.930 N/A THR 734.A OG1 VAL 730.A O no hydrogen 2.942 N/A TYR 735.A N TRP 731.A O no hydrogen 2.860 N/A ASN 736.A N TRP 732.A O no hydrogen 3.059 N/A VAL 737.A N SER 733.A O no hydrogen 3.039 N/A LEU 738.A N THR 734.A O no hydrogen 2.903 N/A MET 739.A N TYR 735.A O no hydrogen 3.043 N/A SER 740.A N VAL 737.A O no hydrogen 3.096 N/A SER 740.A OG VAL 737.A O no hydrogen 2.736 N/A GLU 741.A N VAL 737.A O no hydrogen 3.301 N/A GLN 742.A N GLN 742.A OE1 no hydrogen 2.759 N/A LYS 748.A N ARG 744.A O no hydrogen 2.708 N/A LYS 749.A N LEU 745.A O no hydrogen 2.904 N/A LEU 750.A N GLN 746.A O no hydrogen 3.052 N/A PHE 751.A N SER 747.A O no hydrogen 2.909 N/A SER 752.A N LYS 749.A O no hydrogen 3.275 N/A SER 752.A OG LYS 749.A O no hydrogen 2.304 N/A SER 753.A OG LEU 750.A O no hydrogen 3.099 N/A LEU 754.A N PHE 751.A O no hydrogen 3.215 N/A PHE 756.A N SER 753.A O no hydrogen 3.115 N/A ASN 758.A ND2 CYS 1118.A O no hydrogen 2.739 N/A ASN 758.A ND2 ASN 1127.A OD1 no hydrogen 3.222 N/A GLU 759.A N ARG 757.A O no hydrogen 2.581 N/A GLN 762.A NE2 ASP 1093.A O no hydrogen 2.803 N/A LEU 763.A N GLY 1094.A O no hydrogen 3.152 N/A SER 768.A N GLU 764.A O no hydrogen 2.849 N/A SER 768.A OG GLU 764.A O no hydrogen 3.347 N/A SER 768.A OG ARG 765.A O no hydrogen 3.021 N/A SER 768.A OG THR 1092.A O no hydrogen 3.339 N/A ARG 769.A N ARG 765.A O no hydrogen 2.929 N/A GLN 770.A N SER 766.A O no hydrogen 3.052 N/A LEU 771.A N VAL 767.A O no hydrogen 2.881 N/A TYR 772.A N SER 768.A O no hydrogen 2.944 N/A GLY 773.A N ARG 769.A O no hydrogen 3.137 N/A GLU 774.A N GLU 774.A OE1 no hydrogen 2.431 N/A ARG 775.A NE THR 924.A OG1 no hydrogen 3.148 N/A ILE 776.A N THR 924.A O no hydrogen 2.999 N/A GLY 778.A N GLU 926.A O no hydrogen 3.048 N/A ARG 782.A NE HIS 793.A NE2 no hydrogen 3.026 N/A ARG 782.A NH2 HIS 793.A NE2 no hydrogen 3.427 N/A MET 783.A N SER 779.A O no hydrogen 3.275 N/A GLU 784.A N VAL 780.A O no hydrogen 2.917 N/A THR 785.A N SER 781.A O no hydrogen 2.955 N/A THR 785.A OG1 SER 781.A O no hydrogen 2.724 N/A PHE 786.A N ARG 782.A O no hydrogen 3.006 N/A ASN 787.A N MET 783.A O no hydrogen 2.936 N/A ASN 787.A ND2 GLY 965.A O no hydrogen 2.986 N/A ALA 788.A N GLU 784.A O no hydrogen 2.937 N/A CYS 789.A N THR 785.A O no hydrogen 3.196 N/A SER 792.A OG CYS 789.A O no hydrogen 2.514 N/A HIS 793.A N CYS 789.A O no hydrogen 3.403 N/A PHE 794.A N PRO 790.A O no hydrogen 3.028 N/A ALA 795.A N PHE 791.A O no hydrogen 2.992 N/A SER 796.A N SER 792.A O no hydrogen 3.048 N/A SER 796.A OG SER 792.A O no hydrogen 3.136 N/A HIS 797.A N HIS 793.A O no hydrogen 2.882 N/A LEU 799.A N PHE 794.A O no hydrogen 2.880 N/A LEU 801.A N ALA 795.A O no hydrogen 3.170 N/A ARG 804.A NE ASN 419.A OD1 no hydrogen 3.257 N/A ARG 804.A NH2 ASN 419.A OD1 no hydrogen 3.551 N/A PHE 807.A N ILE 422.A O no hydrogen 3.069 N/A LYS 808.A NZ GLU 810.A OE2 no hydrogen 3.185 N/A GLU 810.A N ASP 813.A OD2 no hydrogen 3.427 N/A ILE 814.A N GLU 810.A O no hydrogen 3.340 N/A GLY 815.A N ALA 811.A O no hydrogen 2.885 N/A GLN 816.A N PRO 812.A O no hydrogen 2.920 N/A LEU 817.A N ASP 813.A O no hydrogen 3.036 N/A PHE 818.A N ILE 814.A O no hydrogen 3.002 N/A HIS 819.A N GLY 815.A O no hydrogen 2.974 N/A HIS 819.A NE2 TYR 950.A O no hydrogen 3.214 N/A SER 820.A N GLN 816.A O no hydrogen 3.032 N/A SER 820.A OG ASP 446.A OD2 no hydrogen 3.202 N/A SER 820.A OG GLN 816.A O no hydrogen 3.109 N/A SER 821.A N LEU 817.A O no hydrogen 2.958 N/A SER 821.A OG LEU 817.A O no hydrogen 2.480 N/A LEU 822.A N PHE 818.A O no hydrogen 3.053 N/A LYS 823.A N HIS 819.A O no hydrogen 3.027 N/A LYS 823.A NZ ASP 827.A OD1 no hydrogen 3.233 N/A LYS 823.A NZ ASP 827.A OD2 no hydrogen 3.124 N/A LEU 824.A N SER 820.A O no hydrogen 2.984 N/A ILE 825.A N SER 821.A O no hydrogen 2.958 N/A SER 826.A N LEU 822.A O no hydrogen 2.968 N/A ASP 827.A N LYS 823.A O no hydrogen 2.966 N/A ARG 828.A N LEU 824.A O no hydrogen 3.014 N/A LEU 829.A N ILE 825.A O no hydrogen 2.922 N/A ARG 830.A N SER 826.A O no hydrogen 3.119 N/A ASP 831.A N ASP 827.A O no hydrogen 3.028 N/A GLU 832.A N ARG 828.A O no hydrogen 3.107 N/A LEU 834.A N LEU 829.A O no hydrogen 2.735 N/A TRP 836.A N ASP 835.A OD1 no hydrogen 2.797 N/A ASP 838.A N ASP 835.A O no hydrogen 2.898 N/A THR 840.A N GLN 843.A OE1 no hydrogen 3.136 N/A GLN 843.A N THR 840.A OG1 no hydrogen 3.364 N/A CYS 844.A N THR 840.A O no hydrogen 2.905 N/A CYS 844.A SG THR 840.A O no hydrogen 3.171 N/A GLU 845.A N LYS 841.A O no hydrogen 3.046 N/A LEU 846.A N GLU 842.A O no hydrogen 3.054 N/A PHE 847.A N GLN 843.A O no hydrogen 2.904 N/A SER 848.A N CYS 844.A O no hydrogen 3.025 N/A SER 848.A OG CYS 844.A O no hydrogen 2.971 N/A SER 848.A OG VAL 881.A O no hydrogen 3.202 N/A TYR 849.A N GLU 845.A O no hydrogen 2.947 N/A ASP 850.A N LEU 846.A O no hydrogen 3.035 N/A ALA 851.A N PHE 847.A O no hydrogen 2.970 N/A VAL 852.A N SER 848.A O no hydrogen 3.082 N/A GLU 853.A N TYR 849.A O no hydrogen 2.996 N/A ARG 854.A N ASP 850.A O no hydrogen 2.948 N/A ARG 854.A N ALA 851.A O no hydrogen 3.151 N/A LEU 855.A N ALA 851.A O no hydrogen 3.157 N/A LEU 855.A N VAL 852.A O no hydrogen 3.128 N/A ALA 856.A N VAL 852.A O no hydrogen 2.870 N/A LYS 858.A N LEU 855.A O no hydrogen 3.332 N/A LEU 859.A N ALA 856.A O no hydrogen 3.110 N/A GLN 860.A NE2 PHE 806.A O no hydrogen 3.132 N/A SER 866.A N ILE 863.A O no hydrogen 3.077 N/A SER 866.A OG ILE 863.A O no hydrogen 2.388 N/A SER 867.A OG HIS 870.A ND1 no hydrogen 2.539 N/A HIS 870.A N SER 867.A OG no hydrogen 3.246 N/A HIS 870.A ND1 SER 867.A OG no hydrogen 2.539 N/A TYR 871.A N SER 867.A O no hydrogen 3.001 N/A TYR 872.A N ASN 868.A O no hydrogen 3.039 N/A VAL 873.A N ARG 869.A O no hydrogen 3.072 N/A LYS 874.A N HIS 870.A O no hydrogen 2.895 N/A GLU 875.A N TYR 871.A O no hydrogen 3.086 N/A LYS 876.A N TYR 872.A O no hydrogen 2.962 N/A LEU 877.A N VAL 873.A O no hydrogen 2.959 N/A GLN 878.A N LYS 874.A O no hydrogen 2.931 N/A LYS 879.A N GLU 875.A O no hydrogen 2.927 N/A ILE 880.A N LYS 876.A O no hydrogen 3.050 N/A VAL 881.A N LEU 877.A O no hydrogen 2.988 N/A THR 882.A N GLN 878.A O no hydrogen 2.951 N/A THR 882.A OG1 GLN 878.A O no hydrogen 2.503 N/A ARG 883.A N LYS 879.A O no hydrogen 3.034 N/A VAL 884.A N ILE 880.A O no hydrogen 2.985 N/A SER 885.A N VAL 881.A O no hydrogen 2.967 N/A SER 885.A OG SER 848.A OG no hydrogen 2.803 N/A SER 885.A OG VAL 881.A O no hydrogen 2.741 N/A GLY 886.A N THR 882.A O no hydrogen 3.103 N/A ILE 887.A N ARG 883.A O no hydrogen 2.930 N/A LEU 888.A N VAL 884.A O no hydrogen 2.873 N/A SER 889.A N SER 885.A O no hydrogen 3.028 N/A SER 889.A OG TRP 836.A O no hydrogen 2.647 N/A GLU 890.A N GLY 886.A O no hydrogen 3.117 N/A HIS 891.A N ILE 887.A O no hydrogen 2.892 N/A ALA 892.A N LEU 888.A O no hydrogen 2.967 N/A LYS 893.A N SER 889.A O no hydrogen 3.197 N/A LYS 893.A N GLU 890.A O no hydrogen 3.254 N/A LYS 893.A NZ GLU 890.A OE1 no hydrogen 3.347 N/A LYS 893.A NZ GLU 890.A OE2 no hydrogen 2.940 N/A ALA 894.A N HIS 891.A O no hydrogen 3.246 N/A GLY 896.A N LEU 1038.A O no hydrogen 2.615 N/A PHE 897.A N SER 895.A OG no hydrogen 3.175 N/A VAL 898.A N LYS 936.A O no hydrogen 2.892 N/A ILE 900.A N VAL 934.A O no hydrogen 2.638 N/A GLU 903.A N ASP 932.A O no hydrogen 2.794 N/A PHE 906.A N GLY 929.A O no hydrogen 2.909 N/A GLY 907.A N LEU 912.A O no hydrogen 2.729 N/A GLY 910.A N GLY 907.A O no hydrogen 2.971 N/A THR 916.A OG1 PRO 914.A O no hydrogen 3.250 N/A PHE 917.A N MET 925.A O no hydrogen 2.842 N/A LYS 920.A N GLU 1089.A OE2 no hydrogen 2.710 N/A LYS 920.A NZ GLU 1089.A OE1 no hydrogen 3.302 N/A GLY 922.A N LEU 919.A O no hydrogen 3.182 N/A CYS 923.A SG GLY 773.A O no hydrogen 3.650 N/A CYS 923.A SG GLU 774.A O no hydrogen 3.270 N/A MET 925.A N PHE 917.A O no hydrogen 2.935 N/A GLU 926.A N ILE 776.A O no hydrogen 3.059 N/A LEU 927.A N LEU 915.A O no hydrogen 3.315 N/A VAL 928.A N GLY 778.A O no hydrogen 2.924 N/A GLY 929.A N PHE 906.A O no hydrogen 3.188 N/A ILE 931.A N LEU 904.A O no hydrogen 2.745 N/A ASP 935.A N ARG 946.A O no hydrogen 2.890 N/A LYS 936.A N VAL 898.A O no hydrogen 2.947 N/A ALA 937.A N LEU 944.A O no hydrogen 2.976 N/A SER 939.A N GLY 942.A O no hydrogen 2.901 N/A SER 939.A OG GLY 942.A O no hydrogen 2.899 N/A SER 940.A N GLU 1034.A OE2 no hydrogen 2.715 N/A SER 940.A OG GLU 1034.A OE1 no hydrogen 2.432 N/A SER 940.A OG GLU 1034.A OE2 no hydrogen 3.054 N/A LYS 941.A NZ ASP 1032.A OD2 no hydrogen 3.140 N/A GLY 942.A N SER 939.A O no hydrogen 3.307 N/A LEU 944.A N ALA 937.A O no hydrogen 2.858 N/A LEU 945.A N THR 990.A O no hydrogen 3.021 N/A ARG 946.A N ASP 935.A O no hydrogen 3.027 N/A ARG 946.A NE ASP 935.A OD2 no hydrogen 3.419 N/A ARG 946.A NH2 ASP 935.A OD2 no hydrogen 3.293 N/A ILE 947.A N GLY 993.A O no hydrogen 3.205 N/A VAL 948.A N ARG 933.A O no hydrogen 2.871 N/A ALA 949.A N LEU 995.A O no hydrogen 2.960 N/A TYR 950.A N ASP 932.A OD2 no hydrogen 3.162 N/A LYS 951.A N PHE 997.A O no hydrogen 2.788 N/A LYS 951.A NZ LYS 955.A O no hydrogen 2.898 N/A ALA 960.A N ASP 958.A OD1 no hydrogen 3.204 N/A VAL 962.A N ASP 958.A O no hydrogen 2.936 N/A TYR 963.A N LEU 959.A O no hydrogen 2.866 N/A TYR 963.A OH GLU 1147.A OE2 no hydrogen 2.894 N/A TYR 964.A N ALA 960.A O no hydrogen 3.079 N/A GLY 965.A N VAL 962.A O no hydrogen 3.059 N/A LEU 966.A N GLU 961.A O no hydrogen 2.601 N/A ALA 967.A N GLU 961.A O no hydrogen 3.084 N/A LEU 968.A N GLU 784.A OE2 no hydrogen 2.542 N/A GLN 969.A NE2 GLU 784.A OE1 no hydrogen 3.268 N/A THR 972.A N LEU 968.A O no hydrogen 3.331 N/A THR 972.A OG1 LEU 968.A O no hydrogen 2.479 N/A TYR 973.A N GLN 969.A O no hydrogen 3.035 N/A LEU 974.A N MET 970.A O no hydrogen 2.860 N/A ASP 975.A N LEU 971.A O no hydrogen 2.906 N/A LEU 976.A N THR 972.A O no hydrogen 2.995 N/A SER 977.A N TYR 973.A O no hydrogen 3.003 N/A SER 977.A OG TYR 973.A O no hydrogen 2.818 N/A ILE 978.A N LEU 974.A O no hydrogen 2.981 N/A THR 979.A N ASP 975.A O no hydrogen 3.020 N/A THR 979.A OG1 ASP 975.A O no hydrogen 2.464 N/A HIS 980.A N LEU 976.A O no hydrogen 3.090 N/A SER 981.A N ILE 978.A O no hydrogen 3.272 N/A SER 981.A OG ILE 978.A O no hydrogen 2.800 N/A SER 981.A OG MET 987.A O no hydrogen 3.126 N/A TRP 984.A N HIS 980.A O no hydrogen 3.187 N/A GLY 986.A N SER 981.A O no hydrogen 2.849 N/A ALA 989.A N SER 981.A OG no hydrogen 3.063 N/A THR 990.A N LEU 943.A O no hydrogen 2.690 N/A ALA 992.A N LEU 945.A O no hydrogen 2.799 N/A VAL 994.A N LEU 1028.A O no hydrogen 2.962 N/A LEU 995.A N ILE 947.A O no hydrogen 2.832 N/A TYR 996.A N LYS 1026.A O no hydrogen 2.804 N/A PHE 997.A N ALA 949.A O no hydrogen 2.944 N/A ILE 999.A N LYS 951.A O no hydrogen 3.001 N/A HIS 1000.A ND1 HIS 998.A O no hydrogen 3.010 N/A SER 1006.A OG LEU 1008.A O no hydrogen 3.509 N/A LEU 1008.A N SER 1006.A OG no hydrogen 3.233 N/A GLY 1011.A N GLU 1014.A OE1 no hydrogen 2.937 N/A ILE 1015.A N GLY 1011.A O no hydrogen 2.766 N/A GLU 1016.A N LEU 1012.A O no hydrogen 2.961 N/A GLN 1017.A N ASP 1013.A O no hydrogen 3.010 N/A GLU 1018.A N GLU 1014.A O no hydrogen 2.975 N/A ILE 1019.A N ILE 1015.A O no hydrogen 2.923 N/A PHE 1020.A N GLU 1016.A O no hydrogen 3.003 N/A LYS 1021.A N GLN 1017.A O no hydrogen 2.956 N/A LYS 1022.A N ILE 1019.A O no hydrogen 3.074 N/A PHE 1023.A N PHE 1020.A O no hydrogen 3.347 N/A LYS 1024.A N LYS 1021.A O no hydrogen 3.459 N/A MET 1025.A N ILE 1050.A O no hydrogen 2.898 N/A LYS 1026.A NZ ASP 954.A O no hydrogen 2.878 N/A LEU 1028.A N VAL 994.A O no hydrogen 2.864 N/A LEU 1029.A N ALA 1066.A O no hydrogen 2.839 N/A GLY 1031.A N VAL 1068.A O no hydrogen 2.627 N/A ASP 1032.A N LEU 1030.A O no hydrogen 2.720 N/A ARG 1037.A N GLN 1033.A O no hydrogen 2.968 N/A LEU 1038.A N GLU 1034.A O no hydrogen 2.971 N/A LEU 1038.A N VAL 1035.A O no hydrogen 3.003 N/A MET 1039.A N VAL 1035.A O no hydrogen 2.992 N/A ASP 1040.A N VAL 1036.A O no hydrogen 3.099 N/A THR 1041.A N ALA 894.A O no hydrogen 2.978 N/A THR 1042.A N ASP 1040.A OD1 no hydrogen 3.416 N/A LEU 1043.A N ASP 1040.A O no hydrogen 3.329 N/A GLY 1046.A N LEU 1055.A O no hydrogen 3.152 N/A ARG 1047.A NH2 ASP 1064.A OD2 no hydrogen 2.385 N/A SER 1048.A N ALA 1053.A O no hydrogen 3.103 N/A SER 1048.A OG ASP 1040.A OD2 no hydrogen 2.341 N/A ILE 1050.A N SER 1048.A OG no hydrogen 3.370 N/A ALA 1053.A N ILE 1051.A O no hydrogen 2.812 N/A GLY 1054.A N SER 1065.A OG no hydrogen 3.023 N/A LEU 1055.A N GLY 1046.A O no hydrogen 2.737 N/A LYS 1056.A N SER 1060.A O no hydrogen 3.055 N/A ASP 1058.A N ASP 1058.A OD1 no hydrogen 2.218 N/A SER 1065.A N ARG 1062.A O no hydrogen 3.116 N/A SER 1065.A OG ARG 1062.A O no hydrogen 3.037 N/A ALA 1066.A N ASN 1052.A O no hydrogen 2.993 N/A VAL 1068.A N LEU 1029.A O no hydrogen 2.763 N/A LYS 1071.A NZ GLU 1072.A OE2 no hydrogen 3.118 N/A GLU 1072.A N GLU 1072.A OE1 no hydrogen 2.725 N/A PHE 1073.A N GLY 1069.A O no hydrogen 3.324 N/A ASP 1074.A N GLU 1070.A O no hydrogen 3.010 N/A LEU 1075.A N LYS 1071.A O no hydrogen 2.972 N/A LEU 1076.A N GLU 1072.A O no hydrogen 2.865 N/A THR 1077.A N PHE 1073.A O no hydrogen 3.001 N/A THR 1077.A OG1 PHE 1073.A O no hydrogen 3.291 N/A THR 1077.A OG1 ASP 1074.A O no hydrogen 2.598 N/A LYS 1078.A N ASP 1074.A O no hydrogen 3.047 N/A HIS 1079.A N LEU 1075.A O no hydrogen 3.049 N/A HIS 1079.A NE2 TYR 963.A O no hydrogen 3.017 N/A VAL 1080.A N LEU 1076.A O no hydrogen 2.908 N/A ARG 1081.A N THR 1077.A O no hydrogen 2.987 N/A ARG 1081.A NH2 ASP 975.A OD1 no hydrogen 2.924 N/A ARG 1082.A N LYS 1078.A O no hydrogen 3.001 N/A ARG 1082.A NE LYS 1078.A O no hydrogen 3.401 N/A THR 1083.A N HIS 1079.A O no hydrogen 2.978 N/A THR 1083.A OG1 HIS 1079.A O no hydrogen 2.970 N/A PHE 1084.A N VAL 1080.A O no hydrogen 2.990 N/A GLN 1085.A N ARG 1081.A O no hydrogen 2.946 N/A GLN 1085.A NE2 GLN 918.A O no hydrogen 2.951 N/A GLU 1086.A N ARG 1082.A O no hydrogen 3.020 N/A ALA 1087.A N THR 1083.A O no hydrogen 2.875 N/A GLY 1088.A N PHE 1084.A O no hydrogen 2.929 N/A GLU 1089.A N GLN 1085.A O no hydrogen 2.956 N/A GLN 1090.A N GLU 1086.A O no hydrogen 3.016 N/A GLN 1090.A NE2 GLU 1086.A OE2 no hydrogen 3.411 N/A ILE 1091.A N ALA 1087.A O no hydrogen 2.905 N/A THR 1092.A N GLY 1088.A O no hydrogen 3.051 N/A THR 1092.A OG1 GLY 1088.A O no hydrogen 2.910 N/A THR 1092.A OG1 GLU 1089.A O no hydrogen 2.788 N/A ASP 1093.A N GLU 1089.A O no hydrogen 3.010 N/A GLY 1094.A N ILE 1091.A O no hydrogen 3.130 N/A ARG 1095.A N GLN 1090.A O no hydrogen 3.015 N/A ARG 1095.A NH2 GLU 1099.A OE1 no hydrogen 2.398 N/A ARG 1095.A NH2 GLU 1099.A OE2 no hydrogen 3.400 N/A LYS 1102.A N ARG 1130.A O no hydrogen 3.044 N/A MET 1103.A N LYS 1106.A O no hydrogen 3.274 N/A LYS 1106.A N MET 1103.A O no hydrogen 2.929 N/A THR 1110.A N THR 1107.A O no hydrogen 3.468 N/A THR 1110.A OG1 THR 1107.A O no hydrogen 2.766 N/A TYR 1111.A N PRO 1108.A O no hydrogen 3.177 N/A CYS 1112.A N CYS 1109.A O no hydrogen 3.386 N/A VAL 1117.A N PHE 1114.A O no hydrogen 3.090 N/A CYS 1118.A N PHE 1114.A O no hydrogen 2.926 N/A CYS 1118.A SG PHE 1114.A O no hydrogen 3.360 N/A CYS 1118.A SG LYS 1115.A O no hydrogen 3.448 N/A GLN 1119.A N LYS 1115.A O no hydrogen 3.363 N/A SER 1123.A OG ASP 1121.A OD1 no hydrogen 2.894 N/A ASN 1127.A ND2 ASN 758.A O no hydrogen 3.661 N/A ARG 1130.A N PRO 1100.A O no hydrogen 2.627 N/A ARG 1130.A NE GLU 1099.A O no hydrogen 2.810 N/A ARG 1130.A NH2 GLU 1099.A O no hydrogen 2.749 N/A GLU 1135.A N LYS 1133.A O no hydrogen 2.940 N/A ILE 1140.A N LYS 1136.A O no hydrogen 3.078 N/A LEU 1141.A N ASP 1137.A O no hydrogen 2.863 N/A GLU 1142.A N LYS 1138.A O no hydrogen 2.976 N/A TRP 1143.A N THR 1139.A O no hydrogen 3.019 N/A ILE 1144.A N ILE 1140.A O no hydrogen 2.932 N/A LYS 1145.A N LEU 1141.A O no hydrogen 2.951 N/A LYS 1145.A NZ LEU 1141.A O no hydrogen 3.507 N/A LYS 1146.A N GLU 1142.A O no hydrogen 2.963 N/A GLU 1147.A N TRP 1143.A O no hydrogen 3.006 N/A ALA 1148.A N ILE 1144.A O no hydrogen 3.217 N/A ALA 1148.A N LYS 1145.A O no hydrogen 3.237 N/A