#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2oex h VAL 363 N 0.00 1.71 -0.64 2.46 2.07 -2.01 -2.89 116.25 116.95 2oex h VAL 363 Ca 0.00 -2.38 0.11 0.00 0.82 0.00 0.00 66.70 65.25 2oex h VAL 363 Cb 0.00 3.32 -0.04 0.00 -1.52 0.00 0.00 31.29 33.05 2oex h VAL 363 CO 0.00 0.62 0.43 -0.61 0.02 0.00 0.00 177.57 178.03 2oex h GLN 364 N -0.88 0.39 0.00 1.57 5.75 -2.06 -1.67 115.11 118.22 2oex h GLN 364 Ca -0.04 -0.02 -0.07 0.00 -0.15 0.00 0.00 58.65 58.36 2oex h GLN 364 Cb 1.13 -0.09 -0.01 0.00 1.07 0.00 0.00 27.48 29.59 2oex h GLN 364 CO 0.02 0.26 -0.37 1.96 -2.65 0.00 0.00 178.83 178.05 2oex h GLN 365 N 0.41 0.00 0.17 1.69 4.20 -2.00 -2.87 115.11 116.70 2oex h GLN 365 Ca 0.30 0.00 -0.33 0.00 0.06 0.00 0.00 58.65 58.68 2oex h GLN 365 Cb 0.62 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.41 2oex h GLN 365 CO -0.08 0.33 -1.62 0.77 -0.67 0.00 0.00 178.83 177.56 2oex h SER 366 N 0.00 0.57 0.29 1.46 0.02 -1.16 -3.25 113.55 111.47 2oex h SER 366 Ca -0.01 -0.77 -0.01 0.00 -0.84 0.00 0.00 61.79 60.16 2oex h SER 366 Cb 1.26 -0.19 0.00 0.00 0.14 0.00 0.00 62.40 63.62 2oex h SER 366 CO 0.04 1.64 -0.14 0.25 -1.14 0.00 0.00 176.83 177.49 2oex h LEU 367 N 0.10 -0.32 -0.71 5.07 5.85 -1.37 -1.70 115.31 122.23 2oex h LEU 367 Ca -0.29 -0.13 0.16 0.00 0.84 0.00 0.00 57.88 58.45 2oex h LEU 367 Cb 2.08 0.08 -0.12 0.00 0.37 0.00 0.00 40.66 43.07 2oex h LEU 367 CO 0.19 -0.04 -0.02 0.00 -0.34 0.00 0.00 178.44 178.22 2oex h ALA 368 N 0.03 0.69 0.60 1.25 0.00 -1.67 -0.49 119.26 119.67 2oex h ALA 368 Ca -0.04 0.23 -0.03 0.00 0.00 0.00 0.00 54.91 55.07 2oex h ALA 368 Cb 0.44 0.41 0.01 0.00 0.00 0.00 0.00 17.79 18.65 2oex h ALA 368 CO 0.06 -0.41 -0.29 0.00 0.00 0.00 0.00 179.25 178.61 2oex h ALA 369 N 1.67 -0.81 -0.91 0.00 0.00 -1.53 -0.04 119.26 117.63 2oex h ALA 369 Ca 0.38 -0.18 0.26 0.00 0.00 0.00 0.00 54.91 55.36 2oex h ALA 369 Cb 0.64 0.31 -0.16 0.00 0.00 0.00 0.00 17.79 18.59 2oex h ALA 369 CO -0.64 -0.93 0.16 -0.92 0.00 0.00 0.00 179.25 176.92 2oex h TYR 370 N -0.85 0.21 -0.62 0.00 3.20 -0.85 0.18 116.97 118.24 2oex h TYR 370 Ca -0.08 0.06 -0.10 0.00 3.14 0.00 0.00 58.73 61.75 2oex h TYR 370 Cb 0.63 0.06 -0.02 0.00 1.54 0.00 0.00 36.73 38.94 2oex h TYR 370 CO -0.03 -0.31 0.00 -0.91 -1.64 0.00 0.00 178.16 175.27 2oex h ASN 371 N 0.11 1.06 -0.07 -2.11 2.35 -0.65 -2.90 115.58 113.39 2oex h ASN 371 Ca 0.58 -0.30 -0.00 0.00 -0.55 0.00 0.00 56.30 56.02 2oex h ASN 371 Cb 1.21 -0.29 -0.00 0.00 0.05 0.00 0.00 38.32 39.29 2oex h ASN 371 CO -0.76 1.11 0.04 1.56 -1.65 0.00 0.00 177.43 177.73 2oex h GLN 372 N 0.99 0.09 -0.98 0.81 4.20 0.12 -1.15 115.11 119.19 2oex h GLN 372 Ca 0.18 -0.01 0.21 0.00 0.06 0.00 0.00 58.65 59.09 2oex h GLN 372 Cb 0.56 -0.02 -0.09 0.00 0.30 0.00 0.00 27.48 28.23 2oex h GLN 372 CO 0.03 0.14 0.62 0.00 -0.67 0.00 0.00 178.83 178.95 2oex h ARG 373 N 0.02 0.56 -0.25 1.46 3.08 -1.17 -0.92 114.38 117.17 2oex h ARG 373 Ca 0.02 -0.03 -0.15 0.00 0.07 0.00 0.00 59.98 59.89 2oex h ARG 373 Cb 0.07 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.00 2oex h ARG 373 CO -0.00 0.37 -0.44 -0.22 -1.07 0.00 0.00 179.97 178.61 2oex h LYS 374 N 0.58 0.74 -0.48 0.04 3.64 -1.21 -2.74 116.57 117.15 2oex h LYS 374 Ca 0.55 -0.46 -0.04 0.00 -1.27 0.00 0.00 60.65 59.43 2oex h LYS 374 Cb 1.11 0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.96 2oex h LYS 374 CO -0.31 1.09 0.14 0.00 -2.27 0.00 0.00 179.45 178.10 2oex h ALA 375 N 0.65 1.35 0.36 5.00 0.00 -0.37 -1.78 119.26 124.46 2oex h ALA 375 Ca 0.02 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 2oex h ALA 375 Cb 1.04 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.64 2oex h ALA 375 CO 0.10 0.47 -0.17 -0.44 0.00 0.00 0.00 179.25 179.21 2oex h ASP 376 N 0.69 -0.41 -0.80 0.00 3.32 -1.17 0.27 116.42 118.32 2oex h ASP 376 Ca 0.16 -0.04 0.07 0.00 0.02 0.00 0.00 57.03 57.24 2oex h ASP 376 Cb 0.22 0.11 -0.06 0.00 0.22 0.00 0.00 39.33 39.82 2oex h ASP 376 CO -0.01 -0.22 0.48 0.25 -1.72 0.00 0.00 179.24 178.02 2oex h LEU 377 N -0.56 0.74 0.35 1.55 5.85 -1.22 0.80 115.31 122.82 2oex h LEU 377 Ca -0.05 0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.68 2oex h LEU 377 Cb 0.42 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.33 2oex h LEU 377 CO 0.08 0.47 -0.17 0.58 -0.34 0.00 0.00 178.44 179.06 2oex h VAL 378 N 0.87 0.16 -0.69 1.05 2.07 -1.14 -2.92 116.25 115.65 2oex h VAL 378 Ca 0.36 -0.70 0.01 0.00 0.82 0.00 0.00 66.70 67.19 2oex h VAL 378 Cb 0.20 0.26 -0.04 0.00 -1.52 0.00 0.00 31.29 30.20 2oex h VAL 378 CO -0.19 0.04 0.46 0.78 0.02 0.00 0.00 177.57 178.68 2oex h ASN 379 N -1.09 0.77 0.70 0.57 2.35 -0.34 -2.16 115.58 116.39 2oex h ASN 379 Ca -0.05 -0.02 -0.13 0.00 -0.55 0.00 0.00 56.30 55.56 2oex h ASN 379 Cb 0.43 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 38.59 2oex h ASN 379 CO 0.08 0.55 -0.60 0.03 -1.65 0.00 0.00 177.43 175.84 2oex h ARG 380 N 0.91 0.00 0.12 0.81 3.08 -0.95 0.80 114.38 119.16 2oex h ARG 380 Ca 0.26 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.31 2oex h ARG 380 Cb -0.06 0.00 0.00 0.00 0.08 0.00 0.00 29.97 29.99 2oex h ARG 380 CO -0.06 0.60 -0.06 0.77 -1.07 0.00 0.00 179.97 180.15 2oex h SER 381 N 0.00 -0.14 -0.91 7.04 0.02 -1.25 -2.36 113.55 115.96 2oex h SER 381 Ca -0.01 -0.17 0.00 0.00 -0.84 0.00 0.00 61.79 60.78 2oex h SER 381 Cb 1.11 0.04 -0.04 0.00 0.14 0.00 0.00 62.40 63.65 2oex h SER 381 CO 0.08 0.09 0.58 0.40 -1.14 0.00 0.00 176.83 176.84 2oex h ILE 382 N -0.37 1.24 -0.52 3.27 2.04 -1.20 -2.17 117.51 119.79 2oex h ILE 382 Ca -0.02 -0.47 0.05 0.00 1.00 0.00 0.00 64.86 65.42 2oex h ILE 382 Cb 0.30 -0.07 -0.05 0.00 -0.74 0.00 0.00 36.82 36.26 2oex h ILE 382 CO 0.03 0.24 0.26 0.00 0.00 0.00 0.00 178.15 178.68 2oex h ALA 383 N 1.32 0.67 0.00 1.87 0.00 -0.82 -2.27 119.26 120.03 2oex h ALA 383 Ca 0.33 0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.26 2oex h ALA 383 Cb -0.11 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.61 2oex h ALA 383 CO -0.07 -0.08 0.00 1.04 0.00 0.00 0.00 179.25 180.14 2oex n GLN 384 N -4.88 0.00 0.00 0.00 6.02 -0.82 -1.39 117.38 116.31 2oex n GLN 384 Ca 0.05 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.04 2oex n GLN 384 Cb 0.14 -1.09 0.00 0.00 1.02 0.00 0.00 30.24 30.31 2oex n GLN 384 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 2oex n ARG 386 N 0.61 0.00 -0.13 -1.09 5.12 -0.86 -2.04 116.66 118.28 2oex n ARG 386 Ca 0.00 0.00 -0.03 0.00 -1.93 0.00 0.00 57.85 55.89 2oex n ARG 386 Cb 0.00 0.00 0.19 0.00 -1.16 0.00 0.00 32.46 31.49 2oex n ARG 386 CO 0.00 0.00 0.00 0.93 -1.93 0.00 0.00 177.63 176.63 2oex h GLU 387 N 0.00 0.82 -0.44 5.56 5.08 -1.51 0.51 114.58 124.61 2oex h GLU 387 Ca 0.00 -0.17 -0.08 0.00 -1.00 0.00 0.00 59.36 58.12 2oex h GLU 387 Cb 0.00 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.11 2oex h GLU 387 CO 0.00 0.74 -0.03 0.00 -1.00 0.00 0.00 179.01 178.73 2oex h ALA 388 N 1.34 0.59 -0.05 3.43 0.00 -1.65 -0.36 119.26 122.56 2oex h ALA 388 Ca 0.17 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 2oex h ALA 388 Cb 0.30 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 2oex h ALA 388 CO -0.00 0.41 -0.02 1.15 0.00 0.00 0.00 179.25 180.78 2oex h THR 389 N 0.63 1.32 -0.97 0.00 2.02 -1.77 -1.64 112.91 112.50 2oex h THR 389 Ca 0.12 -0.99 0.20 0.00 0.77 0.00 0.00 66.41 66.51 2oex h THR 389 Cb 0.53 1.87 -0.09 0.00 -1.74 0.00 0.00 68.15 68.72 2oex h THR 389 CO 0.03 0.27 0.61 0.74 0.37 0.00 0.00 175.52 177.54 2oex h THR 390 N -0.26 0.69 0.20 3.16 2.02 -0.83 -0.87 112.91 117.03 2oex h THR 390 Ca 0.01 -0.21 -0.01 0.00 0.77 0.00 0.00 66.41 66.97 2oex h THR 390 Cb 0.44 0.03 0.00 0.00 -1.74 0.00 0.00 68.15 66.88 2oex h THR 390 CO 0.01 0.11 -0.10 0.25 0.37 0.00 0.00 175.52 176.16 2oex h LEU 391 N 0.61 -0.23 -0.59 2.58 5.85 -0.85 -2.34 115.31 120.34 2oex h LEU 391 Ca 0.53 -0.30 0.10 0.00 0.84 0.00 0.00 57.88 59.06 2oex h LEU 391 Cb 1.03 0.06 -0.11 0.00 0.37 0.00 0.00 40.66 42.00 2oex h LEU 391 CO -0.29 0.27 -0.34 0.00 -0.34 0.00 0.00 178.44 177.74 2oex h ALA 392 N -0.28 -0.06 -0.73 1.25 0.00 -1.06 -0.04 119.26 118.35 2oex h ALA 392 Ca -0.03 0.16 0.10 0.00 0.00 0.00 0.00 54.91 55.15 2oex h ALA 392 Cb 0.52 0.79 -0.08 0.00 0.00 0.00 0.00 17.79 19.02 2oex h ALA 392 CO 0.05 -0.68 0.36 -0.91 0.00 0.00 0.00 179.25 178.06 2oex h ASN 393 N -0.17 0.44 0.38 0.00 2.35 -1.19 -1.02 115.58 116.38 2oex h ASN 393 Ca 0.23 0.07 -0.02 0.00 -0.55 0.00 0.00 56.30 56.03 2oex h ASN 393 Cb 0.55 -0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.92 2oex h ASN 393 CO -0.68 0.24 -0.09 1.23 -1.65 0.00 0.00 177.43 176.48 2oex h GLY 394 N 0.58 0.00 0.33 2.83 0.00 -0.47 0.05 103.07 106.39 2oex h GLY 394 Ca 0.37 0.00 -0.25 0.00 0.00 0.00 0.00 47.33 47.45 2oex h GLY 394 CO -0.30 0.00 -1.32 -2.08 0.00 0.00 0.00 176.54 172.84 2oex h VAL 395 N 0.00 1.00 -0.56 4.60 2.07 -0.24 -2.89 116.25 120.23 2oex h VAL 395 Ca -0.00 -2.31 0.11 0.00 0.82 0.00 0.00 66.70 65.32 2oex h VAL 395 Cb 0.30 2.57 -0.09 0.00 -1.52 0.00 0.00 31.29 32.55 2oex h VAL 395 CO 0.01 0.59 0.05 -0.07 0.02 0.00 0.00 177.57 178.16 2oex h LEU 396 N -0.55 -0.15 0.20 2.57 3.38 -0.98 -2.46 115.31 117.33 2oex h LEU 396 Ca -0.31 0.12 0.01 0.00 0.09 0.00 0.00 57.88 57.79 2oex h LEU 396 Cb 1.58 0.20 -0.02 0.00 0.09 0.00 0.00 40.66 42.51 2oex h LEU 396 CO -0.04 -0.05 -0.21 0.00 0.09 0.00 0.00 178.44 178.23 2oex h ALA 397 N 1.48 -0.42 0.00 1.53 0.00 -1.11 -1.25 119.26 119.48 2oex h ALA 397 Ca 0.29 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.14 2oex h ALA 397 Cb 0.44 0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.54 2oex h ALA 397 CO -0.44 -0.77 0.08 -1.13 0.00 0.00 0.00 179.25 177.00 2oex n SER 398 N -5.34 0.00 -0.02 0.00 3.41 -0.95 -0.23 113.62 110.49 2oex n SER 398 Ca -0.08 0.42 0.02 0.00 -0.26 0.00 0.00 58.87 58.97 2oex n SER 398 Cb 0.25 -0.42 0.02 0.00 -0.26 0.00 0.00 64.21 63.80 2oex n SER 398 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2oex n LEU 399 N -1.42 1.96 -3.83 1.04 4.77 -1.05 -5.00 117.00 113.47 2oex n LEU 399 Ca 0.00 -2.09 -0.30 0.00 -0.03 0.00 0.00 56.01 53.59 2oex n LEU 399 Cb 0.08 -0.07 0.02 0.00 -2.33 0.00 0.00 43.42 41.11 2oex n LEU 399 CO 0.00 0.51 0.07 -3.20 -1.33 0.00 0.00 177.39 173.44 2oex n ASN 400 N -0.63 -4.57 -4.72 -1.43 5.15 0.68 -4.85 115.26 104.90 2oex n ASN 400 Ca 0.03 -0.73 -0.28 0.00 -0.60 0.00 0.00 54.58 52.99 2oex n ASN 400 Cb 0.33 -3.67 -0.07 0.00 -0.53 0.00 0.00 39.78 35.84 2oex n ASN 400 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 2oex s LEU 401 N -7.15 3.54 0.00 1.20 1.43 -0.50 -0.22 118.68 116.98 2oex s LEU 401 Ca 0.63 -0.21 0.10 0.00 -1.03 0.00 0.00 54.13 53.62 2oex s LEU 401 Cb -0.32 -2.22 0.48 0.00 0.03 0.00 0.00 46.19 44.16 2oex s LEU 401 CO 0.77 0.13 1.32 -0.81 0.23 0.00 0.00 176.35 177.99 2oex n PRO 402 N 0.17 1.19 -0.30 1.29 -0.04 -1.26 -4.29 135.00 131.75 2oex n PRO 402 Ca -0.10 -0.29 0.01 0.00 -0.04 0.00 0.00 63.50 63.08 2oex n PRO 402 Cb 0.53 -1.17 0.14 0.00 -0.04 0.00 0.00 33.50 32.96 2oex n PRO 402 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2oex h ALA 403 N 3.39 1.14 -0.89 0.55 0.00 -1.92 -1.99 119.26 119.53 2oex h ALA 403 Ca 0.00 -0.00 0.11 0.00 0.00 0.00 0.00 54.91 55.02 2oex h ALA 403 Cb 0.12 -0.22 -0.08 0.00 0.00 0.00 0.00 17.79 17.61 2oex h ALA 403 CO 0.00 0.24 0.52 0.00 0.00 0.00 0.00 179.25 180.01 2oex h ALA 404 N 1.40 1.31 -0.32 0.00 0.00 -0.93 -2.03 119.26 118.69 2oex h ALA 404 Ca 0.37 0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.31 2oex h ALA 404 Cb 0.18 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.83 2oex h ALA 404 CO -0.18 0.11 0.00 0.44 0.00 0.00 0.00 179.25 179.63 2oex n ILE 405 N -4.72 0.46 0.16 0.00 -5.35 -0.75 -3.27 119.36 105.88 2oex n ILE 405 Ca 0.16 -0.44 0.02 0.00 -0.27 0.00 0.00 62.75 62.23 2oex n ILE 405 Cb 0.33 0.20 0.03 0.00 -1.74 0.00 0.00 39.64 38.45 2oex n ILE 405 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 2oex n GLU 406 N 0.44 0.12 -3.57 6.28 1.02 -0.78 -4.92 120.64 119.24 2oex n GLU 406 Ca 0.11 -0.92 -0.37 0.00 -0.02 0.00 0.00 57.16 55.96 2oex n GLU 406 Cb 0.28 -1.10 -0.05 0.00 -0.02 0.00 0.00 31.44 30.55 2oex n GLU 406 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 2oex n ASP 407 N 0.23 4.44 -0.06 1.62 2.03 -1.13 -4.69 116.55 118.98 2oex n ASP 407 Ca 0.03 -3.15 -0.07 0.00 0.52 0.00 0.00 54.79 52.12 2oex n ASP 407 Cb 0.15 -1.08 -0.05 0.00 -0.72 0.00 0.00 41.12 39.42 2oex n ASP 407 CO 0.00 0.00 0.00 -0.37 -1.92 0.00 0.00 177.20 174.91 2oex h VAL 408 N 3.92 0.63 -3.53 5.18 -1.51 -1.87 -3.41 116.25 115.67 2oex h VAL 408 Ca 0.17 -1.52 -0.62 0.00 -1.23 0.00 0.00 66.70 63.50 2oex h VAL 408 Cb 0.80 1.24 -0.12 0.00 -2.13 0.00 0.00 31.29 31.08 2oex h VAL 408 CO 0.90 0.21 0.25 -0.94 -1.23 0.00 0.00 177.57 176.76 2oex s SER 409 N -5.90 6.51 0.00 4.19 1.04 -1.26 0.19 113.70 118.48 2oex s SER 409 Ca -0.10 0.34 0.00 0.00 0.48 0.00 0.00 55.95 56.66 2oex s SER 409 Cb -0.00 -2.36 0.00 0.00 0.10 0.00 0.00 66.02 63.76 2oex s SER 409 CO 0.29 -0.61 1.02 0.61 0.98 0.00 0.00 173.24 175.53 2oex n GLY 410 N 4.51 1.52 0.36 7.32 0.00 -1.24 -2.87 105.19 114.79 2oex n GLY 410 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 2oex n GLY 410 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2oex n ASP 411 N 1.57 0.00 -4.23 1.61 5.68 -1.26 -2.56 116.55 117.36 2oex n ASP 411 Ca 0.00 -1.38 -0.18 0.00 -0.50 0.00 0.00 54.79 52.73 2oex n ASP 411 Cb 0.28 -0.08 -0.11 0.00 -1.14 0.00 0.00 41.12 40.07 2oex n ASP 411 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 2oex s THR 412 N 0.00 1.29 -0.26 2.12 2.01 -1.14 -5.05 115.64 114.61 2oex s THR 412 Ca 0.00 -1.65 -0.27 0.00 0.31 0.00 0.00 61.69 60.08 2oex s THR 412 Cb 0.00 -1.46 0.00 0.00 0.01 0.00 0.00 72.50 71.06 2oex s THR 412 CO 0.00 -0.39 0.93 -0.69 -0.69 0.00 0.00 174.62 173.79 2oex s VAL 413 N -2.01 4.73 0.23 3.82 1.01 -1.26 -5.00 120.40 121.92 2oex s VAL 413 Ca 0.07 1.71 -0.30 0.00 0.00 0.00 0.00 61.98 63.45 2oex s VAL 413 Cb -0.06 -4.23 -0.15 0.00 0.00 0.00 0.00 36.38 31.95 2oex s VAL 413 CO 0.03 -0.19 1.10 -2.65 0.00 0.00 0.00 175.10 173.38 2oex n PRO 414 N 6.27 1.30 -0.16 2.72 -0.02 -1.26 -4.67 135.00 139.17 2oex n PRO 414 Ca 0.09 0.46 -0.09 0.00 -2.02 0.00 0.00 63.50 61.94 2oex n PRO 414 Cb 0.47 -1.90 -0.03 0.00 -0.02 0.00 0.00 33.50 32.02 2oex n PRO 414 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 2oex h GLN 415 N 2.73 -0.26 -0.33 -0.52 4.20 -1.94 -0.54 115.11 118.46 2oex h GLN 415 Ca -0.41 0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.32 2oex h GLN 415 Cb 1.34 0.06 -0.02 0.00 0.30 0.00 0.00 27.48 29.16 2oex h GLN 415 CO 0.66 -0.17 0.21 0.66 -0.67 0.00 0.00 178.83 179.51 2oex h SER 416 N -0.27 0.38 -0.32 1.46 4.64 -1.95 0.46 113.55 117.95 2oex h SER 416 Ca 0.17 -0.01 -0.12 0.00 -0.47 0.00 0.00 61.79 61.35 2oex h SER 416 Cb 0.57 -0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 62.56 2oex h SER 416 CO -0.63 0.28 -0.28 0.40 -0.87 0.00 0.00 176.83 175.74 2oex h ILE 417 N 0.44 1.29 -0.59 0.95 1.08 -1.63 -1.07 117.51 117.99 2oex h ILE 417 Ca 0.12 -1.44 -0.09 0.00 -0.39 0.00 0.00 64.86 63.07 2oex h ILE 417 Cb -0.03 1.49 -0.02 0.00 -3.07 0.00 0.00 36.82 35.18 2oex h ILE 417 CO -0.02 0.47 0.03 0.25 -0.69 0.00 0.00 178.15 178.18 2oex h LEU 418 N 0.53 0.98 -0.57 1.44 5.85 0.54 -0.45 115.31 123.63 2oex h LEU 418 Ca 0.06 -0.26 -0.03 0.00 0.84 0.00 0.00 57.88 58.49 2oex h LEU 418 Cb 0.84 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 41.59 2oex h LEU 418 CO 0.07 1.02 0.24 0.74 -0.34 0.00 0.00 178.44 180.17 2oex h THR 419 N 0.93 1.22 -0.92 1.05 2.02 -0.16 -0.10 112.91 116.96 2oex h THR 419 Ca 0.17 -0.68 0.01 0.00 0.77 0.00 0.00 66.41 66.68 2oex h THR 419 Cb 0.50 0.60 -0.05 0.00 -1.74 0.00 0.00 68.15 67.47 2oex h THR 419 CO 0.02 0.27 0.61 0.11 0.37 0.00 0.00 175.52 176.90 2oex h LYS 420 N 0.79 1.20 -0.49 6.66 1.57 -0.92 -1.68 116.57 123.70 2oex h LYS 420 Ca 0.19 -0.07 -0.03 0.00 -1.87 0.00 0.00 60.65 58.87 2oex h LYS 420 Cb 0.19 -0.27 -0.02 0.00 0.08 0.00 0.00 32.23 32.21 2oex h LYS 420 CO -0.02 0.79 0.18 1.03 -0.57 0.00 0.00 179.45 180.87 2oex h SER 421 N 1.24 0.64 -0.50 0.86 0.87 -0.44 -2.20 113.55 114.02 2oex h SER 421 Ca 0.34 -0.08 0.03 0.00 -1.23 0.00 0.00 61.79 60.85 2oex h SER 421 Cb -0.12 -0.16 -0.04 0.00 -0.44 0.00 0.00 62.40 61.64 2oex h SER 421 CO -0.08 0.59 0.28 0.03 -0.53 0.00 0.00 176.83 177.12 2oex h ARG 422 N 0.69 0.55 -0.47 2.24 2.47 -0.11 -2.36 114.38 117.40 2oex h ARG 422 Ca 0.17 -0.03 -0.02 0.00 -1.26 0.00 0.00 59.98 58.83 2oex h ARG 422 Cb 0.16 -0.12 -0.02 0.00 -1.65 0.00 0.00 29.97 28.34 2oex h ARG 422 CO -0.01 0.36 0.19 0.77 0.56 0.00 0.00 179.97 181.84 2oex h SER 423 N 0.56 0.64 0.28 7.04 0.02 -0.98 -2.28 113.55 118.83 2oex h SER 423 Ca 0.20 -0.16 -0.01 0.00 -0.84 0.00 0.00 61.79 60.98 2oex h SER 423 Cb 0.05 -0.17 0.00 0.00 0.14 0.00 0.00 62.40 62.42 2oex h SER 423 CO -0.11 0.62 -0.13 0.58 -1.14 0.00 0.00 176.83 176.65 2oex h VAL 424 N 0.61 0.76 -0.74 2.27 2.07 -1.30 -0.24 116.25 119.68 2oex h VAL 424 Ca 0.16 -0.50 0.13 0.00 0.82 0.00 0.00 66.70 67.30 2oex h VAL 424 Cb 0.18 1.03 -0.09 0.00 -1.52 0.00 0.00 31.29 30.89 2oex h VAL 424 CO -0.01 0.10 0.32 0.40 0.02 0.00 0.00 177.57 178.40 2oex h ILE 425 N -0.65 0.73 0.00 4.57 2.04 -1.45 0.63 117.51 123.37 2oex h ILE 425 Ca -0.04 -0.17 0.00 0.00 1.00 0.00 0.00 64.86 65.65 2oex h ILE 425 Cb 0.46 0.18 0.00 0.00 -0.74 0.00 0.00 36.82 36.72 2oex h ILE 425 CO 0.06 0.09 -0.24 -1.84 0.00 0.00 0.00 178.15 176.23 2oex n GLU 426 N -4.95 0.27 -0.02 2.37 -0.00 -0.86 -2.23 120.64 115.24 2oex n GLU 426 Ca 0.13 0.17 0.09 0.00 -0.00 0.00 0.00 57.16 57.55 2oex n GLU 426 Cb 0.37 -1.76 0.48 0.00 -0.00 0.00 0.00 31.44 30.53 2oex n GLU 426 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.13 178.07 2oex n GLN 427 N -2.21 1.13 0.00 3.44 7.27 -0.11 -4.82 117.38 122.08 2oex n GLN 427 Ca 0.05 -0.19 0.00 0.00 0.07 0.00 0.00 57.00 56.92 2oex n GLN 427 Cb 0.43 -1.29 0.00 0.00 2.41 0.00 0.00 30.24 31.80 2oex n GLN 427 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2oex n GLY 428 N 0.83 1.34 7.00 1.69 0.00 -0.94 -4.81 105.19 110.29 2oex n GLY 428 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 2oex n GLY 428 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2oex n GLY 429 N -1.31 0.66 0.04 -0.02 0.00 0.13 -3.69 105.19 101.00 2oex n GLY 429 Ca 0.00 -0.86 0.13 0.00 0.00 0.00 0.00 46.02 45.29 2oex n GLY 429 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 2oex n ILE 430 N 0.00 0.23 0.00 -0.61 3.06 -1.26 -3.49 119.36 117.29 2oex n ILE 430 Ca 0.00 -0.15 -0.12 0.00 -2.50 0.00 0.00 62.75 59.98 2oex n ILE 430 Cb 0.00 -0.19 -0.08 0.00 0.54 0.00 0.00 39.64 39.91 2oex n ILE 430 CO 0.00 0.00 0.00 1.56 -2.50 0.00 0.00 176.55 175.61 2oex h GLN 431 N 0.00 0.05 -0.96 9.51 7.50 -1.98 -2.57 115.11 126.65 2oex h GLN 431 Ca 0.00 -0.01 0.16 0.00 0.50 0.00 0.00 58.65 59.29 2oex h GLN 431 Cb 0.63 -0.01 -0.10 0.00 0.05 0.00 0.00 27.48 28.06 2oex h GLN 431 CO 0.00 0.29 0.57 1.79 -1.50 0.00 0.00 178.83 179.98 2oex h THR 432 N -0.21 0.78 0.00 -0.54 1.35 -1.66 0.41 112.91 113.04 2oex h THR 432 Ca 0.01 -0.28 -0.13 0.00 -0.55 0.00 0.00 66.41 65.46 2oex h THR 432 Cb 0.27 -0.09 -0.02 0.00 -1.73 0.00 0.00 68.15 66.58 2oex h THR 432 CO 0.00 0.15 -0.62 0.58 -0.25 0.00 0.00 175.52 175.37 2oex h VAL 433 N 0.80 1.41 -0.31 6.82 2.07 -1.70 -3.13 116.25 122.21 2oex h VAL 433 Ca 0.52 -2.16 -0.13 0.00 0.82 0.00 0.00 66.70 65.75 2oex h VAL 433 Cb 0.71 2.18 -0.00 0.00 -1.52 0.00 0.00 31.29 32.65 2oex h VAL 433 CO -0.34 0.61 -0.33 0.44 0.02 0.00 0.00 177.57 177.97 2oex h ASP 434 N 0.00 0.83 0.12 0.57 3.32 -0.51 -2.31 116.42 118.44 2oex h ASP 434 Ca -0.01 -0.48 -0.01 0.00 0.02 0.00 0.00 57.03 56.56 2oex h ASP 434 Cb 1.13 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 40.45 2oex h ASP 434 CO 0.08 1.14 -0.06 1.56 -1.72 0.00 0.00 179.24 180.24 2oex h GLN 435 N 0.54 -0.16 -0.28 3.56 1.08 -1.45 -2.15 115.11 116.26 2oex h GLN 435 Ca 0.05 0.01 0.03 0.00 -1.45 0.00 0.00 58.65 57.29 2oex h GLN 435 Cb 0.91 0.04 -0.03 0.00 -0.05 0.00 0.00 27.48 28.34 2oex h GLN 435 CO 0.08 0.10 0.08 -0.07 -0.95 0.00 0.00 178.83 178.07 2oex h LEU 436 N -0.42 0.07 -1.04 1.46 3.38 -1.60 -2.07 115.31 115.10 2oex h LEU 436 Ca -0.02 0.03 -0.10 0.00 0.09 0.00 0.00 57.88 57.89 2oex h LEU 436 Cb 0.34 0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.11 2oex h LEU 436 CO 0.03 0.07 -0.43 -0.29 0.09 0.00 0.00 178.44 177.91 2oex h ILE 437 N 0.20 1.32 0.00 1.22 2.10 -1.45 -2.47 117.51 118.43 2oex h ILE 437 Ca 0.12 -1.53 -0.04 0.00 1.08 0.00 0.00 64.86 64.49 2oex h ILE 437 Cb 0.11 1.77 -0.01 0.00 -1.09 0.00 0.00 36.82 37.60 2oex h ILE 437 CO -0.14 0.45 -0.21 0.07 -1.08 0.00 0.00 178.15 177.24 2oex h LYS 438 N 0.08 0.00 0.00 2.19 5.09 -1.00 -3.33 116.57 119.60 2oex h LYS 438 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.74 2oex h LYS 438 Cb 0.80 0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.13 2oex h LYS 438 CO 0.06 0.21 -1.08 -0.85 -2.09 0.00 0.00 179.45 175.70 2oex n GLU 439 N -3.17 0.81 -0.02 0.07 0.28 -0.81 -4.26 120.64 113.54 2oex n GLU 439 Ca 0.03 -0.04 -0.11 0.00 -0.16 0.00 0.00 57.16 56.88 2oex n GLU 439 Cb 0.58 -1.39 -0.06 0.00 1.43 0.00 0.00 31.44 32.00 2oex n GLU 439 CO 0.00 0.00 0.00 1.25 -0.16 0.00 0.00 177.13 178.22 2oex h LEU 440 N 0.00 0.15 -2.22 -1.84 5.85 -1.55 0.19 115.31 115.90 2oex h LEU 440 Ca 0.00 -0.11 -0.01 0.00 0.84 0.00 0.00 57.88 58.60 2oex h LEU 440 Cb 0.53 -0.04 -0.00 0.00 0.37 0.00 0.00 40.66 41.52 2oex h LEU 440 CO 0.00 0.22 -0.06 1.55 -0.34 0.00 0.00 178.44 179.82 2oex h PRO 441 N 0.07 0.00 0.08 5.25 0.13 -1.75 0.13 132.00 135.92 2oex h PRO 441 Ca 0.04 0.00 -0.28 0.00 -0.87 0.00 0.00 66.00 64.89 2oex h PRO 441 Cb 0.11 0.00 0.02 0.00 0.13 0.00 0.00 31.00 31.26 2oex h PRO 441 CO -0.01 0.06 -1.16 0.93 -0.23 0.00 0.00 178.00 177.59 2oex h GLU 442 N 0.00 0.56 -0.94 0.86 5.08 -1.67 -1.78 114.58 116.69 2oex h GLU 442 Ca -0.00 -0.71 -0.00 0.00 -1.00 0.00 0.00 59.36 57.65 2oex h GLU 442 Cb 0.15 0.23 -0.05 0.00 0.50 0.00 0.00 28.75 29.58 2oex h GLU 442 CO 0.01 1.30 0.58 -0.07 -1.00 0.00 0.00 179.01 179.83 2oex h LEU 443 N 0.27 1.12 -0.47 1.33 3.38 0.51 0.07 115.31 121.51 2oex h LEU 443 Ca -0.15 -0.06 -0.17 0.00 0.09 0.00 0.00 57.88 57.58 2oex h LEU 443 Cb 1.82 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 42.29 2oex h LEU 443 CO 0.22 0.85 -0.68 -0.07 0.09 0.00 0.00 178.44 178.85 2oex h LEU 444 N 1.29 0.47 -0.72 1.67 3.38 -0.84 -3.04 115.31 117.52 2oex h LEU 444 Ca 0.34 -0.29 -0.10 0.00 0.09 0.00 0.00 57.88 57.92 2oex h LEU 444 Cb -0.08 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.52 2oex h LEU 444 CO -0.07 1.01 -0.12 -0.61 0.09 0.00 0.00 178.44 178.75 2oex h GLN 445 N 0.28 0.86 -0.19 1.13 5.75 -0.75 -2.60 115.11 119.60 2oex h GLN 445 Ca -0.02 -0.30 0.05 0.00 -0.15 0.00 0.00 58.65 58.22 2oex h GLN 445 Cb 1.23 -0.06 -0.05 0.00 1.07 0.00 0.00 27.48 29.67 2oex h GLN 445 CO 0.12 0.94 -0.11 -0.09 -2.65 0.00 0.00 178.83 177.03 2oex h ARG 446 N 0.78 -0.10 -0.87 1.69 2.43 -0.99 -2.77 114.38 114.55 2oex h ARG 446 Ca 0.13 0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.30 2oex h ARG 446 Cb 0.63 0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 30.16 2oex h ARG 446 CO 0.04 -0.07 0.54 -0.91 -1.51 0.00 0.00 179.97 178.07 2oex h ASN 447 N -0.10 1.02 -0.52 -3.80 2.35 -1.41 -2.29 115.58 110.83 2oex h ASN 447 Ca 0.11 -0.05 0.08 0.00 -0.55 0.00 0.00 56.30 55.89 2oex h ASN 447 Cb 0.26 -0.26 -0.06 0.00 0.05 0.00 0.00 38.32 38.31 2oex h ASN 447 CO -0.25 0.77 0.17 0.03 -1.65 0.00 0.00 177.43 176.50 2oex h ARG 448 N 1.19 0.33 -0.75 0.81 2.47 -1.20 -2.58 114.38 114.65 2oex h ARG 448 Ca 0.31 -0.02 0.05 0.00 -1.26 0.00 0.00 59.98 59.06 2oex h ARG 448 Cb -0.08 -0.07 -0.04 0.00 -1.65 0.00 0.00 29.97 28.12 2oex h ARG 448 CO -0.06 0.22 0.49 0.93 0.56 0.00 0.00 179.97 182.11 2oex h GLU 449 N 0.34 0.84 -0.21 0.04 5.08 -1.18 0.82 114.58 120.30 2oex h GLU 449 Ca 0.25 -0.05 -0.09 0.00 -1.00 0.00 0.00 59.36 58.47 2oex h GLU 449 Cb 0.29 -0.19 -0.00 0.00 0.50 0.00 0.00 28.75 29.35 2oex h GLU 449 CO -0.27 0.55 -0.22 0.82 -1.00 0.00 0.00 179.01 178.89 2oex h ILE 450 N 0.86 1.33 -0.29 3.13 2.04 -1.35 -0.92 117.51 122.30 2oex h ILE 450 Ca 0.31 -1.39 -0.04 0.00 1.00 0.00 0.00 64.86 64.74 2oex h ILE 450 Cb 0.14 1.75 -0.02 0.00 -0.74 0.00 0.00 36.82 37.95 2oex h ILE 450 CO -0.10 0.43 -0.01 0.25 0.00 0.00 0.00 178.15 178.72 2oex h LEU 451 N 0.20 0.42 -0.20 1.44 5.85 -1.01 -1.40 115.31 120.61 2oex h LEU 451 Ca 0.03 -0.07 -0.19 0.00 0.84 0.00 0.00 57.88 58.49 2oex h LEU 451 Cb 0.77 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.67 2oex h LEU 451 CO 0.05 0.49 -0.91 0.44 -0.34 0.00 0.00 178.44 178.18 2oex h ASP 452 N 0.43 0.04 0.09 1.25 3.32 -0.60 -2.72 116.42 118.24 2oex h ASP 452 Ca 0.10 -0.04 -0.00 0.00 0.02 0.00 0.00 57.03 57.10 2oex h ASP 452 Cb 0.30 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 39.84 2oex h ASP 452 CO 0.01 0.92 -0.04 -0.33 -1.72 0.00 0.00 179.24 178.08 2oex h GLU 453 N 0.01 -0.12 -0.76 3.56 4.39 -1.00 -2.71 114.58 117.95 2oex h GLU 453 Ca -0.02 0.01 0.09 0.00 0.34 0.00 0.00 59.36 59.78 2oex h GLU 453 Cb 1.59 0.03 -0.12 0.00 -0.10 0.00 0.00 28.75 30.15 2oex h GLU 453 CO 0.12 0.25 -0.50 0.77 -1.16 0.00 0.00 179.01 178.49 2oex h SER 454 N -0.50 -1.76 0.42 1.42 0.02 -1.28 -0.59 113.55 111.27 2oex h SER 454 Ca -0.01 0.28 -0.08 0.00 -0.84 0.00 0.00 61.79 61.14 2oex h SER 454 Cb 0.42 0.80 -0.01 0.00 0.14 0.00 0.00 62.40 63.74 2oex h SER 454 CO 0.02 -0.31 -0.37 -0.07 -1.14 0.00 0.00 176.83 174.96 2oex h LEU 455 N -0.14 0.00 -0.46 5.07 3.38 -1.57 -2.89 115.31 118.70 2oex h LEU 455 Ca 0.18 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 58.05 2oex h LEU 455 Cb 0.53 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.26 2oex h LEU 455 CO -0.81 0.37 -0.12 -0.09 0.09 0.00 0.00 178.44 177.89 2oex h ARG 456 N 0.00 0.89 -0.11 1.13 2.43 -0.82 -0.14 114.38 117.75 2oex h ARG 456 Ca -0.00 -0.34 0.04 0.00 -0.81 0.00 0.00 59.98 58.86 2oex h ARG 456 Cb 0.68 -0.05 -0.05 0.00 -0.42 0.00 0.00 29.97 30.13 2oex h ARG 456 CO 0.05 0.99 -0.18 -0.07 -1.51 0.00 0.00 179.97 179.25 2oex h LEU 457 N 0.72 -0.54 -0.82 3.80 3.38 -1.00 -0.69 115.31 120.17 2oex h LEU 457 Ca 0.11 0.09 0.16 0.00 0.09 0.00 0.00 57.88 58.34 2oex h LEU 457 Cb 0.67 0.25 -0.10 0.00 0.09 0.00 0.00 40.66 41.56 2oex h LEU 457 CO 0.05 -0.23 0.36 -0.07 0.09 0.00 0.00 178.44 178.64 2oex h LEU 458 N -0.23 0.35 -0.84 1.67 3.38 -1.42 -2.00 115.31 116.22 2oex h LEU 458 Ca 0.09 0.12 -0.09 0.00 0.09 0.00 0.00 57.88 58.09 2oex h LEU 458 Cb 0.36 0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.18 2oex h LEU 458 CO -0.25 0.11 -0.11 0.44 0.09 0.00 0.00 178.44 178.72 2oex h ASP 459 N 0.48 0.73 0.52 -0.43 3.45 -0.04 -2.11 116.42 119.02 2oex h ASP 459 Ca 0.47 -0.22 -0.03 0.00 0.43 0.00 0.00 57.03 57.68 2oex h ASP 459 Cb 0.75 -0.20 0.01 0.00 -0.56 0.00 0.00 39.33 39.33 2oex h ASP 459 CO -0.43 0.87 -0.25 -0.08 -1.57 0.00 0.00 179.24 177.78 2oex h GLU 460 N 0.68 -0.68 -0.87 3.56 4.22 -0.41 -2.54 114.58 118.53 2oex h GLU 460 Ca 0.12 0.05 -0.00 0.00 0.08 0.00 0.00 59.36 59.60 2oex h GLU 460 Cb 0.58 0.15 -0.04 0.00 0.50 0.00 0.00 28.75 29.94 2oex h GLU 460 CO 0.04 -0.38 0.53 1.49 -2.18 0.00 0.00 179.01 178.50 2oex h GLU 461 N -0.92 1.18 0.00 1.92 4.22 -1.52 -2.24 114.58 117.22 2oex h GLU 461 Ca -0.07 -0.11 -0.06 0.00 0.08 0.00 0.00 59.36 59.21 2oex h GLU 461 Cb 0.61 -0.25 -0.01 0.00 0.50 0.00 0.00 28.75 29.61 2oex h GLU 461 CO 0.12 0.83 -0.27 1.49 -2.18 0.00 0.00 179.01 179.00 2oex h GLU 462 N 1.20 0.00 -0.14 1.92 4.81 -1.30 0.33 114.58 121.39 2oex h GLU 462 Ca 0.31 0.00 -0.15 0.00 -0.13 0.00 0.00 59.36 59.40 2oex h GLU 462 Cb -0.05 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.32 2oex h GLU 462 CO -0.06 0.27 -0.53 0.00 -0.73 0.00 0.00 179.01 177.96 2oex h ALA 463 N 1.73 0.82 0.03 2.92 0.00 -0.97 -1.05 119.26 122.74 2oex h ALA 463 Ca -0.00 -0.50 -0.25 0.00 0.00 0.00 0.00 54.91 54.16 2oex h ALA 463 Cb 0.49 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 18.21 2oex h ALA 463 CO 0.03 0.68 -1.03 1.79 0.00 0.00 0.00 179.25 180.73 2oex h THR 464 N 0.32 1.38 0.34 0.00 1.35 -1.12 -2.49 112.91 112.69 2oex h THR 464 Ca 0.01 -2.48 -0.02 0.00 -0.55 0.00 0.00 66.41 63.38 2oex h THR 464 Cb 1.04 2.50 0.00 0.00 -1.73 0.00 0.00 68.15 69.96 2oex h THR 464 CO 0.09 0.74 -0.16 -0.78 -0.25 0.00 0.00 175.52 175.16 2oex h ASP 465 N 0.25 -0.38 -0.84 5.36 -0.00 -0.94 -1.68 116.42 118.18 2oex h ASP 465 Ca -0.11 -0.08 0.18 0.00 -0.00 0.00 0.00 57.03 57.02 2oex h ASP 465 Cb 1.68 0.10 -0.11 0.00 -0.00 0.00 0.00 39.33 41.00 2oex h ASP 465 CO 0.18 -0.15 0.36 0.78 -0.00 0.00 0.00 179.24 180.41 2oex h ASN 466 N -0.61 0.32 -0.49 2.28 2.35 -1.18 -1.35 115.58 116.90 2oex h ASN 466 Ca -0.05 0.13 -0.10 0.00 -0.55 0.00 0.00 56.30 55.74 2oex h ASN 466 Cb 0.44 0.10 -0.02 0.00 0.05 0.00 0.00 38.32 38.90 2oex h ASN 466 CO 0.08 0.07 -0.06 -0.78 -1.65 0.00 0.00 177.43 175.09 2oex h ASP 467 N 0.44 0.93 0.30 5.81 3.58 -1.26 -2.41 116.42 123.81 2oex h ASP 467 Ca 0.49 -0.27 -0.04 0.00 0.42 0.00 0.00 57.03 57.63 2oex h ASP 467 Cb 0.83 -0.25 -0.01 0.00 1.72 0.00 0.00 39.33 41.63 2oex h ASP 467 CO -0.46 1.02 -0.18 -0.07 -2.88 0.00 0.00 179.24 176.66 2oex h LEU 468 N 0.85 0.00 -0.09 2.28 -0.00 -0.30 -1.70 115.31 116.35 2oex h LEU 468 Ca 0.15 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 58.03 2oex h LEU 468 Cb 0.58 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.24 2oex h LEU 468 CO 0.04 0.18 -0.17 0.54 -0.00 0.00 0.00 178.44 179.03 2oex n ARG 469 N -3.96 0.29 -0.08 1.13 1.74 -0.89 -2.21 116.66 112.68 2oex n ARG 469 Ca -0.02 -0.09 -0.13 0.00 -0.77 0.00 0.00 57.85 56.83 2oex n ARG 469 Cb 0.27 -1.50 -0.08 0.00 -1.02 0.00 0.00 32.46 30.13 2oex n ARG 469 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2oex h ALA 470 N 3.26 0.11 0.24 7.54 0.00 -1.06 -3.40 119.26 125.95 2oex h ALA 470 Ca 0.00 -0.74 0.00 0.00 0.00 0.00 0.00 54.91 54.17 2oex h ALA 470 Cb 0.44 0.46 -0.02 0.00 0.00 0.00 0.00 17.79 18.66 2oex h ALA 470 CO 0.00 0.44 -0.23 0.87 0.00 0.00 0.00 179.25 180.33 2oex h LYS 471 N -1.00 -0.48 -6.40 0.00 1.57 -1.47 -3.42 116.57 105.38 2oex h LYS 471 Ca -0.15 0.03 -0.63 0.00 -1.87 0.00 0.00 60.65 58.04 2oex h LYS 471 Cb 0.87 0.11 -0.13 0.00 0.08 0.00 0.00 32.23 33.16 2oex h LYS 471 CO -0.09 -0.32 -0.68 -0.06 -0.57 0.00 0.00 179.45 177.73 2oex s PHE 472 N -6.09 2.82 0.00 -1.35 0.40 -0.94 -5.08 117.98 107.74 2oex s PHE 472 Ca -0.16 -0.13 0.00 0.00 -0.60 0.00 0.00 56.93 56.04 2oex s PHE 472 Cb 0.06 -1.40 0.00 0.00 0.51 0.00 0.00 43.02 42.19 2oex s PHE 472 CO 0.65 0.49 0.00 1.63 0.70 0.00 0.00 175.22 178.69 2oex n LYS 473 N 0.19 0.00 0.00 0.44 5.02 -1.26 -4.01 118.16 118.54 2oex n LYS 473 Ca -0.11 0.00 0.14 0.00 -2.02 0.00 0.00 58.31 56.32 2oex n LYS 473 Cb 0.54 0.00 0.80 0.00 -0.02 0.00 0.00 35.03 36.35 2oex n LYS 473 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2oex n GLU 474 N -0.26 0.77 -0.14 1.97 1.02 -1.26 -2.39 120.64 120.35 2oex n GLU 474 Ca 0.00 0.01 0.08 0.00 -0.02 0.00 0.00 57.16 57.23 2oex n GLU 474 Cb 0.00 -1.50 0.25 0.00 -0.02 0.00 0.00 31.44 30.17 2oex n GLU 474 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2oex n ARG 475 N -1.06 1.82 -3.65 3.49 1.74 -1.26 -4.40 116.66 113.34 2oex n ARG 475 Ca 0.19 -1.25 -0.29 0.00 -0.77 0.00 0.00 57.85 55.72 2oex n ARG 475 Cb 0.12 -1.34 -0.13 0.00 -1.02 0.00 0.00 32.46 30.10 2oex n ARG 475 CO 0.00 0.00 0.00 -0.46 -1.52 0.00 0.00 177.63 175.65 2oex s TRP 476 N -1.62 1.67 -1.00 -1.55 -0.11 -1.01 -5.02 118.94 110.31 2oex s TRP 476 Ca 0.28 -2.23 0.21 0.00 1.22 0.00 0.00 56.10 55.58 2oex s TRP 476 Cb 0.15 -1.64 -0.23 0.00 -1.50 0.00 0.00 33.47 30.25 2oex s TRP 476 CO 0.21 -0.79 0.89 1.04 -4.62 0.00 0.00 176.95 173.68 2oex n GLN 477 N 3.65 0.10 -1.51 5.86 6.02 -1.26 -4.91 117.38 125.33 2oex n GLN 477 Ca 0.10 -0.01 -0.35 0.00 -0.01 0.00 0.00 57.00 56.73 2oex n GLN 477 Cb 0.35 -1.49 0.09 0.00 1.02 0.00 0.00 30.24 30.21 2oex n GLN 477 CO 0.00 0.00 0.00 -0.98 -1.01 0.00 0.00 177.06 175.07 2oex s ARG 478 N -2.97 2.22 -0.02 -1.09 1.70 -1.26 -4.86 118.95 112.67 2oex s ARG 478 Ca 0.08 1.86 -0.38 0.00 -0.47 0.00 0.00 55.73 56.82 2oex s ARG 478 Cb 0.16 -1.83 -0.17 0.00 -0.57 0.00 0.00 34.95 32.54 2oex s ARG 478 CO 0.86 -1.79 1.41 2.41 -1.08 0.00 0.00 175.30 177.10 2oex n THR 479 N -2.51 0.07 -1.70 4.99 -1.04 -1.26 -4.87 114.28 107.97 2oex n THR 479 Ca 0.14 -0.01 -0.40 0.00 -2.04 0.00 0.00 64.05 61.74 2oex n THR 479 Cb 0.50 -0.82 0.03 0.00 -1.82 0.00 0.00 70.33 68.22 2oex n THR 479 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 2oex n PRO 480 N 3.10 1.69 -0.11 -2.82 -0.02 -1.26 -4.84 135.00 130.74 2oex n PRO 480 Ca 0.21 0.61 -0.01 0.00 -2.02 0.00 0.00 63.50 62.29 2oex n PRO 480 Cb 0.16 -2.41 0.24 0.00 -0.02 0.00 0.00 33.50 31.47 2oex n PRO 480 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 2oex h SER 481 N 1.62 0.71 -0.32 2.55 0.02 -1.92 -1.71 113.55 114.51 2oex h SER 481 Ca -0.49 -0.10 0.03 0.00 -0.84 0.00 0.00 61.79 60.39 2oex h SER 481 Cb 1.31 -0.18 -0.02 0.00 0.14 0.00 0.00 62.40 63.65 2oex h SER 481 CO 0.58 0.67 0.21 -0.55 -1.14 0.00 0.00 176.83 176.60 2oex h ASN 482 N 0.76 0.27 0.07 3.07 7.08 -1.92 0.31 115.58 125.22 2oex h ASN 482 Ca 0.18 -0.00 -0.18 0.00 -3.08 0.00 0.00 56.30 53.21 2oex h ASN 482 Cb 0.21 -0.06 0.02 0.00 -2.08 0.00 0.00 38.32 36.40 2oex h ASN 482 CO -0.01 0.19 -0.75 -0.08 -2.08 0.00 0.00 177.43 174.71 2oex h GLU 483 N 0.32 0.38 -0.27 4.14 4.81 -1.77 -2.98 114.58 119.21 2oex h GLU 483 Ca 0.13 -0.50 -0.02 0.00 -0.13 0.00 0.00 59.36 58.84 2oex h GLU 483 Cb 0.12 0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.65 2oex h GLU 483 CO -0.03 1.19 0.10 1.25 -0.73 0.00 0.00 179.01 180.78 2oex h LEU 484 N -0.19 0.34 -2.88 1.64 5.85 -0.88 -3.05 115.31 116.13 2oex h LEU 484 Ca -0.11 -0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.58 2oex h LEU 484 Cb 1.50 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 42.45 2oex h LEU 484 CO 0.14 0.32 0.00 -1.22 -0.34 0.00 0.00 178.44 177.35 2oex n TYR 485 N -4.41 1.00 0.09 1.25 4.01 0.06 -4.50 117.16 114.65 2oex n TYR 485 Ca 0.01 -0.54 -0.13 0.00 -0.16 0.00 0.00 57.90 57.08 2oex n TYR 485 Cb 0.14 -0.07 -0.07 0.00 -0.31 0.00 0.00 39.34 39.02 2oex n TYR 485 CO 0.00 0.00 0.00 -0.22 -0.46 0.00 0.00 176.86 176.18 2oex h LYS 486 N 3.75 -0.14 0.00 -0.72 3.64 -1.41 -1.11 116.57 120.59 2oex h LYS 486 Ca 0.00 0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.36 2oex h LYS 486 Cb 1.06 0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 32.91 2oex h LYS 486 CO 0.06 -0.07 -0.14 -1.00 -2.27 0.00 0.00 179.45 176.03 2oex h PRO 487 N -0.17 0.00 0.15 1.90 0.13 -1.83 -2.43 132.00 129.75 2oex h PRO 487 Ca -0.01 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.11 2oex h PRO 487 Cb 0.13 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.27 2oex h PRO 487 CO 0.02 0.14 -0.07 -0.07 -0.23 0.00 0.00 178.00 177.79 2oex h LEU 488 N 0.00 -0.17 -2.04 1.56 3.38 -1.77 -0.75 115.31 115.52 2oex h LEU 488 Ca -0.00 -0.38 0.12 0.00 0.09 0.00 0.00 57.88 57.72 2oex h LEU 488 Cb 0.64 0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.41 2oex h LEU 488 CO 0.02 0.39 0.37 0.03 0.09 0.00 0.00 178.44 179.34 2oex h ARG 489 N -0.85 0.00 -0.23 1.13 3.08 -1.23 0.37 114.38 116.64 2oex h ARG 489 Ca -0.02 0.00 -0.19 0.00 0.07 0.00 0.00 59.98 59.84 2oex h ARG 489 Cb 0.53 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.59 2oex h ARG 489 CO 0.03 0.00 -0.61 0.00 -1.07 0.00 0.00 179.97 178.33 2oex h ALA 490 N 1.67 0.39 0.06 0.04 0.00 -1.29 -0.54 119.26 119.58 2oex h ALA 490 Ca 0.20 -0.54 0.01 0.00 0.00 0.00 0.00 54.91 54.59 2oex h ALA 490 Cb 0.93 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.65 2oex h ALA 490 CO -0.00 0.64 -0.12 0.93 0.00 0.00 0.00 179.25 180.70 2oex h GLU 491 N 0.58 -0.22 -0.24 0.00 5.08 0.12 -0.12 114.58 119.78 2oex h GLU 491 Ca -0.01 0.01 0.06 0.00 -1.00 0.00 0.00 59.36 58.42 2oex h GLU 491 Cb 1.22 0.05 -0.07 0.00 0.50 0.00 0.00 28.75 30.46 2oex h GLU 491 CO 0.13 -0.14 -0.21 0.78 -1.00 0.00 0.00 179.01 178.57 2oex h GLY 492 N -0.22 -0.09 0.25 -3.84 0.00 -0.94 0.15 103.07 98.38 2oex h GLY 492 Ca 0.02 0.26 0.12 0.00 0.00 0.00 0.00 47.33 47.74 2oex h GLY 492 CO -0.07 -0.19 0.29 -0.84 0.00 0.00 0.00 176.54 175.73 2oex h THR 493 N -0.21 0.71 -0.37 4.70 2.02 -0.83 0.18 112.91 119.10 2oex h THR 493 Ca 0.14 -0.16 -0.15 0.00 0.77 0.00 0.00 66.41 67.01 2oex h THR 493 Cb 0.42 0.21 -0.01 0.00 -1.74 0.00 0.00 68.15 67.03 2oex h THR 493 CO -0.36 0.08 -0.36 0.78 0.37 0.00 0.00 175.52 176.03 2oex h ASN 494 N 0.46 0.93 -0.89 4.18 -0.26 0.64 -1.76 115.58 118.88 2oex h ASN 494 Ca 0.38 -0.41 0.06 0.00 -0.56 0.00 0.00 56.30 55.77 2oex h ASN 494 Cb 0.52 -0.26 -0.06 0.00 -1.06 0.00 0.00 38.32 37.46 2oex h ASN 494 CO -0.36 1.18 0.56 -0.26 -1.06 0.00 0.00 177.43 177.49 2oex h PHE 495 N 0.72 1.03 -0.89 1.19 0.05 -0.15 -2.42 116.94 116.47 2oex h PHE 495 Ca 0.07 0.03 0.01 0.00 3.82 0.00 0.00 57.97 61.89 2oex h PHE 495 Cb 0.93 -0.33 -0.04 0.00 2.00 0.00 0.00 35.95 38.51 2oex h PHE 495 CO 0.06 0.53 0.58 -0.09 -0.18 0.00 0.00 178.31 179.20 2oex h ARG 496 N 1.01 1.18 -0.55 1.51 2.43 -0.02 -1.24 114.38 118.70 2oex h ARG 496 Ca 0.39 -0.08 0.01 0.00 -0.81 0.00 0.00 59.98 59.49 2oex h ARG 496 Cb 0.17 -0.26 -0.03 0.00 -0.42 0.00 0.00 29.97 29.43 2oex h ARG 496 CO -0.17 0.79 0.36 1.15 -1.51 0.00 0.00 179.97 180.59 2oex h THR 497 N 1.21 1.14 -0.63 0.20 2.02 -0.89 -0.78 112.91 115.18 2oex h THR 497 Ca 0.33 -0.25 -0.10 0.00 0.77 0.00 0.00 66.41 67.16 2oex h THR 497 Cb -0.13 0.33 -0.02 0.00 -1.74 0.00 0.00 68.15 66.59 2oex h THR 497 CO -0.07 0.14 0.02 0.58 0.37 0.00 0.00 175.52 176.56 2oex h VAL 498 N 0.74 1.27 -0.27 3.16 2.07 -0.91 -2.07 116.25 120.24 2oex h VAL 498 Ca 0.20 -1.14 -0.12 0.00 0.82 0.00 0.00 66.70 66.46 2oex h VAL 498 Cb -0.08 0.76 -0.01 0.00 -1.52 0.00 0.00 31.29 30.44 2oex h VAL 498 CO -0.05 0.42 -0.35 -0.07 0.02 0.00 0.00 177.57 177.54 2oex h LEU 499 N 1.00 0.61 -0.41 2.57 3.38 -0.94 -1.72 115.31 119.80 2oex h LEU 499 Ca 0.18 -0.25 -0.10 0.00 0.09 0.00 0.00 57.88 57.80 2oex h LEU 499 Cb 0.54 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.11 2oex h LEU 499 CO 0.03 0.91 -0.12 0.44 0.09 0.00 0.00 178.44 179.78 2oex h ASP 500 N 0.49 0.82 -0.39 -0.43 3.32 -1.02 -1.31 116.42 117.90 2oex h ASP 500 Ca 0.05 -0.37 0.02 0.00 0.02 0.00 0.00 57.03 56.75 2oex h ASP 500 Cb 0.83 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 40.13 2oex h ASP 500 CO 0.07 1.00 0.21 0.50 -1.72 0.00 0.00 179.24 179.30 2oex h LYS 501 N 0.63 0.41 0.11 3.56 3.64 -1.32 -2.07 116.57 121.53 2oex h LYS 501 Ca 0.10 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.45 2oex h LYS 501 Cb 0.66 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.39 2oex h LYS 501 CO 0.05 0.27 -0.05 0.00 -2.27 0.00 0.00 179.45 177.45 2oex h ALA 502 N 1.19 -0.14 -0.83 5.00 0.00 -1.15 -0.09 119.26 123.24 2oex h ALA 502 Ca 0.16 -0.04 0.12 0.00 0.00 0.00 0.00 54.91 55.15 2oex h ALA 502 Cb 0.04 0.05 -0.08 0.00 0.00 0.00 0.00 17.79 17.80 2oex h ALA 502 CO -0.09 -0.57 0.45 0.28 0.00 0.00 0.00 179.25 179.32 2oex h VAL 503 N -0.16 0.82 -0.25 0.00 2.07 -1.21 -0.41 116.25 117.11 2oex h VAL 503 Ca -0.01 -0.24 -0.14 0.00 0.82 0.00 0.00 66.70 67.13 2oex h VAL 503 Cb 0.13 0.06 -0.00 0.00 -1.52 0.00 0.00 31.29 29.95 2oex h VAL 503 CO 0.02 0.13 -0.38 -0.61 0.02 0.00 0.00 177.57 176.75 2oex h GLN 504 N 0.71 0.71 0.00 1.57 4.15 -1.08 -2.41 115.11 118.76 2oex h GLN 504 Ca 0.42 -0.42 0.00 0.00 0.77 0.00 0.00 58.65 59.42 2oex h GLN 504 Cb 0.49 0.04 0.00 0.00 0.21 0.00 0.00 27.48 28.22 2oex h GLN 504 CO -0.30 1.04 0.00 0.00 -1.93 0.00 0.00 178.83 177.64 2oex h ALA 505 N 0.66 1.00 0.12 3.38 0.00 -0.54 -2.71 119.26 121.18 2oex h ALA 505 Ca 0.02 0.00 -0.26 0.00 0.00 0.00 0.00 54.91 54.67 2oex h ALA 505 Cb 0.97 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.76 2oex h ALA 505 CO 0.09 0.00 -1.32 -0.44 0.00 0.00 0.00 179.25 177.58 2oex h ASP 506 N 0.00 0.41 -0.94 0.00 3.32 -0.82 -3.05 116.42 115.34 2oex h ASP 506 Ca 0.00 -0.87 0.21 0.00 0.02 0.00 0.00 57.03 56.39 2oex h ASP 506 Cb 0.34 -0.13 -0.12 0.00 0.22 0.00 0.00 39.33 39.64 2oex h ASP 506 CO 0.00 1.59 0.50 1.23 -1.72 0.00 0.00 179.24 180.83 2oex h GLY 507 N 0.01 1.65 1.84 2.75 0.00 -1.34 0.14 103.07 108.12 2oex h GLY 507 Ca -0.28 -0.26 -0.04 0.00 0.00 0.00 0.00 47.33 46.76 2oex h GLY 507 CO 0.08 -0.18 -0.10 1.46 0.00 0.00 0.00 176.54 177.81 2oex h GLN 508 N 0.56 0.20 0.16 4.80 1.08 -1.55 -1.42 115.11 118.94 2oex h GLN 508 Ca 0.57 -0.04 -0.23 0.00 -1.45 0.00 0.00 58.65 57.50 2oex h GLN 508 Cb 1.00 -0.03 0.02 0.00 -0.05 0.00 0.00 27.48 28.42 2oex h GLN 508 CO -0.46 0.31 -1.03 0.28 -0.95 0.00 0.00 178.83 176.98 2oex h VAL 509 N 0.19 1.40 -0.42 -0.54 2.07 -0.82 -3.17 116.25 114.96 2oex h VAL 509 Ca 0.04 -2.55 -0.01 0.00 0.82 0.00 0.00 66.70 65.00 2oex h VAL 509 Cb 0.30 3.11 -0.02 0.00 -1.52 0.00 0.00 31.29 33.15 2oex h VAL 509 CO 0.02 0.73 0.22 0.50 0.02 0.00 0.00 177.57 179.06 2oex h LYS 510 N -0.27 0.59 -0.18 1.57 3.64 -0.74 -1.68 116.57 119.50 2oex h LYS 510 Ca -0.19 -0.08 -0.01 0.00 -1.27 0.00 0.00 60.65 59.11 2oex h LYS 510 Cb 1.76 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 33.46 2oex h LYS 510 CO 0.16 0.49 0.08 1.49 -2.27 0.00 0.00 179.45 179.40 2oex h GLU 511 N 0.53 0.26 -0.93 1.90 4.57 -1.40 0.52 114.58 120.03 2oex h GLU 511 Ca 0.14 -0.04 0.02 0.00 -1.18 0.00 0.00 59.36 58.30 2oex h GLU 511 Cb 0.08 -0.05 -0.05 0.00 -0.16 0.00 0.00 28.75 28.58 2oex h GLU 511 CO -0.02 0.30 0.61 0.00 -1.18 0.00 0.00 179.01 178.72 2oex h TYR 513 N 1.23 0.55 0.00 0.00 3.20 -0.71 -2.28 116.97 118.96 2oex h TYR 513 Ca 0.35 -0.25 -0.05 0.00 3.14 0.00 0.00 58.73 61.91 2oex h TYR 513 Cb -0.10 -0.08 -0.01 0.00 1.54 0.00 0.00 36.73 38.08 2oex h TYR 513 CO -0.00 1.02 -0.26 1.96 -1.64 0.00 0.00 178.16 179.24 2oex h GLN 514 N 0.27 0.00 -0.01 1.82 4.20 -0.75 0.17 115.11 120.81 2oex h GLN 514 Ca -0.04 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.67 2oex h GLN 514 Cb 1.34 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.12 2oex h GLN 514 CO 0.13 0.26 -0.06 0.43 -0.67 0.00 0.00 178.83 178.91 2oex n SER 515 N -4.03 1.07 -0.09 1.46 7.64 -1.04 -4.11 113.62 114.52 2oex n SER 515 Ca -0.02 -1.19 -0.15 0.00 1.01 0.00 0.00 58.87 58.52 2oex n SER 515 Cb 0.32 0.02 -0.07 0.00 -1.01 0.00 0.00 64.21 63.47 2oex n SER 515 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 2oex n HIS 516 N -0.29 0.00 -0.29 1.43 8.25 -0.74 -4.83 115.22 118.75 2oex n HIS 516 Ca 0.18 0.00 0.29 0.00 -0.26 0.00 0.00 57.72 57.92 2oex n HIS 516 Cb 0.31 -0.63 0.53 0.00 1.12 0.00 0.00 29.99 31.32 2oex n HIS 516 CO 0.00 0.00 0.00 2.89 0.64 0.00 0.00 176.34 179.87 2oex n ARG 517 N -3.37 -0.05 -0.29 -0.41 1.85 0.52 -1.82 116.66 113.09 2oex n ARG 517 Ca -0.32 1.25 -0.08 0.00 -1.00 0.00 0.00 57.85 57.71 2oex n ARG 517 Cb 0.78 -2.25 -0.04 0.00 -1.05 0.00 0.00 32.46 29.90 2oex n ARG 517 CO 0.00 0.00 0.00 -0.44 -0.01 0.00 0.00 177.63 177.18 2oex h ASP 518 N 0.00 -1.67 0.22 2.89 3.32 -1.86 0.92 116.42 120.25 2oex h ASP 518 Ca 0.77 0.28 -0.10 0.00 0.02 0.00 0.00 57.03 58.00 2oex h ASP 518 Cb 2.02 0.77 -0.01 0.00 0.22 0.00 0.00 39.33 42.33 2oex h ASP 518 CO -0.70 -0.30 -0.39 0.74 -1.72 0.00 0.00 179.24 176.87 2oex h THR 519 N -0.13 1.30 0.00 0.35 2.02 -1.74 -2.28 112.91 112.43 2oex h THR 519 Ca 0.20 -1.45 -0.06 0.00 0.77 0.00 0.00 66.41 65.88 2oex h THR 519 Cb 0.54 1.65 -0.01 0.00 -1.74 0.00 0.00 68.15 68.59 2oex h THR 519 CO -0.81 0.43 -0.27 0.40 0.37 0.00 0.00 175.52 175.64 2oex h ILE 520 N 0.19 0.73 0.28 3.11 2.04 -1.25 -2.99 117.51 119.63 2oex h ILE 520 Ca 0.02 -1.15 0.00 0.00 1.00 0.00 0.00 64.86 64.73 2oex h ILE 520 Cb 0.77 1.73 -0.02 0.00 -0.74 0.00 0.00 36.82 38.56 2oex h ILE 520 CO 0.06 0.26 -0.30 0.58 0.00 0.00 0.00 178.15 178.75 2oex h VAL 521 N 0.00 0.36 -0.06 1.67 2.07 -0.26 -3.19 116.25 116.84 2oex h VAL 521 Ca -0.00 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.55 2oex h VAL 521 Cb 0.71 0.36 -0.04 0.00 -1.52 0.00 0.00 31.29 30.80 2oex h VAL 521 CO 0.04 0.00 -0.15 -0.07 0.02 0.00 0.00 177.57 177.41 2oex h LEU 522 N -0.62 -0.44 -1.57 2.57 3.38 -1.58 -2.29 115.31 114.75 2oex h LEU 522 Ca -0.01 0.07 0.26 0.00 0.09 0.00 0.00 57.88 58.29 2oex h LEU 522 Cb 0.58 0.20 -0.04 0.00 0.09 0.00 0.00 40.66 41.49 2oex h LEU 522 CO -0.08 -0.20 0.90 -0.07 0.09 0.00 0.00 178.44 179.09 2oex h LEU 523 N -0.22 0.00 -0.18 1.67 3.38 -1.57 0.55 115.31 118.95 2oex h LEU 523 Ca 0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.04 2oex h LEU 523 Cb 0.31 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.06 2oex h LEU 523 CO -0.18 0.00 -0.31 0.00 0.09 0.00 0.00 178.44 178.03 2oex s LYS 525 N -2.77 3.43 0.94 0.00 1.02 0.19 -4.86 119.74 117.69 2oex s LYS 525 Ca 0.18 1.00 -0.11 0.00 0.02 0.00 0.00 55.97 57.06 2oex s LYS 525 Cb 0.19 -2.06 0.16 0.00 -0.52 0.00 0.00 37.83 35.60 2oex s LYS 525 CO 0.59 -0.71 1.12 -1.25 -0.92 0.00 0.00 175.35 174.18 2oex s PRO 526 N -4.52 0.81 0.12 -1.68 0.04 -1.26 -4.63 135.00 123.87 2oex s PRO 526 Ca 0.59 1.34 -0.32 0.00 0.04 0.00 0.00 61.00 62.66 2oex s PRO 526 Cb -0.13 -1.72 -0.11 0.00 0.04 0.00 0.00 34.50 32.58 2oex s PRO 526 CO 0.43 -2.71 1.52 1.49 0.04 0.00 0.00 177.00 177.78 2oex h GLU 527 N -1.92 -0.45 -0.56 4.56 4.81 -1.97 -0.61 114.58 118.45 2oex h GLU 527 Ca -0.47 0.03 0.11 0.00 -0.13 0.00 0.00 59.36 58.90 2oex h GLU 527 Cb 1.28 0.10 -0.11 0.00 0.63 0.00 0.00 28.75 30.65 2oex h GLU 527 CO 0.45 -0.30 -0.24 -1.35 -0.73 0.00 0.00 179.01 176.84 2oex h PRO 528 N -0.47 -0.10 0.00 0.92 0.11 -2.00 -1.52 132.00 128.94 2oex h PRO 528 Ca 0.05 0.01 -0.05 0.00 0.11 0.00 0.00 66.00 66.12 2oex h PRO 528 Cb 0.61 0.02 -0.01 0.00 0.11 0.00 0.00 31.00 31.73 2oex h PRO 528 CO -0.49 -0.06 -0.22 0.93 -0.21 0.00 0.00 178.00 177.95 2oex h GLU 529 N -0.10 0.00 -0.23 1.05 5.08 -1.82 -2.89 114.58 115.67 2oex h GLU 529 Ca 0.25 0.00 -0.18 0.00 -1.00 0.00 0.00 59.36 58.43 2oex h GLU 529 Cb 0.50 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.75 2oex h GLU 529 CO -0.63 0.22 -0.59 1.25 -1.00 0.00 0.00 179.01 178.26 2oex h LEU 530 N 0.00 0.84 -0.74 1.33 5.85 -0.39 -3.29 115.31 118.91 2oex h LEU 530 Ca -0.00 -0.47 -0.13 0.00 0.84 0.00 0.00 57.88 58.12 2oex h LEU 530 Cb 0.85 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.62 2oex h LEU 530 CO 0.03 1.24 -0.42 -1.13 -0.34 0.00 0.00 178.44 177.82 2oex h ASN 531 N 0.56 0.49 0.00 1.25 -0.00 -1.10 -2.90 115.58 113.87 2oex h ASN 531 Ca 0.00 -0.22 0.00 0.00 -0.00 0.00 0.00 56.30 56.08 2oex h ASN 531 Cb 1.18 -0.14 0.00 0.00 -0.00 0.00 0.00 38.32 39.37 2oex h ASN 531 CO 0.12 0.85 0.00 0.00 -0.00 0.00 0.00 177.43 178.40 2oex n ALA 532 N -2.49 2.39 0.09 1.57 0.00 -1.13 -1.45 120.51 119.49 2oex n ALA 532 Ca -0.02 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.43 2oex n ALA 532 Cb 0.51 -1.00 -0.01 0.00 0.00 0.00 0.00 19.45 18.95 2oex n ALA 532 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2oex n ALA 533 N -0.31 2.26 -3.02 0.00 0.00 -1.10 -4.92 120.51 113.43 2oex n ALA 533 Ca 0.00 -0.06 -0.43 0.00 0.00 0.00 0.00 53.44 52.95 2oex n ALA 533 Cb 0.08 -0.08 -0.09 0.00 0.00 0.00 0.00 19.45 19.36 2oex n ALA 533 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2oex s ILE 534 N -1.33 4.81 1.11 0.00 1.01 -0.53 -5.05 121.20 121.22 2oex s ILE 534 Ca 0.01 -1.17 -0.12 0.00 0.00 0.00 0.00 60.65 59.36 2oex s ILE 534 Cb 0.02 -3.88 0.24 0.00 0.01 0.00 0.00 42.46 38.85 2oex s ILE 534 CO 0.09 -0.53 1.00 -0.81 0.00 0.00 0.00 174.94 174.70 2oex n PRO 535 N 5.08 -1.90 -3.48 2.79 -0.04 -1.26 -4.96 135.00 131.23 2oex n PRO 535 Ca -0.11 -0.52 -0.22 0.00 -0.04 0.00 0.00 63.50 62.61 2oex n PRO 535 Cb 0.44 -2.20 -0.01 0.00 -0.04 0.00 0.00 33.50 31.69 2oex n PRO 535 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 2oex s SER 536 N -2.43 6.14 0.05 3.54 0.01 -1.26 -4.71 113.70 115.03 2oex s SER 536 Ca 0.68 0.17 0.00 0.00 1.31 0.00 0.00 55.95 58.11 2oex s SER 536 Cb -0.24 -1.71 0.00 0.00 0.21 0.00 0.00 66.02 64.28 2oex s SER 536 CO 0.63 -0.35 0.00 0.00 0.41 0.00 0.00 173.24 173.94 2oex n ALA 537 N -1.71 3.00 0.00 1.44 0.00 -1.06 -4.71 120.51 117.47 2oex n ALA 537 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.40 2oex n ALA 537 Cb 0.57 0.03 0.00 0.00 0.00 0.00 0.00 19.45 20.05 2oex n ALA 537 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2oex n ASN 538 N -2.70 0.00 -4.69 0.00 3.02 -1.26 -4.74 115.26 104.89 2oex n ASN 538 Ca 0.00 0.00 -0.39 0.00 -0.03 0.00 0.00 54.58 54.16 2oex n ASN 538 Cb 0.02 0.00 0.04 0.00 -0.61 0.00 0.00 39.78 39.23 2oex n ASN 538 CO 0.00 0.00 0.00 -2.65 -2.62 0.00 0.00 177.26 171.99 2oex n PRO 539 N -0.84 1.42 -3.40 3.52 -0.02 -1.26 -3.69 135.00 130.73 2oex n PRO 539 Ca 0.00 0.53 -0.44 0.00 -2.02 0.00 0.00 63.50 61.56 2oex n PRO 539 Cb 0.00 -2.40 -0.03 0.00 -0.02 0.00 0.00 33.50 31.06 2oex n PRO 539 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2oex s ALA 540 N -1.35 4.21 0.21 3.55 0.00 0.52 -4.90 121.76 124.00 2oex s ALA 540 Ca 0.72 -3.49 0.00 0.00 0.00 0.00 0.00 51.96 49.19 2oex s ALA 540 Cb -0.44 -3.38 0.18 0.00 0.00 0.00 0.00 23.12 19.48 2oex s ALA 540 CO 0.49 -2.23 1.53 0.87 0.00 0.00 0.00 175.76 176.42 2oex h LYS 541 N 7.27 0.40 -2.25 0.00 1.57 -1.93 -3.41 116.57 118.22 2oex h LYS 541 Ca 0.12 -0.27 -0.64 0.00 -1.87 0.00 0.00 60.65 57.99 2oex h LYS 541 Cb 0.97 0.04 -0.38 0.00 0.08 0.00 0.00 32.23 32.93 2oex h LYS 541 CO 0.82 0.87 -0.22 0.25 -0.57 0.00 0.00 179.45 180.60 2oex n THR 542 N -3.92 3.79 0.00 -0.16 -2.24 -1.26 -5.10 114.28 105.40 2oex n THR 542 Ca -0.03 -5.64 0.00 0.00 -2.27 0.00 0.00 64.05 56.11 2oex n THR 542 Cb 0.61 -1.43 0.00 0.00 -2.10 0.00 0.00 70.33 67.41 2oex n THR 542 CO 0.00 0.00 0.00 1.67 -0.57 0.00 0.00 175.07 176.17 2oex n GLN 544 N -0.22 0.00 0.00 -0.78 7.27 -1.26 -4.56 117.38 117.83 2oex n GLN 544 Ca 0.35 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.42 2oex n GLN 544 Cb 0.37 0.00 0.00 0.00 2.41 0.00 0.00 30.24 33.02 2oex n GLN 544 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2oex n GLY 545 N 0.63 0.95 3.73 1.69 0.00 -1.26 -5.11 105.19 105.82 2oex n GLY 545 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 2oex n GLY 545 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2oex s SER 546 N -1.50 4.21 0.22 1.61 1.04 -1.26 -4.84 113.70 113.17 2oex s SER 546 Ca 0.00 2.14 -0.02 0.00 0.48 0.00 0.00 55.95 58.55 2oex s SER 546 Cb 0.00 -2.56 0.21 0.00 0.10 0.00 0.00 66.02 63.77 2oex s SER 546 CO 0.00 -2.24 1.60 -0.33 0.98 0.00 0.00 173.24 173.25 2oex h GLU 547 N -0.70 0.61 0.33 4.02 4.39 -1.99 -0.69 114.58 120.55 2oex h GLU 547 Ca -0.46 -0.29 -0.00 0.00 0.34 0.00 0.00 59.36 58.95 2oex h GLU 547 Cb 1.27 -0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.89 2oex h GLU 547 CO 0.49 0.88 -0.35 0.28 -1.16 0.00 0.00 179.01 179.15 2oex h VAL 548 N 0.51 0.28 -0.90 3.13 2.07 -1.98 -0.79 116.25 118.57 2oex h VAL 548 Ca 0.05 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.68 2oex h VAL 548 Cb 0.87 0.28 -0.08 0.00 -1.52 0.00 0.00 31.29 30.83 2oex h VAL 548 CO 0.07 0.00 0.53 0.58 0.02 0.00 0.00 177.57 178.77 2oex h VAL 549 N -0.72 0.89 0.32 2.57 2.07 -1.92 -1.54 116.25 117.92 2oex h VAL 549 Ca -0.02 -0.29 0.00 0.00 0.82 0.00 0.00 66.70 67.21 2oex h VAL 549 Cb 0.65 -0.03 -0.03 0.00 -1.52 0.00 0.00 31.29 30.36 2oex h VAL 549 CO -0.07 0.15 -0.46 0.78 0.02 0.00 0.00 177.57 177.99 2oex h ASN 550 N 0.85 -1.31 -0.45 0.57 2.35 -0.53 0.67 115.58 117.74 2oex h ASN 550 Ca 0.45 0.12 0.09 0.00 -0.55 0.00 0.00 56.30 56.41 2oex h ASN 550 Cb 0.46 0.46 -0.08 0.00 0.05 0.00 0.00 38.32 39.21 2oex h ASN 550 CO -0.27 -0.58 -0.03 0.58 -1.65 0.00 0.00 177.43 175.48 2oex h VAL 551 N -0.83 0.63 -0.49 2.81 2.07 -0.83 -1.64 116.25 117.97 2oex h VAL 551 Ca -0.02 -0.03 0.04 0.00 0.82 0.00 0.00 66.70 67.51 2oex h VAL 551 Cb 0.77 0.54 -0.04 0.00 -1.52 0.00 0.00 31.29 31.04 2oex h VAL 551 CO -0.14 0.02 0.24 0.25 0.02 0.00 0.00 177.57 177.95 2oex h LEU 552 N 0.08 0.34 -1.46 2.57 5.85 -1.07 -0.77 115.31 120.85 2oex h LEU 552 Ca 0.22 0.03 -0.02 0.00 0.84 0.00 0.00 57.88 58.95 2oex h LEU 552 Cb 0.33 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.31 2oex h LEU 552 CO -0.39 0.24 0.17 0.50 -0.34 0.00 0.00 178.44 178.61 2oex h LYS 553 N 0.47 0.53 -0.17 1.25 3.64 -0.01 -0.28 116.57 122.00 2oex h LYS 553 Ca 0.22 -0.06 -0.11 0.00 -1.27 0.00 0.00 60.65 59.43 2oex h LYS 553 Cb 0.13 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 31.85 2oex h LYS 553 CO -0.16 0.43 -0.32 1.03 -2.27 0.00 0.00 179.45 178.16 2oex h SER 554 N 0.53 0.57 -0.33 4.20 0.87 -0.81 -2.15 113.55 116.43 2oex h SER 554 Ca 0.13 -0.55 0.06 0.00 -1.23 0.00 0.00 61.79 60.20 2oex h SER 554 Cb 0.08 -0.16 -0.05 0.00 -0.44 0.00 0.00 62.40 61.83 2oex h SER 554 CO -0.02 1.02 0.01 -0.07 -0.53 0.00 0.00 176.83 177.24 2oex h LEU 555 N 0.15 -0.11 -1.19 2.23 4.07 -0.54 -0.25 115.31 119.67 2oex h LEU 555 Ca 0.01 0.07 -0.06 0.00 0.08 0.00 0.00 57.88 57.98 2oex h LEU 555 Cb 0.92 0.12 -0.02 0.00 1.08 0.00 0.00 40.66 42.77 2oex h LEU 555 CO 0.07 -0.02 -0.07 -0.07 -1.08 0.00 0.00 178.44 177.27 2oex h LEU 556 N 0.11 0.44 -0.21 1.67 3.38 -1.09 -1.08 115.31 118.53 2oex h LEU 556 Ca 0.16 -0.10 -0.04 0.00 0.09 0.00 0.00 57.88 57.99 2oex h LEU 556 Cb 0.21 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 2oex h LEU 556 CO -0.26 0.57 -0.04 -1.28 0.09 0.00 0.00 178.44 177.52 2oex h SER 557 N 0.44 0.40 0.05 -0.43 0.87 -0.80 -0.65 113.55 113.43 2oex h SER 557 Ca 0.09 -0.36 0.01 0.00 -1.23 0.00 0.00 61.79 60.30 2oex h SER 557 Cb 0.41 -0.11 -0.05 0.00 -0.44 0.00 0.00 62.40 62.21 2oex h SER 557 CO 0.02 0.67 -0.48 0.78 -0.53 0.00 0.00 176.83 177.29 2oex h ASN 558 N 0.13 -1.46 -0.35 6.23 2.35 -0.91 -2.30 115.58 119.26 2oex h ASN 558 Ca 0.05 0.16 0.10 0.00 -0.55 0.00 0.00 56.30 56.06 2oex h ASN 558 Cb 0.49 0.55 -0.01 0.00 0.05 0.00 0.00 38.32 39.39 2oex h ASN 558 CO 0.02 -0.49 0.36 0.25 -1.65 0.00 0.00 177.43 175.92 2oex h LEU 559 N -0.64 0.00 -0.53 1.61 5.85 -1.10 0.46 115.31 120.96 2oex h LEU 559 Ca 0.00 0.00 -0.15 0.00 0.84 0.00 0.00 57.88 58.57 2oex h LEU 559 Cb 0.67 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.69 2oex h LEU 559 CO -0.29 0.00 -0.49 -0.78 -0.34 0.00 0.00 178.44 176.53 2oex h ASP 560 N 0.00 0.67 0.33 1.25 1.82 -0.71 -2.93 116.42 116.85 2oex h ASP 560 Ca 0.17 -0.34 -0.13 0.00 -0.39 0.00 0.00 57.03 56.34 2oex h ASP 560 Cb 0.89 -0.19 -0.01 0.00 0.68 0.00 0.00 39.33 40.69 2oex h ASP 560 CO -0.00 1.05 -0.52 -0.33 -1.61 0.00 0.00 179.24 177.83 2oex h GLU 561 N 0.49 0.21 0.33 0.28 4.39 0.45 -2.73 114.58 118.00 2oex h GLU 561 Ca 0.02 -0.12 -0.02 0.00 0.34 0.00 0.00 59.36 59.58 2oex h GLU 561 Cb 1.04 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.70 2oex h GLU 561 CO 0.10 0.68 -0.16 0.28 -1.16 0.00 0.00 179.01 178.75 2oex h VAL 562 N 0.17 0.64 0.00 3.13 2.07 -1.39 -0.94 116.25 119.92 2oex h VAL 562 Ca 0.00 -0.60 -0.02 0.00 0.82 0.00 0.00 66.70 66.91 2oex h VAL 562 Cb 0.98 0.93 -0.00 0.00 -1.52 0.00 0.00 31.29 31.67 2oex h VAL 562 CO 0.08 0.11 -0.08 0.07 0.02 0.00 0.00 177.57 177.76 2oex h LYS 563 N -0.80 0.00 -0.04 1.57 2.10 -1.61 -2.39 116.57 115.40 2oex h LYS 563 Ca -0.05 0.00 -0.02 0.00 -2.00 0.00 0.00 60.65 58.59 2oex h LYS 563 Cb 0.52 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.85 2oex h LYS 563 CO 0.07 0.08 -0.04 -0.22 -2.00 0.00 0.00 179.45 177.35 2oex h LYS 564 N 0.00 0.10 0.00 0.07 3.11 -1.45 -3.23 116.57 115.17 2oex h LYS 564 Ca -0.00 -0.05 0.00 0.00 -2.81 0.00 0.00 60.65 57.79 2oex h LYS 564 Cb 0.60 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.83 2oex h LYS 564 CO 0.01 0.55 0.00 1.05 -2.81 0.00 0.00 179.45 178.25 2oex h GLU 565 N -0.35 0.00 -0.59 1.90 4.11 -0.68 -2.65 114.58 116.33 2oex h GLU 565 Ca 0.01 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.42 2oex h GLU 565 Cb 0.53 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.75 2oex h GLU 565 CO 0.01 0.00 0.32 0.00 0.07 0.00 0.00 179.01 179.41 2oex h ARG 566 N 0.00 0.83 -0.90 1.06 3.08 -1.48 -2.34 114.38 114.62 2oex h ARG 566 Ca 0.00 -0.10 0.14 0.00 0.07 0.00 0.00 59.98 60.09 2oex h ARG 566 Cb 0.36 -0.16 -0.07 0.00 0.08 0.00 0.00 29.97 30.18 2oex h ARG 566 CO 0.00 0.63 0.58 0.93 -1.07 0.00 0.00 179.97 181.04 2oex h GLU 567 N 0.80 0.68 0.00 0.04 5.08 -1.60 0.34 114.58 119.93 2oex h GLU 567 Ca 0.21 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.53 2oex h GLU 567 Cb 0.05 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.15 2oex h GLU 567 CO -0.03 0.45 0.00 0.41 -1.00 0.00 0.00 179.01 178.84 2oex n GLY 568 N -1.43 -1.25 0.12 -3.84 0.00 -0.90 -2.30 105.19 95.59 2oex n GLY 568 Ca 0.18 0.08 -0.16 0.00 0.00 0.00 0.00 46.02 46.11 2oex n GLY 568 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2oex n LEU 569 N -2.18 2.65 -0.12 0.99 4.77 0.87 -3.26 117.00 120.73 2oex n LEU 569 Ca 0.02 -0.12 -0.05 0.00 -0.03 0.00 0.00 56.01 55.84 2oex n LEU 569 Cb 0.22 -0.70 0.02 0.00 -2.33 0.00 0.00 43.42 40.63 2oex n LEU 569 CO 0.19 0.86 0.82 -0.08 -1.33 0.00 0.00 177.39 177.85 2oex h GLU 570 N 0.00 0.05 -0.16 3.23 4.81 -0.63 0.28 114.58 122.15 2oex h GLU 570 Ca -0.54 -0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 58.68 2oex h GLU 570 Cb 1.87 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 31.23 2oex h GLU 570 CO -0.07 0.03 0.06 -0.91 -0.73 0.00 0.00 179.01 177.39 2oex h ASN 571 N 0.05 0.22 -0.75 1.04 4.21 -1.66 -1.03 115.58 117.66 2oex h ASN 571 Ca 0.20 -0.17 0.00 0.00 1.21 0.00 0.00 56.30 57.54 2oex h ASN 571 Cb 0.29 -0.06 -0.04 0.00 -1.12 0.00 0.00 38.32 37.40 2oex h ASN 571 CO -0.38 0.33 0.48 0.44 -1.29 0.00 0.00 177.43 177.02 2oex h ASP 572 N 0.10 0.88 0.14 5.81 3.45 -1.46 0.64 116.42 125.97 2oex h ASP 572 Ca 0.05 -0.03 -0.01 0.00 0.43 0.00 0.00 57.03 57.47 2oex h ASP 572 Cb 0.18 -0.22 0.00 0.00 -0.56 0.00 0.00 39.33 38.73 2oex h ASP 572 CO -0.00 0.65 -0.07 0.25 -1.57 0.00 0.00 179.24 178.50 2oex h LEU 573 N 1.03 -0.15 0.22 1.55 5.85 -0.36 -3.23 115.31 120.22 2oex h LEU 573 Ca 0.28 -0.24 -0.01 0.00 0.84 0.00 0.00 57.88 58.74 2oex h LEU 573 Cb -0.09 0.04 0.00 0.00 0.37 0.00 0.00 40.66 40.98 2oex h LEU 573 CO -0.06 0.17 -0.11 0.11 -0.34 0.00 0.00 178.44 178.21 2oex h LYS 574 N -0.49 -0.29 -1.17 1.25 1.57 -0.84 -3.26 116.57 113.34 2oex h LYS 574 Ca -0.02 0.02 -0.38 0.00 -1.87 0.00 0.00 60.65 58.40 2oex h LYS 574 Cb 0.39 0.07 -0.19 0.00 0.08 0.00 0.00 32.23 32.57 2oex h LYS 574 CO 0.03 -0.10 0.49 -1.13 -0.57 0.00 0.00 179.45 178.17 2oex n SER 575 N -5.17 5.10 -4.67 0.86 3.41 0.19 -4.84 113.62 108.49 2oex n SER 575 Ca -0.09 -3.15 -0.43 0.00 -0.26 0.00 0.00 58.87 54.94 2oex n SER 575 Cb 0.18 -0.87 -0.02 0.00 -0.26 0.00 0.00 64.21 63.24 2oex n SER 575 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2oex s VAL 576 N -2.57 4.59 -0.53 -3.33 1.01 -1.22 -4.97 120.40 113.40 2oex s VAL 576 Ca 0.39 1.90 0.06 0.00 0.00 0.00 0.00 61.98 64.33 2oex s VAL 576 Cb 0.31 -4.22 0.36 0.00 0.00 0.00 0.00 36.38 32.83 2oex s VAL 576 CO 0.03 -0.08 0.96 -3.20 0.00 0.00 0.00 175.10 172.81 2oex n ASN 577 N 5.74 4.12 -4.83 3.32 5.15 -1.26 -5.04 115.26 122.46 2oex n ASN 577 Ca 0.11 -3.61 -0.37 0.00 -0.60 0.00 0.00 54.58 50.11 2oex n ASN 577 Cb 0.47 -0.55 -0.06 0.00 -0.53 0.00 0.00 39.78 39.11 2oex n ASN 577 CO 0.00 0.00 0.00 0.12 1.40 0.00 0.00 177.26 178.78 2oex s PHE 578 N -3.38 3.59 0.09 1.20 5.36 -1.26 -5.22 117.98 118.35 2oex s PHE 578 Ca 0.47 0.64 -0.22 0.00 -0.96 0.00 0.00 56.93 56.85 2oex s PHE 578 Cb 0.31 -2.11 -0.07 0.00 -0.34 0.00 0.00 43.02 40.82 2oex s PHE 578 CO -0.14 0.59 0.68 0.34 -1.46 0.00 0.00 175.22 175.23 2oex s ASP 579 N -0.67 7.18 0.00 6.13 3.68 -1.26 -5.05 116.67 126.69 2oex s ASP 579 Ca 0.17 1.41 0.00 0.00 2.13 0.00 0.00 52.55 56.25 2oex s ASP 579 Cb -0.13 -2.43 0.00 0.00 -1.45 0.00 0.00 42.92 38.91 2oex s ASP 579 CO 0.06 0.18 0.00 0.35 0.13 0.00 0.00 175.17 175.89 2oex n THR 581 N 2.03 0.00 0.21 1.71 -2.24 -1.26 -3.77 114.28 110.96 2oex n THR 581 Ca -0.07 0.00 -0.15 0.00 -2.27 0.00 0.00 64.05 61.56 2oex n THR 581 Cb 0.50 0.00 -0.08 0.00 -2.10 0.00 0.00 70.33 68.65 2oex n THR 581 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 2oex h SER 582 N 0.00 -0.41 -0.82 3.42 0.02 -1.98 0.55 113.55 114.33 2oex h SER 582 Ca 0.00 -0.01 0.20 0.00 -0.84 0.00 0.00 61.79 61.14 2oex h SER 582 Cb 0.00 0.11 -0.13 0.00 0.14 0.00 0.00 62.40 62.51 2oex h SER 582 CO 0.00 -0.26 0.14 0.50 -1.14 0.00 0.00 176.83 176.07 2oex h LYS 583 N -0.52 0.17 0.03 3.45 3.64 -2.00 -0.11 116.57 121.23 2oex h LYS 583 Ca -0.05 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.32 2oex h LYS 583 Cb 0.39 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.17 2oex h LYS 583 CO 0.08 0.11 -0.01 0.35 -2.27 0.00 0.00 179.45 177.71 2oex h PHE 584 N 0.18 -0.04 0.00 1.91 3.57 -1.79 -2.36 116.94 118.41 2oex h PHE 584 Ca 0.48 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.96 2oex h PHE 584 Cb 0.91 0.01 -0.00 0.00 2.79 0.00 0.00 35.95 39.66 2oex h PHE 584 CO -0.33 0.17 -0.11 -0.07 -2.23 0.00 0.00 178.31 175.73 2oex h LEU 585 N -0.24 0.00 -0.27 0.59 3.38 -0.11 -0.26 115.31 118.40 2oex h LEU 585 Ca -0.00 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.87 2oex h LEU 585 Cb 0.22 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 2oex h LEU 585 CO 0.01 0.11 -0.20 0.74 0.09 0.00 0.00 178.44 179.19 2oex h THR 586 N 0.00 1.30 -0.64 0.22 2.02 -0.93 -1.26 112.91 113.63 2oex h THR 586 Ca -0.00 -1.34 -0.01 0.00 0.77 0.00 0.00 66.41 65.82 2oex h THR 586 Cb 0.27 1.57 -0.03 0.00 -1.74 0.00 0.00 68.15 68.22 2oex h THR 586 CO 0.01 0.42 0.34 0.00 0.37 0.00 0.00 175.52 176.67 2oex h ALA 587 N 0.71 1.39 0.00 6.16 0.00 -0.60 0.14 119.26 127.06 2oex h ALA 587 Ca 0.05 -0.11 -0.10 0.00 0.00 0.00 0.00 54.91 54.75 2oex h ALA 587 Cb 0.75 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 2oex h ALA 587 CO 0.05 0.49 -0.49 1.25 0.00 0.00 0.00 179.25 180.56 2oex h LEU 588 N 0.89 0.00 0.41 0.00 5.85 -1.04 -1.77 115.31 119.66 2oex h LEU 588 Ca 0.23 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.93 2oex h LEU 588 Cb 0.04 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.08 2oex h LEU 588 CO -0.04 0.49 -0.20 0.00 -0.34 0.00 0.00 178.44 178.35 2oex h ALA 589 N 1.51 -0.55 0.04 1.25 0.00 -0.39 -3.39 119.26 117.74 2oex h ALA 589 Ca -0.00 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.72 2oex h ALA 589 Cb 1.10 0.21 -0.02 0.00 0.00 0.00 0.00 17.79 19.08 2oex h ALA 589 CO 0.06 -0.60 -0.19 0.37 0.00 0.00 0.00 179.25 178.89 2oex h GLN 590 N -0.96 -0.26 -6.51 0.00 4.15 -0.63 -3.44 115.11 107.46 2oex h GLN 590 Ca -0.06 0.02 -0.45 0.00 0.77 0.00 0.00 58.65 58.93 2oex h GLN 590 Cb 0.55 0.06 0.02 0.00 0.21 0.00 0.00 27.48 28.32 2oex h GLN 590 CO 0.09 -0.17 -0.22 -0.51 -1.93 0.00 0.00 178.83 176.09 2oex s ASP 591 N -3.22 5.92 0.00 -0.69 1.01 -0.68 -5.10 116.67 113.91 2oex s ASP 591 Ca -0.06 0.07 0.00 0.00 0.71 0.00 0.00 52.55 53.28 2oex s ASP 591 Cb 0.02 -1.42 0.00 0.00 1.01 0.00 0.00 42.92 42.53 2oex s ASP 591 CO 0.21 -0.55 0.00 0.61 0.21 0.00 0.00 175.17 175.65 2oex n GLY 592 N -1.86 1.55 3.66 0.21 0.00 -1.26 -4.56 105.19 102.94 2oex n GLY 592 Ca 0.00 -0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 2oex n GLY 592 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2oex s VAL 593 N 0.00 4.68 0.32 1.61 -7.23 -1.26 -4.88 120.40 113.63 2oex s VAL 593 Ca 0.00 1.95 0.03 0.00 -1.81 0.00 0.00 61.98 62.15 2oex s VAL 593 Cb 0.00 -4.30 -0.05 0.00 0.56 0.00 0.00 36.38 32.59 2oex s VAL 593 CO 0.00 -0.20 0.10 0.27 -0.31 0.00 0.00 175.10 174.96 2oex s ILE 594 N 3.21 0.75 -1.22 -0.62 -5.25 -1.26 -5.08 121.20 111.73 2oex s ILE 594 Ca 0.43 -2.00 -0.18 0.00 -0.99 0.00 0.00 60.65 57.91 2oex s ILE 594 Cb -0.15 -2.61 0.09 0.00 2.95 0.00 0.00 42.46 42.74 2oex s ILE 594 CO 0.07 0.00 1.61 0.21 -1.79 0.00 0.00 174.94 175.04 2oex s ASN 595 N -3.44 6.81 0.20 4.36 3.84 -1.26 -4.83 114.94 120.62 2oex s ASN 595 Ca 0.34 -2.34 -0.11 0.00 0.21 0.00 0.00 52.86 50.96 2oex s ASN 595 Cb 0.07 -2.54 0.13 0.00 -0.55 0.00 0.00 41.25 38.35 2oex s ASN 595 CO 0.15 -1.16 1.81 -0.33 -2.79 0.00 0.00 177.10 174.79 2oex h GLU 596 N 7.95 0.98 -0.01 0.43 5.08 -1.98 -1.42 114.58 125.61 2oex h GLU 596 Ca 0.37 -0.11 -0.00 0.00 -1.00 0.00 0.00 59.36 58.62 2oex h GLU 596 Cb 0.90 -0.19 -0.00 0.00 0.50 0.00 0.00 28.75 29.96 2oex h GLU 596 CO 1.40 0.73 0.00 0.93 -1.00 0.00 0.00 179.01 181.08 2oex h GLU 597 N 0.97 0.01 -0.91 2.33 3.07 -1.99 0.67 114.58 118.72 2oex h GLU 597 Ca 0.25 -0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 59.09 2oex h GLU 597 Cb 0.04 -0.00 -0.04 0.00 -0.84 0.00 0.00 28.75 27.90 2oex h GLU 597 CO -0.04 0.27 0.53 0.00 -1.40 0.00 0.00 179.01 178.37 2oex h ALA 598 N 0.74 1.16 -0.10 3.43 0.00 -1.96 -1.87 119.26 120.66 2oex h ALA 598 Ca 0.00 -0.11 0.01 0.00 0.00 0.00 0.00 54.91 54.81 2oex h ALA 598 Cb 0.26 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 2oex h ALA 598 CO 0.00 0.64 0.03 1.25 0.00 0.00 0.00 179.25 181.17 2oex h LEU 599 N 1.26 0.02 -0.63 0.00 5.85 -1.09 -2.97 115.31 117.76 2oex h LEU 599 Ca 0.32 0.01 0.12 0.00 0.84 0.00 0.00 57.88 59.17 2oex h LEU 599 Cb -0.02 0.01 -0.09 0.00 0.37 0.00 0.00 40.66 40.94 2oex h LEU 599 CO -0.06 0.03 0.17 -1.28 -0.34 0.00 0.00 178.44 176.96 2oex h SER 600 N 0.07 0.07 -0.72 1.25 0.87 -0.33 -1.29 113.55 113.47 2oex h SER 600 Ca 0.04 0.11 0.10 0.00 -1.23 0.00 0.00 61.79 60.82 2oex h SER 600 Cb 0.03 0.13 -0.08 0.00 -0.44 0.00 0.00 62.40 62.05 2oex h SER 600 CO -0.05 0.04 0.35 0.58 -0.53 0.00 0.00 176.83 177.21 2oex h VAL 601 N 0.31 0.81 0.22 2.23 2.07 -1.24 -1.42 116.25 119.23 2oex h VAL 601 Ca 0.33 -0.20 -0.01 0.00 0.82 0.00 0.00 66.70 67.65 2oex h VAL 601 Cb 0.49 0.19 0.00 0.00 -1.52 0.00 0.00 31.29 30.45 2oex h VAL 601 CO -0.39 0.10 -0.11 0.74 0.02 0.00 0.00 177.57 177.93 2oex h THR 602 N 0.57 0.82 0.00 2.57 2.02 -1.14 -2.77 112.91 114.98 2oex h THR 602 Ca 0.37 -0.83 -0.04 0.00 0.77 0.00 0.00 66.41 66.68 2oex h THR 602 Cb 0.43 1.26 -0.01 0.00 -1.74 0.00 0.00 68.15 68.09 2oex h THR 602 CO -0.30 0.17 -0.19 -0.08 0.37 0.00 0.00 175.52 175.49 2oex h GLU 603 N -0.76 0.00 0.03 6.66 4.57 -1.11 -1.80 114.58 122.18 2oex h GLU 603 Ca -0.03 0.00 -0.22 0.00 -1.18 0.00 0.00 59.36 57.93 2oex h GLU 603 Cb 0.50 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.08 2oex h GLU 603 CO 0.05 0.19 -1.01 -0.07 -1.18 0.00 0.00 179.01 176.99 2oex h LEU 604 N 0.00 0.19 -1.05 1.64 3.38 -1.31 -2.68 115.31 115.48 2oex h LEU 604 Ca -0.00 -0.18 -0.10 0.00 0.09 0.00 0.00 57.88 57.68 2oex h LEU 604 Cb 0.37 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 2oex h LEU 604 CO 0.02 1.08 -0.46 -0.78 0.09 0.00 0.00 178.44 178.39 2oex h ASP 605 N 0.05 0.03 -0.13 -0.43 3.58 -1.06 0.29 116.42 118.75 2oex h ASP 605 Ca -0.05 -0.01 -0.08 0.00 0.42 0.00 0.00 57.03 57.31 2oex h ASP 605 Cb 1.71 -0.01 -0.00 0.00 1.72 0.00 0.00 39.33 42.75 2oex h ASP 605 CO 0.15 0.49 -0.22 -0.09 -2.88 0.00 0.00 179.24 176.68 2oex h ARG 606 N 0.02 0.38 0.00 0.28 2.43 -1.32 -2.13 114.38 114.05 2oex h ARG 606 Ca -0.00 -0.24 -0.00 0.00 -0.81 0.00 0.00 59.98 58.93 2oex h ARG 606 Cb 0.83 0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 30.40 2oex h ARG 606 CO 0.06 0.83 -0.07 0.28 -1.51 0.00 0.00 179.97 179.56 2oex h VAL 607 N -0.02 0.24 -0.01 0.20 2.07 -1.35 -3.40 116.25 113.98 2oex h VAL 607 Ca 0.01 -1.19 0.00 0.00 0.82 0.00 0.00 66.70 66.34 2oex h VAL 607 Cb 0.80 0.47 0.00 0.00 -1.52 0.00 0.00 31.29 31.04 2oex h VAL 607 CO 0.05 0.08 -0.41 -1.22 0.02 0.00 0.00 177.57 176.09 2oex n TYR 608 N -4.74 0.00 -0.21 1.57 4.02 1.00 -4.43 117.16 114.37 2oex n TYR 608 Ca -0.02 0.00 -0.01 0.00 -0.01 0.00 0.00 57.90 57.85 2oex n TYR 608 Cb 0.10 -0.09 0.10 0.00 -0.02 0.00 0.00 39.34 39.43 2oex n TYR 608 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 176.86 176.63 2oex h GLY 609 N 4.91 0.89 2.00 2.72 0.00 -1.19 -1.14 103.07 111.26 2oex h GLY 609 Ca 0.00 -0.19 -0.01 0.00 0.00 0.00 0.00 47.33 47.13 2oex h GLY 609 CO 0.00 0.08 -0.04 -1.33 0.00 0.00 0.00 176.54 175.24 2oex h GLY 610 N 0.54 0.00 0.38 4.60 0.00 -1.77 -2.67 103.07 104.15 2oex h GLY 610 Ca 0.29 0.00 -0.35 0.00 0.00 0.00 0.00 47.33 47.27 2oex h GLY 610 CO -0.23 0.00 -2.15 1.04 0.00 0.00 0.00 176.54 175.20 2oex n LEU 611 N -3.39 1.47 0.20 3.11 4.77 -0.51 -3.27 117.00 119.39 2oex n LEU 611 Ca -0.02 0.12 0.04 0.00 -0.03 0.00 0.00 56.01 56.12 2oex n LEU 611 Cb 0.17 -0.25 0.42 0.00 -2.33 0.00 0.00 43.42 41.44 2oex n LEU 611 CO 0.26 0.65 0.81 0.74 -1.33 0.00 0.00 177.39 178.51 2oex h THR 612 N 0.02 1.20 0.49 -5.08 2.02 -1.21 -0.33 112.91 110.03 2oex h THR 612 Ca -0.46 -0.97 -0.02 0.00 0.77 0.00 0.00 66.41 65.73 2oex h THR 612 Cb 2.06 1.52 0.00 0.00 -1.74 0.00 0.00 68.15 70.00 2oex h THR 612 CO 0.03 0.28 -0.24 0.74 0.37 0.00 0.00 175.52 176.70 2oex h THR 613 N 0.00 0.44 -1.00 3.16 2.02 -1.59 -2.01 112.91 113.94 2oex h THR 613 Ca -0.00 -0.35 0.09 0.00 0.77 0.00 0.00 66.41 66.91 2oex h THR 613 Cb 0.50 0.58 -0.07 0.00 -1.74 0.00 0.00 68.15 67.41 2oex h THR 613 CO 0.04 0.05 0.64 0.11 0.37 0.00 0.00 175.52 176.72 2oex h LYS 614 N -0.90 1.06 -0.51 6.66 1.57 -1.47 -1.48 116.57 121.50 2oex h LYS 614 Ca -0.07 -0.06 0.06 0.00 -1.87 0.00 0.00 60.65 58.71 2oex h LYS 614 Cb 0.59 -0.24 -0.05 0.00 0.08 0.00 0.00 32.23 32.61 2oex h LYS 614 CO 0.11 0.70 0.22 0.28 -0.57 0.00 0.00 179.45 180.19 2oex h VAL 615 N 1.09 0.89 -0.20 0.50 2.07 -0.95 0.18 116.25 119.82 2oex h VAL 615 Ca 0.46 -0.15 -0.12 0.00 0.82 0.00 0.00 66.70 67.71 2oex h VAL 615 Cb 0.30 0.42 -0.01 0.00 -1.52 0.00 0.00 31.29 30.48 2oex h VAL 615 CO -0.21 0.08 -0.40 -0.61 0.02 0.00 0.00 177.57 176.45 2oex h GLN 616 N 0.43 0.46 0.00 1.57 5.75 -0.79 -2.15 115.11 120.39 2oex h GLN 616 Ca 0.24 -0.23 -0.05 0.00 -0.15 0.00 0.00 58.65 58.46 2oex h GLN 616 Cb 0.20 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 28.75 2oex h GLN 616 CO -0.20 0.79 -0.22 1.49 -2.65 0.00 0.00 178.83 178.04 2oex h GLU 617 N 0.39 0.00 -0.01 1.69 4.81 -0.63 -1.24 114.58 119.58 2oex h GLU 617 Ca 0.04 0.00 -0.14 0.00 -0.13 0.00 0.00 59.36 59.13 2oex h GLU 617 Cb 0.87 0.00 0.01 0.00 0.63 0.00 0.00 28.75 30.26 2oex h GLU 617 CO 0.07 0.22 -0.54 1.03 -0.73 0.00 0.00 179.01 179.06 2oex h SER 618 N 0.00 0.49 -0.29 1.04 0.87 -0.26 -3.01 113.55 112.39 2oex h SER 618 Ca -0.00 -0.75 -0.13 0.00 -1.23 0.00 0.00 61.79 59.68 2oex h SER 618 Cb 0.55 -0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 62.35 2oex h SER 618 CO 0.03 1.17 -0.27 -0.07 -0.53 0.00 0.00 176.83 177.16 2oex h LEU 619 N -0.14 0.82 -0.37 2.23 3.38 -0.99 -2.22 115.31 118.03 2oex h LEU 619 Ca -0.06 -0.32 -0.07 0.00 0.09 0.00 0.00 57.88 57.52 2oex h LEU 619 Cb 1.25 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.76 2oex h LEU 619 CO 0.11 1.04 -0.04 0.50 0.09 0.00 0.00 178.44 180.14 2oex h LYS 620 N 0.68 0.67 -0.05 1.13 3.11 -1.36 0.74 116.57 121.49 2oex h LYS 620 Ca 0.08 -0.23 0.02 0.00 -2.81 0.00 0.00 60.65 57.71 2oex h LYS 620 Cb 0.80 -0.05 -0.02 0.00 -1.00 0.00 0.00 32.23 31.96 2oex h LYS 620 CO 0.07 0.80 -0.06 -0.22 -2.81 0.00 0.00 179.45 177.22 2oex h LYS 621 N 0.48 -0.09 -0.75 1.90 3.64 -1.44 -1.02 116.57 119.29 2oex h LYS 621 Ca 0.10 0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.46 2oex h LYS 621 Cb 0.52 0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.33 2oex h LYS 621 CO 0.03 -0.06 0.36 0.37 -2.27 0.00 0.00 179.45 177.88 2oex h GLN 622 N -0.09 1.09 -0.28 1.90 4.15 -1.38 -1.39 115.11 119.11 2oex h GLN 622 Ca 0.04 -0.16 0.06 0.00 0.77 0.00 0.00 58.65 59.36 2oex h GLN 622 Cb 0.15 -0.19 -0.08 0.00 0.21 0.00 0.00 27.48 27.57 2oex h GLN 622 CO -0.10 0.85 -0.38 0.93 -1.93 0.00 0.00 178.83 178.20 2oex h GLU 623 N 1.06 -0.35 -0.22 1.69 5.08 -0.03 -1.44 114.58 120.38 2oex h GLU 623 Ca 0.26 0.02 -0.10 0.00 -1.00 0.00 0.00 59.36 58.55 2oex h GLU 623 Cb 0.13 0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.44 2oex h GLU 623 CO -0.03 -0.23 -0.28 0.78 -1.00 0.00 0.00 179.01 178.25 2oex h GLY 624 N -0.36 0.45 0.87 -3.84 0.00 -1.15 -2.76 103.07 96.28 2oex h GLY 624 Ca 0.13 -0.38 -0.10 0.00 0.00 0.00 0.00 47.33 46.98 2oex h GLY 624 CO -0.48 0.35 -0.26 1.41 0.00 0.00 0.00 176.54 177.55 2oex h LEU 625 N 0.37 0.59 -1.27 3.11 3.38 -0.81 -2.14 115.31 118.54 2oex h LEU 625 Ca 0.05 -0.50 0.04 0.00 0.09 0.00 0.00 57.88 57.56 2oex h LEU 625 Cb 0.68 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 41.22 2oex h LEU 625 CO 0.05 0.97 0.51 -0.07 0.09 0.00 0.00 178.44 180.00 2oex h LEU 626 N 0.22 0.81 -0.06 1.67 3.38 -1.31 -0.88 115.31 119.14 2oex h LEU 626 Ca 0.03 -0.01 0.01 0.00 0.09 0.00 0.00 57.88 58.00 2oex h LEU 626 Cb 0.83 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.39 2oex h LEU 626 CO 0.06 0.56 0.00 0.50 0.09 0.00 0.00 178.44 179.65 2oex h LYS 627 N 0.94 0.02 -0.47 1.13 3.64 -1.14 -2.11 116.57 118.59 2oex h LYS 627 Ca 0.31 -0.00 -0.08 0.00 -1.27 0.00 0.00 60.65 59.61 2oex h LYS 627 Cb 0.07 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 31.86 2oex h LYS 627 CO -0.09 0.02 -0.03 -0.91 -2.27 0.00 0.00 179.45 176.16 2oex h ASN 628 N 0.02 0.77 -0.79 4.20 2.35 -1.11 -2.93 115.58 118.09 2oex h ASN 628 Ca 0.03 -0.20 -0.03 0.00 -0.55 0.00 0.00 56.30 55.55 2oex h ASN 628 Cb 0.03 -0.20 -0.04 0.00 0.05 0.00 0.00 38.32 38.16 2oex h ASN 628 CO -0.05 0.85 0.40 0.40 -1.65 0.00 0.00 177.43 177.38 2oex h ILE 629 N 0.73 1.25 -0.01 2.81 2.04 -0.90 0.70 117.51 124.14 2oex h ILE 629 Ca 0.14 -0.67 0.00 0.00 1.00 0.00 0.00 64.86 65.32 2oex h ILE 629 Cb 0.49 0.23 -0.00 0.00 -0.74 0.00 0.00 36.82 36.80 2oex h ILE 629 CO 0.03 0.29 0.00 -0.61 0.00 0.00 0.00 178.15 177.86 2oex h GLN 630 N 1.12 0.01 -0.72 2.37 5.75 -1.29 0.22 115.11 122.57 2oex h GLN 630 Ca 0.27 -0.00 0.16 0.00 -0.15 0.00 0.00 58.65 58.93 2oex h GLN 630 Cb 0.10 -0.00 -0.11 0.00 1.07 0.00 0.00 27.48 28.54 2oex h GLN 630 CO -0.04 0.02 0.16 0.28 -2.65 0.00 0.00 178.83 176.60 2oex h VAL 631 N -0.00 0.52 -0.30 2.39 2.07 -1.23 0.46 116.25 120.15 2oex h VAL 631 Ca 0.00 -0.09 -0.18 0.00 0.82 0.00 0.00 66.70 67.25 2oex h VAL 631 Cb 0.01 0.24 -0.00 0.00 -1.52 0.00 0.00 31.29 30.02 2oex h VAL 631 CO -0.00 0.05 -0.52 0.28 0.02 0.00 0.00 177.57 177.40 2oex h SER 632 N 0.26 0.98 -0.67 0.57 0.02 -0.19 -2.91 113.55 111.61 2oex h SER 632 Ca 0.41 -0.52 -0.01 0.00 -0.84 0.00 0.00 61.79 60.82 2oex h SER 632 Cb 0.69 -0.28 -0.03 0.00 0.14 0.00 0.00 62.40 62.92 2oex h SER 632 CO -0.51 1.31 0.37 -0.74 -1.14 0.00 0.00 176.83 176.12 2oex h HIS 633 N 0.67 0.93 -0.72 3.45 6.17 -0.01 0.79 115.15 126.42 2oex h HIS 633 Ca 0.02 -0.02 0.14 0.00 0.71 0.00 0.00 60.37 61.22 2oex h HIS 633 Cb 1.13 -0.30 -0.10 0.00 2.52 0.00 0.00 27.41 30.66 2oex h HIS 633 CO 0.07 0.66 0.25 1.96 0.71 0.00 0.00 177.93 181.58 2oex h GLN 634 N 0.92 0.36 0.00 5.26 4.20 -0.87 0.28 115.11 125.27 2oex h GLN 634 Ca 0.24 -0.02 -0.08 0.00 0.06 0.00 0.00 58.65 58.85 2oex h GLN 634 Cb 0.04 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 27.73 2oex h GLN 634 CO -0.04 0.24 -0.36 0.93 -0.67 0.00 0.00 178.83 178.93 2oex h GLU 635 N 0.37 0.00 -0.04 1.46 5.08 -1.22 -3.04 114.58 117.20 2oex h GLU 635 Ca 0.40 0.00 -0.22 0.00 -1.00 0.00 0.00 59.36 58.54 2oex h GLU 635 Cb 0.62 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.88 2oex h GLU 635 CO -0.43 0.36 -0.89 0.35 -1.00 0.00 0.00 179.01 177.40 2oex h PHE 636 N 0.00 0.71 0.00 4.33 3.57 0.20 -3.23 116.94 122.52 2oex h PHE 636 Ca -0.00 -0.36 0.00 0.00 3.53 0.00 0.00 57.97 61.14 2oex h PHE 636 Cb 1.09 -0.09 0.00 0.00 2.79 0.00 0.00 35.95 39.74 2oex h PHE 636 CO 0.00 1.17 0.00 0.43 -2.23 0.00 0.00 178.31 177.68 2oex n SER 637 N -3.80 1.84 -0.44 0.41 7.64 0.89 -3.35 113.62 116.81 2oex n SER 637 Ca -0.07 -1.31 0.07 0.00 1.01 0.00 0.00 58.87 58.58 2oex n SER 637 Cb 0.80 -0.33 0.16 0.00 -1.01 0.00 0.00 64.21 63.83 2oex n SER 637 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 2oex n LYS 638 N 0.63 1.26 -0.09 1.43 4.76 -1.22 -5.02 118.16 119.90 2oex n LYS 638 Ca 0.00 -2.78 0.00 0.00 -2.87 0.00 0.00 58.31 52.66 2oex n LYS 638 Cb 0.31 -1.39 0.00 0.00 -1.84 0.00 0.00 35.03 32.11 2oex n LYS 638 CO 0.00 0.00 0.00 0.36 -1.37 0.00 0.00 177.40 176.39 2oex n LYS 640 N -1.07 0.00 -2.62 1.97 2.85 -1.21 -5.04 118.16 113.04 2oex n LYS 640 Ca 0.16 0.00 -0.38 0.00 -1.05 0.00 0.00 58.31 57.03 2oex n LYS 640 Cb 0.70 -0.09 -0.05 0.00 -0.65 0.00 0.00 35.03 34.94 2oex n LYS 640 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 177.40 176.70 2oex s GLN 641 N -0.80 4.52 -0.97 -1.58 1.11 -1.26 -4.96 119.66 115.72 2oex s GLN 641 Ca 0.00 1.54 -0.01 0.00 0.01 0.00 0.00 55.36 56.90 2oex s GLN 641 Cb 0.00 -2.91 0.33 0.00 -1.01 0.00 0.00 33.01 29.42 2oex s GLN 641 CO 0.00 0.17 1.85 0.43 0.01 0.00 0.00 175.29 177.76 2oex n SER 642 N 0.70 7.33 -4.74 5.90 7.64 -1.26 -4.88 113.62 124.31 2oex n SER 642 Ca 0.01 -3.73 -0.34 0.00 1.01 0.00 0.00 58.87 55.83 2oex n SER 642 Cb 0.48 -1.13 -0.08 0.00 -1.01 0.00 0.00 64.21 62.47 2oex n SER 642 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 2oex s ASN 643 N -1.34 5.50 0.20 6.43 -0.87 -1.26 -4.99 114.94 118.60 2oex s ASN 643 Ca 0.42 0.13 -0.11 0.00 -1.57 0.00 0.00 52.86 51.73 2oex s ASN 643 Cb 0.25 -1.55 0.21 0.00 -0.02 0.00 0.00 41.25 40.13 2oex s ASN 643 CO -0.20 0.31 1.78 -1.13 -2.57 0.00 0.00 177.10 175.28 2oex h ASN 644 N 4.44 0.36 -0.04 -1.22 -0.00 -1.99 -1.69 115.58 115.43 2oex h ASN 644 Ca -0.50 0.04 -0.05 0.00 -0.00 0.00 0.00 56.30 55.80 2oex h ASN 644 Cb 1.19 -0.02 -0.01 0.00 -0.00 0.00 0.00 38.32 39.48 2oex h ASN 644 CO 0.59 0.24 -0.09 -0.33 -0.00 0.00 0.00 177.43 177.84 2oex h GLU 645 N 0.51 0.29 0.02 6.67 5.08 -1.93 -1.99 114.58 123.24 2oex h GLU 645 Ca 0.27 -0.06 -0.27 0.00 -1.00 0.00 0.00 59.36 58.30 2oex h GLU 645 Cb 0.23 -0.04 0.02 0.00 0.50 0.00 0.00 28.75 29.45 2oex h GLU 645 CO -0.21 0.39 -1.07 0.00 -1.00 0.00 0.00 179.01 177.12 2oex h ALA 646 N 1.64 0.13 -0.57 3.43 0.00 -1.78 -2.75 119.26 119.36 2oex h ALA 646 Ca 0.06 -0.72 0.03 0.00 0.00 0.00 0.00 54.91 54.28 2oex h ALA 646 Cb 0.34 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.16 2oex h ALA 646 CO 0.02 0.71 0.38 -0.91 0.00 0.00 0.00 179.25 179.44 2oex h ASN 647 N 0.35 0.58 0.91 0.00 -0.26 -0.69 -0.63 115.58 115.85 2oex h ASN 647 Ca -0.14 -0.01 -0.22 0.00 -0.56 0.00 0.00 56.30 55.37 2oex h ASN 647 Cb 1.73 -0.14 -0.03 0.00 -1.06 0.00 0.00 38.32 38.82 2oex h ASN 647 CO 0.21 0.40 -1.11 -0.07 -1.06 0.00 0.00 177.43 175.79 2oex h LEU 648 N 0.68 0.01 0.08 1.61 3.38 -1.38 -1.33 115.31 118.35 2oex h LEU 648 Ca 0.23 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.18 2oex h LEU 648 Cb 0.07 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.82 2oex h LEU 648 CO -0.06 1.01 -0.04 -0.09 0.09 0.00 0.00 178.44 179.35 2oex h ARG 649 N 0.00 -0.10 -0.87 1.13 2.43 -1.24 -3.09 114.38 112.63 2oex h ARG 649 Ca -0.06 0.01 0.18 0.00 -0.81 0.00 0.00 59.98 59.30 2oex h ARG 649 Cb 1.81 0.02 -0.11 0.00 -0.42 0.00 0.00 29.97 31.28 2oex h ARG 649 CO 0.12 0.44 0.43 1.49 -1.51 0.00 0.00 179.97 180.94 2oex h GLU 650 N -0.78 0.53 -0.78 0.20 4.81 -1.19 -0.18 114.58 117.18 2oex h GLU 650 Ca -0.01 -0.03 0.06 0.00 -0.13 0.00 0.00 59.36 59.25 2oex h GLU 650 Cb 0.59 -0.12 -0.06 0.00 0.63 0.00 0.00 28.75 29.79 2oex h GLU 650 CO 0.02 0.35 0.46 1.49 -0.73 0.00 0.00 179.01 180.60 2oex h GLU 651 N 0.54 0.81 -0.08 1.92 4.81 -1.28 0.46 114.58 121.77 2oex h GLU 651 Ca 0.51 -0.05 -0.07 0.00 -0.13 0.00 0.00 59.36 59.61 2oex h GLU 651 Cb 0.82 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 30.02 2oex h GLU 651 CO -0.43 0.54 -0.24 0.28 -0.73 0.00 0.00 179.01 178.43 2oex h VAL 652 N 0.84 1.41 -0.54 0.32 2.07 -1.26 -2.74 116.25 116.35 2oex h VAL 652 Ca 0.35 -1.59 0.11 0.00 0.82 0.00 0.00 66.70 66.38 2oex h VAL 652 Cb 0.20 2.23 -0.10 0.00 -1.52 0.00 0.00 31.29 32.09 2oex h VAL 652 CO -0.18 0.46 -0.16 -0.07 0.02 0.00 0.00 177.57 177.63 2oex h LEU 653 N -0.17 -0.58 0.50 2.57 4.07 -0.63 0.41 115.31 121.47 2oex h LEU 653 Ca -0.01 0.17 -0.01 0.00 0.08 0.00 0.00 57.88 58.11 2oex h LEU 653 Cb 0.86 0.36 -0.02 0.00 1.08 0.00 0.00 40.66 42.94 2oex h LEU 653 CO 0.05 -0.20 -0.44 0.11 -1.08 0.00 0.00 178.44 176.88 2oex h LYS 654 N -0.03 -0.90 -0.68 1.13 1.57 -0.94 -2.07 116.57 114.64 2oex h LYS 654 Ca 0.26 0.06 0.14 0.00 -1.87 0.00 0.00 60.65 59.24 2oex h LYS 654 Cb 0.42 0.20 -0.04 0.00 0.08 0.00 0.00 32.23 32.90 2oex h LYS 654 CO -0.57 -0.60 0.46 -0.91 -0.57 0.00 0.00 179.45 177.26 2oex h ASN 655 N -0.93 0.29 0.14 0.86 2.35 -1.15 0.13 115.58 117.27 2oex h ASN 655 Ca -0.05 0.01 -0.10 0.00 -0.55 0.00 0.00 56.30 55.61 2oex h ASN 655 Cb 0.81 -0.04 -0.01 0.00 0.05 0.00 0.00 38.32 39.12 2oex h ASN 655 CO -0.03 0.16 -0.34 -0.07 -1.65 0.00 0.00 177.43 175.49 2oex h LEU 656 N 0.31 0.31 -0.42 1.61 3.38 -0.36 0.30 115.31 120.44 2oex h LEU 656 Ca 0.33 -0.11 -0.18 0.00 0.09 0.00 0.00 57.88 58.01 2oex h LEU 656 Cb 0.85 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.51 2oex h LEU 656 CO -0.08 0.63 -0.75 0.00 0.09 0.00 0.00 178.44 178.33 2oex h ALA 657 N 1.39 0.63 -0.13 1.53 0.00 -0.38 -2.79 119.26 119.51 2oex h ALA 657 Ca 0.03 -0.63 -0.01 0.00 0.00 0.00 0.00 54.91 54.30 2oex h ALA 657 Cb 0.73 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 2oex h ALA 657 CO 0.06 0.80 0.04 1.15 0.00 0.00 0.00 179.25 181.30 2oex h THR 658 N 0.20 1.18 -0.64 0.00 2.02 -0.78 -2.43 112.91 112.46 2oex h THR 658 Ca -0.03 -0.55 0.13 0.00 0.77 0.00 0.00 66.41 66.73 2oex h THR 658 Cb 1.33 1.31 -0.11 0.00 -1.74 0.00 0.00 68.15 68.94 2oex h THR 658 CO 0.12 0.16 -0.08 0.00 0.37 0.00 0.00 175.52 176.10 2oex h ALA 659 N 0.85 0.53 -0.09 6.16 0.00 -0.96 0.30 119.26 126.05 2oex h ALA 659 Ca 0.04 0.22 -0.01 0.00 0.00 0.00 0.00 54.91 55.16 2oex h ALA 659 Cb 0.22 0.41 -0.00 0.00 0.00 0.00 0.00 17.79 18.42 2oex h ALA 659 CO -0.00 -0.42 0.01 -0.92 0.00 0.00 0.00 179.25 177.92 2oex h TYR 660 N 0.05 0.16 -0.97 0.00 3.20 -1.32 0.19 116.97 118.29 2oex h TYR 660 Ca 0.32 -0.02 0.08 0.00 3.14 0.00 0.00 58.73 62.25 2oex h TYR 660 Cb 0.52 -0.04 -0.07 0.00 1.54 0.00 0.00 36.73 38.67 2oex h TYR 660 CO -0.45 0.37 0.62 -0.44 -1.64 0.00 0.00 178.16 176.62 2oex h ASP 661 N -0.10 0.96 -0.30 -2.11 3.32 -0.92 -1.36 116.42 115.91 2oex h ASP 661 Ca 0.03 0.02 -0.06 0.00 0.02 0.00 0.00 57.03 57.04 2oex h ASP 661 Cb 0.30 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.66 2oex h ASP 661 CO 0.00 0.58 -0.05 0.78 -1.72 0.00 0.00 179.24 178.84 2oex h ASN 662 N 1.08 0.57 -0.21 6.45 4.21 0.13 -2.54 115.58 125.27 2oex h ASN 662 Ca 0.44 -0.35 0.04 0.00 1.21 0.00 0.00 56.30 57.64 2oex h ASN 662 Cb 0.26 -0.16 -0.07 0.00 -1.12 0.00 0.00 38.32 37.24 2oex h ASN 662 CO -0.20 0.79 -0.51 0.15 -1.29 0.00 0.00 177.43 176.36 2oex h PHE 663 N 0.35 -1.52 -0.14 1.19 3.57 -0.25 0.14 116.94 120.27 2oex h PHE 663 Ca 0.08 0.06 0.05 0.00 3.53 0.00 0.00 57.97 61.69 2oex h PHE 663 Cb 0.52 0.69 -0.06 0.00 2.79 0.00 0.00 35.95 39.90 2oex h PHE 663 CO 0.05 -0.52 -0.25 0.28 -2.23 0.00 0.00 178.31 175.64 2oex h VAL 664 N -0.51 0.40 -0.60 1.41 2.07 -1.18 -0.34 116.25 117.50 2oex h VAL 664 Ca 0.06 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.50 2oex h VAL 664 Cb 0.65 0.40 -0.02 0.00 -1.52 0.00 0.00 31.29 30.79 2oex h VAL 664 CO -0.47 0.00 0.08 -0.08 0.02 0.00 0.00 177.57 177.11 2oex h GLU 665 N -0.31 0.98 -0.64 1.57 4.81 -1.32 -2.23 114.58 117.43 2oex h GLU 665 Ca 0.10 -0.25 -0.09 0.00 -0.13 0.00 0.00 59.36 58.99 2oex h GLU 665 Cb 0.47 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.71 2oex h GLU 665 CO -0.32 0.92 0.06 1.25 -0.73 0.00 0.00 179.01 180.19 2oex h LEU 666 N 0.92 1.06 -0.04 1.64 5.85 -0.23 -1.79 115.31 122.71 2oex h LEU 666 Ca 0.18 -0.27 -0.01 0.00 0.84 0.00 0.00 57.88 58.62 2oex h LEU 666 Cb 0.43 -0.28 -0.00 0.00 0.37 0.00 0.00 40.66 41.18 2oex h LEU 666 CO 0.01 1.07 -0.01 0.58 -0.34 0.00 0.00 178.44 179.75 2oex h VAL 667 N 1.01 1.31 -0.82 1.05 2.07 -0.85 -2.17 116.25 117.86 2oex h VAL 667 Ca 0.19 -0.95 0.16 0.00 0.82 0.00 0.00 66.70 66.92 2oex h VAL 667 Cb 0.49 1.87 -0.10 0.00 -1.52 0.00 0.00 31.29 32.03 2oex h VAL 667 CO 0.02 0.26 0.37 0.00 0.02 0.00 0.00 177.57 178.23 2oex h ALA 668 N 0.63 1.22 -0.39 1.67 0.00 -1.40 0.71 119.26 121.70 2oex h ALA 668 Ca 0.01 0.12 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 2oex h ALA 668 Cb 0.42 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 2oex h ALA 668 CO 0.00 -0.20 0.18 -0.97 0.00 0.00 0.00 179.25 178.26 2oex h ASN 669 N 0.49 0.52 -0.41 0.00 -0.73 -1.27 -1.81 115.58 112.38 2oex h ASN 669 Ca 0.46 -0.14 -0.15 0.00 1.87 0.00 0.00 56.30 58.34 2oex h ASN 669 Cb 0.74 -0.13 -0.01 0.00 0.27 0.00 0.00 38.32 39.18 2oex h ASN 669 CO -0.42 0.52 -0.34 -0.07 -0.37 0.00 0.00 177.43 176.74 2oex h LEU 670 N 0.49 1.01 -0.65 0.34 3.38 -0.67 0.36 115.31 119.58 2oex h LEU 670 Ca 0.13 -0.44 0.01 0.00 0.09 0.00 0.00 57.88 57.67 2oex h LEU 670 Cb 0.14 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.57 2oex h LEU 670 CO -0.01 1.25 0.42 0.11 0.09 0.00 0.00 178.44 180.29 2oex h LYS 671 N 0.79 0.82 0.00 1.13 1.57 -0.88 0.24 116.57 120.25 2oex h LYS 671 Ca 0.07 -0.05 -0.17 0.00 -1.87 0.00 0.00 60.65 58.63 2oex h LYS 671 Cb 0.94 -0.19 -0.02 0.00 0.08 0.00 0.00 32.23 33.04 2oex h LYS 671 CO 0.09 0.54 -0.82 1.49 -0.57 0.00 0.00 179.45 180.18 2oex h GLU 672 N 0.85 0.00 -0.37 3.15 4.22 -1.13 -1.67 114.58 119.64 2oex h GLU 672 Ca 0.25 -0.00 -0.15 0.00 0.08 0.00 0.00 59.36 59.53 2oex h GLU 672 Cb -0.06 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.18 2oex h GLU 672 CO -0.07 0.82 -0.36 0.78 -2.18 0.00 0.00 179.01 178.00 2oex h GLY 673 N 2.45 0.93 0.96 1.92 0.00 0.01 -3.05 103.07 106.30 2oex h GLY 673 Ca -0.01 -0.93 -0.05 0.00 0.00 0.00 0.00 47.33 46.34 2oex h GLY 673 CO 0.11 0.84 0.07 -0.84 0.00 0.00 0.00 176.54 176.72 2oex h THR 674 N 0.71 1.25 -0.63 4.70 2.02 -0.38 -2.61 112.91 117.96 2oex h THR 674 Ca 0.06 -0.90 -0.03 0.00 0.77 0.00 0.00 66.41 66.32 2oex h THR 674 Cb 0.94 0.97 -0.03 0.00 -1.74 0.00 0.00 68.15 68.29 2oex h THR 674 CO 0.09 0.31 0.29 0.50 0.37 0.00 0.00 175.52 177.08 2oex h LYS 675 N 0.60 0.91 0.01 6.66 3.64 -1.32 -2.44 116.57 124.63 2oex h LYS 675 Ca 0.13 -0.14 -0.20 0.00 -1.27 0.00 0.00 60.65 59.18 2oex h LYS 675 Cb 0.38 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 32.03 2oex h LYS 675 CO 0.01 0.74 -0.92 0.35 -2.27 0.00 0.00 179.45 177.36 2oex h PHE 676 N 0.87 0.16 -0.12 1.91 3.57 -1.53 -2.31 116.94 119.50 2oex h PHE 676 Ca 0.21 -0.10 -0.10 0.00 3.53 0.00 0.00 57.97 61.51 2oex h PHE 676 Cb 0.13 -0.01 -0.01 0.00 2.79 0.00 0.00 35.95 38.85 2oex h PHE 676 CO 0.00 0.96 -0.38 1.88 -2.23 0.00 0.00 178.31 178.54 2oex h TYR 677 N 0.05 0.28 -0.43 0.41 0.99 -1.28 0.25 116.97 117.24 2oex h TYR 677 Ca -0.04 -0.07 -0.09 0.00 2.00 0.00 0.00 58.73 60.53 2oex h TYR 677 Cb 1.58 -0.06 -0.02 0.00 1.00 0.00 0.00 36.73 39.23 2oex h TYR 677 CO 0.02 0.59 -0.11 -0.91 -0.00 0.00 0.00 178.16 177.75 2oex h ASN 678 N 0.21 0.77 1.14 3.88 2.35 -1.41 -3.01 115.58 119.51 2oex h ASN 678 Ca 0.02 -0.23 -0.09 0.00 -0.55 0.00 0.00 56.30 55.45 2oex h ASN 678 Cb 0.77 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 38.92 2oex h ASN 678 CO 0.06 0.90 -0.44 -0.08 -1.65 0.00 0.00 177.43 176.22 2oex h GLU 679 N 0.70 0.00 0.00 0.81 4.81 -0.95 -2.65 114.58 117.30 2oex h GLU 679 Ca 0.12 0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 59.30 2oex h GLU 679 Cb 0.59 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.96 2oex h GLU 679 CO 0.04 0.44 -0.23 1.25 -0.73 0.00 0.00 179.01 179.78 2oex h LEU 680 N 0.00 0.00 0.05 1.64 5.85 -0.41 -3.15 115.31 119.29 2oex h LEU 680 Ca -0.00 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.71 2oex h LEU 680 Cb 1.13 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.16 2oex h LEU 680 CO 0.06 0.23 -0.03 0.74 -0.34 0.00 0.00 178.44 179.10 2oex h THR 681 N 0.00 1.23 -0.09 1.05 2.02 -1.34 -1.91 112.91 113.86 2oex h THR 681 Ca -0.00 -1.00 0.04 0.00 0.77 0.00 0.00 66.41 66.22 2oex h THR 681 Cb 0.76 1.88 -0.06 0.00 -1.74 0.00 0.00 68.15 68.99 2oex h THR 681 CO 0.03 0.25 -0.39 -0.33 0.37 0.00 0.00 175.52 175.45 2oex h GLU 682 N -0.52 -0.47 -0.87 6.66 5.08 -1.57 0.18 114.58 123.07 2oex h GLU 682 Ca -0.01 0.03 0.23 0.00 -1.00 0.00 0.00 59.36 58.62 2oex h GLU 682 Cb 0.46 0.11 -0.15 0.00 0.50 0.00 0.00 28.75 29.67 2oex h GLU 682 CO 0.01 -0.31 0.17 0.82 -1.00 0.00 0.00 179.01 178.70 2oex h ILE 683 N -0.49 0.27 0.00 3.13 1.08 -1.56 -0.60 117.51 119.34 2oex h ILE 683 Ca 0.07 -0.05 -0.18 0.00 -0.39 0.00 0.00 64.86 64.30 2oex h ILE 683 Cb 0.61 0.10 -0.02 0.00 -3.07 0.00 0.00 36.82 34.45 2oex h ILE 683 CO -0.36 0.03 -0.84 -0.07 -0.69 0.00 0.00 178.15 176.22 2oex h LEU 684 N 0.16 0.15 -0.52 1.44 3.38 -0.22 -2.50 115.31 117.20 2oex h LEU 684 Ca 0.54 -0.12 -0.04 0.00 0.09 0.00 0.00 57.88 58.35 2oex h LEU 684 Cb 1.08 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.76 2oex h LEU 684 CO -0.69 0.92 0.18 0.58 0.09 0.00 0.00 178.44 179.51 2oex h VAL 685 N 0.07 1.23 -0.59 1.22 2.07 0.74 0.63 116.25 121.61 2oex h VAL 685 Ca -0.03 -0.74 -0.01 0.00 0.82 0.00 0.00 66.70 66.75 2oex h VAL 685 Cb 1.46 0.74 -0.03 0.00 -1.52 0.00 0.00 31.29 31.94 2oex h VAL 685 CO 0.12 0.27 0.33 0.03 0.02 0.00 0.00 177.57 178.35 2oex h ARG 686 N 0.70 0.81 -0.45 1.57 2.47 -1.17 0.27 114.38 118.57 2oex h ARG 686 Ca 0.17 -0.09 -0.07 0.00 -1.26 0.00 0.00 59.98 58.73 2oex h ARG 686 Cb 0.25 -0.16 -0.02 0.00 -1.65 0.00 0.00 29.97 28.38 2oex h ARG 686 CO -0.01 0.61 -0.01 0.35 0.56 0.00 0.00 179.97 181.47 2oex h PHE 687 N 0.79 0.79 -0.25 3.04 3.57 -1.24 0.10 116.94 123.75 2oex h PHE 687 Ca 0.21 -0.11 -0.06 0.00 3.53 0.00 0.00 57.97 61.54 2oex h PHE 687 Cb 0.02 -0.22 -0.01 0.00 2.79 0.00 0.00 35.95 38.54 2oex h PHE 687 CO -0.01 0.74 -0.07 0.37 -2.23 0.00 0.00 178.31 177.11 2oex h GLN 688 N 0.70 0.48 -0.81 1.11 4.15 -0.26 -1.39 115.11 119.10 2oex h GLN 688 Ca 0.14 -0.19 0.03 0.00 0.77 0.00 0.00 58.65 59.40 2oex h GLN 688 Cb 0.44 -0.02 -0.05 0.00 0.21 0.00 0.00 27.48 28.06 2oex h GLN 688 CO 0.02 0.72 0.53 -0.91 -1.93 0.00 0.00 178.83 177.26 2oex h ASN 689 N 0.22 0.87 -0.20 -0.69 2.35 -0.08 0.15 115.58 118.19 2oex h ASN 689 Ca 0.06 -0.01 -0.01 0.00 -0.55 0.00 0.00 56.30 55.79 2oex h ASN 689 Cb 0.55 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.70 2oex h ASN 689 CO 0.03 0.60 0.09 0.50 -1.65 0.00 0.00 177.43 177.00 2oex h LYS 690 N 1.01 0.30 -0.17 0.81 3.64 -0.69 0.20 116.57 121.67 2oex h LYS 690 Ca 0.32 -0.05 -0.02 0.00 -1.27 0.00 0.00 60.65 59.63 2oex h LYS 690 Cb 0.02 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 31.78 2oex h LYS 690 CO -0.09 0.34 0.03 0.00 -2.27 0.00 0.00 179.45 177.45 2oex h SER 692 N 0.24 0.68 -0.59 0.00 0.87 -0.44 -2.80 113.55 111.50 2oex h SER 692 Ca 0.06 -0.79 0.06 0.00 -1.23 0.00 0.00 61.79 59.89 2oex h SER 692 Cb 0.12 -0.21 -0.05 0.00 -0.44 0.00 0.00 62.40 61.82 2oex h SER 692 CO -0.00 1.38 0.30 0.44 -0.53 0.00 0.00 176.83 178.42 2oex h ASP 693 N 0.05 0.42 0.84 6.23 3.32 -0.37 0.00 116.42 126.92 2oex h ASP 693 Ca -0.12 0.04 -0.04 0.00 0.02 0.00 0.00 57.03 56.93 2oex h ASP 693 Cb 1.54 -0.04 0.01 0.00 0.22 0.00 0.00 39.33 41.06 2oex h ASP 693 CO 0.16 0.28 -0.40 0.40 -1.72 0.00 0.00 179.24 177.96 2oex h ILE 694 N 0.56 0.00 -0.98 0.35 1.08 -1.30 -2.06 117.51 115.17 2oex h ILE 694 Ca 0.27 -0.11 0.23 0.00 -0.39 0.00 0.00 64.86 64.87 2oex h ILE 694 Cb 0.19 0.00 -0.08 0.00 -3.07 0.00 0.00 36.82 33.86 2oex h ILE 694 CO -0.19 0.00 0.64 0.58 -0.69 0.00 0.00 178.15 178.49 2oex h VAL 695 N -1.24 0.61 0.05 1.67 2.07 -1.49 -1.26 116.25 116.66 2oex h VAL 695 Ca -0.12 -0.14 -0.00 0.00 0.82 0.00 0.00 66.70 67.26 2oex h VAL 695 Cb 0.87 0.16 0.00 0.00 -1.52 0.00 0.00 31.29 30.79 2oex h VAL 695 CO 0.19 0.08 -0.03 0.15 0.02 0.00 0.00 177.57 177.98 2oex h PHE 696 N 0.41 -0.06 -0.77 1.57 3.57 -0.72 -2.64 116.94 118.30 2oex h PHE 696 Ca 0.53 -0.00 0.11 0.00 3.53 0.00 0.00 57.97 62.14 2oex h PHE 696 Cb 1.33 0.02 -0.08 0.00 2.79 0.00 0.00 35.95 40.02 2oex h PHE 696 CO -0.00 0.19 0.40 0.00 -2.23 0.00 0.00 178.31 176.67 2oex h ALA 697 N 0.62 1.09 -0.13 2.41 0.00 -0.57 -1.31 119.26 121.38 2oex h ALA 697 Ca -0.01 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2oex h ALA 697 Cb 0.28 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 2oex h ALA 697 CO 0.01 -0.02 0.08 0.00 0.00 0.00 0.00 179.25 179.32 2oex h ARG 698 N 0.65 0.16 0.00 0.00 2.47 -1.21 0.41 114.38 116.86 2oex h ARG 698 Ca 0.39 -0.01 -0.23 0.00 -1.26 0.00 0.00 59.98 58.86 2oex h ARG 698 Cb 0.43 -0.04 -0.04 0.00 -1.65 0.00 0.00 29.97 28.68 2oex h ARG 698 CO -0.29 0.11 -1.22 0.87 0.56 0.00 0.00 179.97 180.00 2oex h LYS 699 N 0.17 0.00 0.00 0.04 1.57 -0.97 -3.43 116.57 113.95 2oex h LYS 699 Ca 0.05 0.00 -0.17 0.00 -1.87 0.00 0.00 60.65 58.66 2oex h LYS 699 Cb -0.01 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.27 2oex h LYS 699 CO -0.01 0.83 -1.58 2.41 -0.57 0.00 0.00 179.45 180.53 2oex n THR 700 N -3.25 0.57 0.09 -0.16 -1.04 -0.42 -4.74 114.28 105.34 2oex n THR 700 Ca -0.05 -0.17 0.08 0.00 -2.04 0.00 0.00 64.05 61.86 2oex n THR 700 Cb 0.97 -1.34 -0.01 0.00 -1.82 0.00 0.00 70.33 68.13 2oex n THR 700 CO 0.00 0.00 0.00 -0.33 -0.64 0.00 0.00 175.07 174.10 2oex h GLU 701 N -0.23 0.00 0.00 -2.82 4.39 -0.47 -3.50 114.58 111.95 2oex h GLU 701 Ca -0.25 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.45 2oex h GLU 701 Cb 1.27 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.92 2oex h GLU 701 CO -0.11 0.11 0.00 0.54 -1.16 0.00 0.00 179.01 178.39