#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2oex s SER 362 N 0.00 6.73 0.02 4.52 1.04 -1.26 -4.88 113.70 119.87 2oex s SER 362 Ca 0.00 1.20 -0.25 0.00 0.48 0.00 0.00 55.95 57.38 2oex s SER 362 Cb 0.00 -2.34 -0.18 0.00 0.10 0.00 0.00 66.02 63.60 2oex s SER 362 CO 0.00 -0.19 1.45 0.58 0.98 0.00 0.00 173.24 176.06 2oex h VAL 363 N 1.94 1.20 -0.39 5.02 2.07 -2.01 -2.36 116.25 121.72 2oex h VAL 363 Ca -0.48 -0.67 0.08 0.00 0.82 0.00 0.00 66.70 66.46 2oex h VAL 363 Cb 1.17 1.65 -0.09 0.00 -1.52 0.00 0.00 31.29 32.51 2oex h VAL 363 CO 0.66 0.17 -0.21 1.56 0.02 0.00 0.00 177.57 179.78 2oex h GLN 364 N -0.32 -0.13 -0.68 1.57 1.08 -2.00 -1.17 115.11 113.46 2oex h GLN 364 Ca -0.00 0.01 0.04 0.00 -1.45 0.00 0.00 58.65 57.25 2oex h GLN 364 Cb 0.30 0.03 -0.05 0.00 -0.05 0.00 0.00 27.48 27.72 2oex h GLN 364 CO 0.00 -0.09 0.41 0.37 -0.95 0.00 0.00 178.83 178.58 2oex h GLN 365 N -0.14 0.77 0.00 1.46 4.15 -1.97 -1.66 115.11 117.72 2oex h GLN 365 Ca 0.19 -0.05 -0.05 0.00 0.77 0.00 0.00 58.65 59.52 2oex h GLN 365 Cb 0.43 -0.17 -0.01 0.00 0.21 0.00 0.00 27.48 27.94 2oex h GLN 365 CO -0.47 0.51 -0.22 0.77 -1.93 0.00 0.00 178.83 177.49 2oex h SER 366 N 0.79 0.00 0.15 -0.69 0.02 -0.76 -1.68 113.55 111.38 2oex h SER 366 Ca 0.28 0.00 -0.21 0.00 -0.84 0.00 0.00 61.79 61.02 2oex h SER 366 Cb 0.07 0.00 0.02 0.00 0.14 0.00 0.00 62.40 62.64 2oex h SER 366 CO -0.13 0.22 -0.95 -0.07 -1.14 0.00 0.00 176.83 174.75 2oex h LEU 367 N 0.00 0.50 -0.70 5.07 3.38 -0.65 -2.43 115.31 120.48 2oex h LEU 367 Ca -0.00 -0.94 0.15 0.00 0.09 0.00 0.00 57.88 57.18 2oex h LEU 367 Cb 0.57 -0.16 -0.11 0.00 0.09 0.00 0.00 40.66 41.04 2oex h LEU 367 CO 0.03 1.45 0.08 0.00 0.09 0.00 0.00 178.44 180.09 2oex h ALA 368 N 0.07 0.79 0.21 1.53 0.00 -1.19 -0.38 119.26 120.29 2oex h ALA 368 Ca -0.17 0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 2oex h ALA 368 Cb 1.71 0.31 0.00 0.00 0.00 0.00 0.00 17.79 19.81 2oex h ALA 368 CO 0.15 -0.38 -0.10 0.00 0.00 0.00 0.00 179.25 178.92 2oex h ALA 369 N 1.61 -0.28 -0.43 0.00 0.00 -1.33 -1.49 119.26 117.35 2oex h ALA 369 Ca 0.38 -0.07 0.06 0.00 0.00 0.00 0.00 54.91 55.28 2oex h ALA 369 Cb 0.65 0.11 -0.05 0.00 0.00 0.00 0.00 17.79 18.50 2oex h ALA 369 CO -0.55 -0.65 0.14 -0.92 0.00 0.00 0.00 179.25 177.27 2oex h TYR 370 N -0.30 0.24 0.00 0.00 3.20 -1.07 -1.33 116.97 117.72 2oex h TYR 370 Ca -0.03 0.02 -0.05 0.00 3.14 0.00 0.00 58.73 61.81 2oex h TYR 370 Cb 0.23 -0.04 -0.01 0.00 1.54 0.00 0.00 36.73 38.45 2oex h TYR 370 CO -0.06 0.08 -0.24 -0.91 -1.64 0.00 0.00 178.16 175.39 2oex h ASN 371 N 0.30 0.00 -0.26 -2.11 4.21 -0.91 -1.25 115.58 115.56 2oex h ASN 371 Ca 0.20 0.00 -0.09 0.00 1.21 0.00 0.00 56.30 57.63 2oex h ASN 371 Cb 0.21 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 37.40 2oex h ASN 371 CO -0.22 0.24 -0.17 1.56 -1.29 0.00 0.00 177.43 177.55 2oex h GLN 372 N 0.00 0.58 0.13 0.81 1.08 -0.49 -0.90 115.11 116.32 2oex h GLN 372 Ca -0.00 -0.27 0.02 0.00 -1.45 0.00 0.00 58.65 56.94 2oex h GLN 372 Cb 0.52 -0.01 -0.03 0.00 -0.05 0.00 0.00 27.48 27.91 2oex h GLN 372 CO 0.03 0.85 -0.27 0.00 -0.95 0.00 0.00 178.83 178.49 2oex h ARG 373 N 0.30 -0.47 -0.55 1.46 3.08 -0.47 0.37 114.38 118.09 2oex h ARG 373 Ca 0.05 0.03 0.03 0.00 0.07 0.00 0.00 59.98 60.17 2oex h ARG 373 Cb 0.70 0.11 -0.04 0.00 0.08 0.00 0.00 29.97 30.82 2oex h ARG 373 CO 0.05 -0.32 0.32 -0.22 -1.07 0.00 0.00 179.97 178.73 2oex h LYS 374 N -0.49 0.61 0.42 0.04 3.64 -1.31 -0.73 116.57 118.75 2oex h LYS 374 Ca 0.03 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.36 2oex h LYS 374 Cb 0.51 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 32.19 2oex h LYS 374 CO -0.15 0.40 -0.27 0.00 -2.27 0.00 0.00 179.45 177.17 2oex h ALA 375 N 1.26 -0.66 -0.21 5.00 0.00 -0.84 -1.86 119.26 121.94 2oex h ALA 375 Ca 0.23 -0.13 0.03 0.00 0.00 0.00 0.00 54.91 55.04 2oex h ALA 375 Cb 0.06 0.34 -0.04 0.00 0.00 0.00 0.00 17.79 18.15 2oex h ALA 375 CO -0.12 -0.89 -0.31 -0.44 0.00 0.00 0.00 179.25 177.50 2oex h ASP 376 N -0.66 -1.03 -0.46 0.00 3.32 0.18 0.32 116.42 118.09 2oex h ASP 376 Ca -0.04 0.13 0.09 0.00 0.02 0.00 0.00 57.03 57.23 2oex h ASP 376 Cb 0.55 0.42 -0.09 0.00 0.22 0.00 0.00 39.33 40.43 2oex h ASP 376 CO 0.04 -0.23 -0.18 0.25 -1.72 0.00 0.00 179.24 177.40 2oex h LEU 377 N -0.23 -0.64 0.40 1.55 6.46 -1.15 0.57 115.31 122.28 2oex h LEU 377 Ca 0.04 0.16 -0.01 0.00 -0.12 0.00 0.00 57.88 57.95 2oex h LEU 377 Cb 0.33 0.36 -0.02 0.00 -0.73 0.00 0.00 40.66 40.61 2oex h LEU 377 CO -0.32 -0.22 -0.38 0.58 -0.62 0.00 0.00 178.44 177.48 2oex h VAL 378 N -0.08 0.23 -0.48 1.05 2.07 -1.05 -2.01 116.25 115.98 2oex h VAL 378 Ca 0.22 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.83 2oex h VAL 378 Cb 0.42 0.23 -0.03 0.00 -1.52 0.00 0.00 31.29 30.40 2oex h VAL 378 CO -0.52 0.00 0.32 0.78 0.02 0.00 0.00 177.57 178.17 2oex h ASN 379 N -0.80 0.24 -0.26 0.57 2.35 0.02 -0.71 115.58 117.01 2oex h ASN 379 Ca -0.03 0.00 -0.08 0.00 -0.55 0.00 0.00 56.30 55.64 2oex h ASN 379 Cb 0.71 -0.05 -0.01 0.00 0.05 0.00 0.00 38.32 39.02 2oex h ASN 379 CO -0.05 0.15 -0.16 -0.09 -1.65 0.00 0.00 177.43 175.63 2oex h ARG 380 N 0.27 0.57 -0.46 0.81 2.43 0.32 -2.76 114.38 115.56 2oex h ARG 380 Ca 0.22 -0.26 -0.05 0.00 -0.81 0.00 0.00 59.98 59.07 2oex h ARG 380 Cb 0.51 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.03 2oex h ARG 380 CO -0.05 0.84 0.09 0.77 -1.51 0.00 0.00 179.97 180.11 2oex h SER 381 N 0.29 0.72 -0.24 -3.80 0.02 -0.54 -0.78 113.55 109.22 2oex h SER 381 Ca 0.05 -0.25 -0.01 0.00 -0.84 0.00 0.00 61.79 60.74 2oex h SER 381 Cb 0.69 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 63.03 2oex h SER 381 CO 0.05 0.79 0.11 0.40 -1.14 0.00 0.00 176.83 177.03 2oex h ILE 382 N 0.63 1.16 0.00 3.27 2.04 -1.23 -2.29 117.51 121.09 2oex h ILE 382 Ca 0.14 -0.46 -0.02 0.00 1.00 0.00 0.00 64.86 65.52 2oex h ILE 382 Cb 0.36 1.01 -0.00 0.00 -0.74 0.00 0.00 36.82 37.45 2oex h ILE 382 CO 0.01 0.16 -0.11 0.00 0.00 0.00 0.00 178.15 178.20 2oex h ALA 383 N 0.96 1.80 0.00 1.87 0.00 -1.37 -1.23 119.26 121.29 2oex h ALA 383 Ca 0.08 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2oex h ALA 383 Cb 0.15 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2oex h ALA 383 CO -0.01 0.14 0.00 1.04 0.00 0.00 0.00 179.25 180.42 2oex n GLN 384 N -4.39 0.32 0.00 0.00 6.02 -0.31 -1.76 117.38 117.27 2oex n GLN 384 Ca -0.03 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.96 2oex n GLN 384 Cb 0.18 -1.14 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 0.22 0.00 -0.25 -1.09 1.74 -0.47 -1.89 116.66 114.92 2oex n ARG 386 Ca 0.00 0.00 0.03 0.00 -0.77 0.00 0.00 57.85 57.11 2oex n ARG 386 Cb 0.07 0.00 0.15 0.00 -1.02 0.00 0.00 32.46 31.66 2oex n ARG 386 CO 0.00 0.00 0.00 1.49 -1.52 0.00 0.00 177.63 177.60 2oex h GLU 387 N 0.00 0.54 -0.34 5.56 4.81 -1.59 -1.98 114.58 121.58 2oex h GLU 387 Ca 0.00 -0.03 -0.15 0.00 -0.13 0.00 0.00 59.36 59.04 2oex h GLU 387 Cb 0.00 -0.12 -0.00 0.00 0.63 0.00 0.00 28.75 29.25 2oex h GLU 387 CO 0.00 0.36 -0.39 0.00 -0.73 0.00 0.00 179.01 178.25 2oex h ALA 388 N 1.47 0.50 0.15 2.92 0.00 -1.63 -2.51 119.26 120.15 2oex h ALA 388 Ca 0.37 -0.45 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 2oex h ALA 388 Cb 0.46 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.14 2oex h ALA 388 CO -0.31 0.60 -0.07 1.15 0.00 0.00 0.00 179.25 180.62 2oex h THR 389 N 0.64 0.91 -1.07 0.00 2.02 -1.78 0.19 112.91 113.82 2oex h THR 389 Ca 0.05 -0.25 0.29 0.00 0.77 0.00 0.00 66.41 67.27 2oex h THR 389 Cb 0.98 1.07 -0.10 0.00 -1.74 0.00 0.00 68.15 68.35 2oex h THR 389 CO 0.09 0.06 0.68 0.74 0.37 0.00 0.00 175.52 177.46 2oex h THR 390 N -0.31 0.46 0.01 3.16 2.02 -1.38 0.24 112.91 117.10 2oex h THR 390 Ca -0.02 -0.13 -0.23 0.00 0.77 0.00 0.00 66.41 66.80 2oex h THR 390 Cb 0.25 0.06 0.02 0.00 -1.74 0.00 0.00 68.15 66.74 2oex h THR 390 CO 0.03 0.07 -0.92 0.25 0.37 0.00 0.00 175.52 175.32 2oex h LEU 391 N 0.37 0.79 -0.18 2.58 6.46 -0.76 -1.76 115.31 122.81 2oex h LEU 391 Ca 0.64 -0.75 0.01 0.00 -0.12 0.00 0.00 57.88 57.65 2oex h LEU 391 Cb 1.63 -0.24 -0.01 0.00 -0.73 0.00 0.00 40.66 41.30 2oex h LEU 391 CO -0.35 1.45 0.09 0.00 -0.62 0.00 0.00 178.44 179.01 2oex h ALA 392 N 0.36 0.21 -0.22 1.25 0.00 0.80 -0.19 119.26 121.48 2oex h ALA 392 Ca -0.12 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 2oex h ALA 392 Cb 1.60 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.35 2oex h ALA 392 CO 0.18 -0.34 0.08 -0.91 0.00 0.00 0.00 179.25 178.27 2oex h ASN 393 N 0.19 0.26 -0.18 0.00 2.35 -1.08 -1.96 115.58 115.16 2oex h ASN 393 Ca 0.07 -0.02 -0.01 0.00 -0.55 0.00 0.00 56.30 55.79 2oex h ASN 393 Cb 0.02 -0.07 -0.01 0.00 0.05 0.00 0.00 38.32 38.31 2oex h ASN 393 CO -0.05 0.25 0.07 1.23 -1.65 0.00 0.00 177.43 177.28 2oex h GLY 394 N 0.44 0.30 0.95 2.83 0.00 -0.32 -2.00 103.07 105.26 2oex h GLY 394 Ca 0.08 -0.17 -0.09 0.00 0.00 0.00 0.00 47.33 47.14 2oex h GLY 394 CO -0.01 0.16 -0.16 -2.08 0.00 0.00 0.00 176.54 174.45 2oex h VAL 395 N 0.14 1.29 -0.59 4.60 2.07 -0.49 -2.24 116.25 121.03 2oex h VAL 395 Ca 0.06 -1.27 0.07 0.00 0.82 0.00 0.00 66.70 66.38 2oex h VAL 395 Cb 0.19 1.41 -0.06 0.00 -1.52 0.00 0.00 31.29 31.31 2oex h VAL 395 CO -0.00 0.41 0.28 -0.07 0.02 0.00 0.00 177.57 178.20 2oex h LEU 396 N 0.46 0.36 -0.31 2.57 3.38 -1.29 -1.88 115.31 118.59 2oex h LEU 396 Ca 0.07 0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 2oex h LEU 396 Cb 0.69 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.41 2oex h LEU 396 CO 0.05 0.23 0.16 0.00 0.09 0.00 0.00 178.44 178.97 2oex h ALA 397 N 1.35 0.40 0.00 1.53 0.00 -1.12 0.54 119.26 121.96 2oex h ALA 397 Ca 0.28 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.10 2oex h ALA 397 Cb 0.25 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.91 2oex h ALA 397 CO -0.22 -0.04 0.03 0.66 0.00 0.00 0.00 179.25 179.68 2oex h SER 398 N 0.38 0.00 -0.07 0.00 4.64 -0.79 -1.56 113.55 116.15 2oex h SER 398 Ca 0.11 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 2oex h SER 398 Cb 0.10 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.19 2oex h SER 398 CO -0.01 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 176.13 2oex n LEU 399 N -2.73 2.30 -1.69 5.97 4.77 -0.02 -4.98 117.00 120.62 2oex n LEU 399 Ca -0.02 -1.12 -0.16 0.00 -0.03 0.00 0.00 56.01 54.68 2oex n LEU 399 Cb 0.08 -0.04 -0.02 0.00 -2.33 0.00 0.00 43.42 41.12 2oex n LEU 399 CO 0.15 0.45 -0.19 -3.20 -1.33 0.00 0.00 177.39 173.26 2oex n ASN 400 N 0.80 -4.83 -4.64 -1.43 5.15 -0.05 -4.85 115.26 105.41 2oex n ASN 400 Ca 0.09 0.09 -0.34 0.00 -0.60 0.00 0.00 54.58 53.81 2oex n ASN 400 Cb 0.37 -3.90 -0.10 0.00 -0.53 0.00 0.00 39.78 35.62 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 -4.40 3.44 0.00 1.20 1.43 -0.75 0.82 118.68 120.42 2oex s LEU 401 Ca 0.00 0.07 0.29 0.00 -1.03 0.00 0.00 54.13 53.46 2oex s LEU 401 Cb 0.00 -1.78 1.22 0.00 0.03 0.00 0.00 46.19 45.66 2oex s LEU 401 CO 0.00 0.35 1.88 -0.81 0.23 0.00 0.00 176.35 178.00 2oex n PRO 402 N 2.34 0.35 -0.20 1.29 -0.04 -1.26 -4.23 135.00 133.25 2oex n PRO 402 Ca -0.18 -0.08 -0.04 0.00 -0.04 0.00 0.00 63.50 63.16 2oex n PRO 402 Cb 0.53 -1.50 0.02 0.00 -0.04 0.00 0.00 33.50 32.52 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 3.32 0.07 -0.84 0.55 0.00 -1.82 -1.77 119.26 118.77 2oex h ALA 403 Ca 0.00 0.18 0.18 0.00 0.00 0.00 0.00 54.91 55.28 2oex h ALA 403 Cb 0.39 0.71 -0.11 0.00 0.00 0.00 0.00 17.79 18.78 2oex h ALA 403 CO 0.00 -0.62 0.35 0.00 0.00 0.00 0.00 179.25 178.98 2oex h ALA 404 N 1.14 1.26 -0.00 0.00 0.00 0.08 -0.55 119.26 121.19 2oex h ALA 404 Ca 0.25 0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.30 2oex h ALA 404 Cb 0.54 0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.45 2oex h ALA 404 CO -0.67 -0.27 -0.02 0.44 0.00 0.00 0.00 179.25 178.72 2oex n ILE 405 N -5.03 0.00 0.78 0.00 -5.35 -0.67 -2.72 119.36 106.37 2oex n ILE 405 Ca 0.19 -0.07 0.08 0.00 -0.27 0.00 0.00 62.75 62.68 2oex n ILE 405 Cb 0.54 -0.19 -0.06 0.00 -1.74 0.00 0.00 39.64 38.20 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 -0.73 1.57 -2.38 6.28 1.02 -0.24 -4.82 120.64 121.34 2oex n GLU 406 Ca 0.20 -0.34 -0.42 0.00 -0.02 0.00 0.00 57.16 56.59 2oex n GLU 406 Cb 0.21 -1.29 0.00 0.00 -0.02 0.00 0.00 31.44 30.34 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 -0.87 6.69 -0.06 1.62 2.03 -1.05 -4.70 116.55 120.20 2oex n ASP 407 Ca 0.05 -3.26 -0.13 0.00 0.52 0.00 0.00 54.79 51.97 2oex n ASP 407 Cb 0.30 -1.35 -0.06 0.00 -0.72 0.00 0.00 41.12 39.28 2oex n ASP 407 CO 0.00 0.00 0.00 1.62 -1.92 0.00 0.00 177.20 176.90 2oex h VAL 408 N 3.06 1.32 -0.15 5.18 3.04 -1.87 -3.33 116.25 123.50 2oex h VAL 408 Ca 0.49 -1.20 -0.03 0.00 -1.01 0.00 0.00 66.70 64.95 2oex h VAL 408 Cb 0.47 1.72 -0.01 0.00 -2.01 0.00 0.00 31.29 31.46 2oex h VAL 408 CO 1.46 0.36 -0.02 0.77 -1.01 0.00 0.00 177.57 179.13 2oex h SER 409 N 0.07 0.27 0.00 3.17 4.64 -1.94 -3.42 113.55 116.34 2oex h SER 409 Ca 0.04 -0.34 0.00 0.00 -0.47 0.00 0.00 61.79 61.02 2oex h SER 409 Cb 0.61 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 62.63 2oex h SER 409 CO 0.03 0.55 0.00 0.61 -0.87 0.00 0.00 176.83 177.15 2oex n GLY 410 N -0.21 0.38 1.10 -0.77 0.00 -1.25 -4.20 105.19 100.24 2oex n GLY 410 Ca -0.05 0.00 0.02 0.00 0.00 0.00 0.00 46.02 45.99 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 -0.28 0.58 -4.20 1.61 3.85 -1.26 -1.01 116.55 115.84 2oex n ASP 411 Ca 0.00 -1.99 -0.12 0.00 -0.71 0.00 0.00 54.79 51.97 2oex n ASP 411 Cb 0.14 -0.25 -0.10 0.00 -1.35 0.00 0.00 41.12 39.56 2oex n ASP 411 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.20 176.61 2oex s THR 412 N 0.00 0.46 -0.09 2.12 -4.23 -1.26 -5.03 115.64 107.61 2oex s THR 412 Ca 0.20 -1.95 -0.30 0.00 -1.18 0.00 0.00 61.69 58.47 2oex s THR 412 Cb 0.23 -2.05 -0.04 0.00 1.34 0.00 0.00 72.50 71.99 2oex s THR 412 CO -0.10 -0.51 1.43 0.68 -0.54 0.00 0.00 174.62 175.57 2oex s VAL 413 N -3.80 3.93 0.47 2.29 -7.23 -1.26 -4.97 120.40 109.82 2oex s VAL 413 Ca 0.23 1.16 -0.22 0.00 -1.81 0.00 0.00 61.98 61.34 2oex s VAL 413 Cb 0.07 -3.75 -0.09 0.00 0.56 0.00 0.00 36.38 33.16 2oex s VAL 413 CO 0.02 -0.08 0.95 -2.65 -0.31 0.00 0.00 175.10 173.03 2oex n PRO 414 N 6.53 1.17 -0.04 4.82 -0.02 -1.26 -4.78 135.00 141.41 2oex n PRO 414 Ca 0.15 0.43 -0.10 0.00 -2.02 0.00 0.00 63.50 61.95 2oex n PRO 414 Cb 0.44 -2.03 -0.04 0.00 -0.02 0.00 0.00 33.50 31.85 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 1.19 0.26 -0.49 -0.52 1.08 -1.93 -2.12 115.11 112.57 2oex h GLN 415 Ca -0.45 -0.03 0.10 0.00 -1.45 0.00 0.00 58.65 56.82 2oex h GLN 415 Cb 1.35 -0.05 -0.09 0.00 -0.05 0.00 0.00 27.48 28.64 2oex h GLN 415 CO 0.55 0.23 -0.04 0.66 -0.95 0.00 0.00 178.83 179.28 2oex h SER 416 N 0.21 -0.29 -0.48 1.46 4.64 -1.96 0.21 113.55 117.35 2oex h SER 416 Ca 0.07 0.13 0.08 0.00 -0.47 0.00 0.00 61.79 61.59 2oex h SER 416 Cb 0.04 0.24 -0.03 0.00 -0.31 0.00 0.00 62.40 62.35 2oex h SER 416 CO -0.01 -0.10 0.33 0.40 -0.87 0.00 0.00 176.83 176.57 2oex h ILE 417 N 0.07 0.92 -0.06 0.95 1.08 -1.89 -0.94 117.51 117.65 2oex h ILE 417 Ca 0.24 -0.11 -0.06 0.00 -0.39 0.00 0.00 64.86 64.54 2oex h ILE 417 Cb 0.37 0.57 0.00 0.00 -3.07 0.00 0.00 36.82 34.69 2oex h ILE 417 CO -0.44 0.06 -0.20 0.25 -0.69 0.00 0.00 178.15 177.13 2oex h LEU 418 N 0.33 0.27 -0.56 1.44 5.85 -0.01 -1.00 115.31 121.63 2oex h LEU 418 Ca 0.22 -0.62 0.11 0.00 0.84 0.00 0.00 57.88 58.42 2oex h LEU 418 Cb 0.44 -0.08 -0.09 0.00 0.37 0.00 0.00 40.66 41.30 2oex h LEU 418 CO -0.05 0.85 0.07 0.74 -0.34 0.00 0.00 178.44 179.72 2oex h THR 419 N -0.29 0.62 -0.35 1.05 2.02 -0.72 0.19 112.91 115.43 2oex h THR 419 Ca -0.01 -0.07 0.00 0.00 0.77 0.00 0.00 66.41 67.11 2oex h THR 419 Cb 0.83 0.40 -0.02 0.00 -1.74 0.00 0.00 68.15 67.63 2oex h THR 419 CO 0.04 0.04 0.23 0.11 0.37 0.00 0.00 175.52 176.30 2oex h LYS 420 N 0.20 0.47 -0.08 6.66 1.57 -1.11 -0.77 116.57 123.52 2oex h LYS 420 Ca 0.29 -0.03 -0.00 0.00 -1.87 0.00 0.00 60.65 59.04 2oex h LYS 420 Cb 0.44 -0.10 -0.00 0.00 0.08 0.00 0.00 32.23 32.64 2oex h LYS 420 CO -0.42 0.33 0.04 1.03 -0.57 0.00 0.00 179.45 179.86 2oex h SER 421 N 0.47 0.09 -0.49 0.86 0.87 -0.54 -1.79 113.55 113.03 2oex h SER 421 Ca 0.13 -0.08 0.09 0.00 -1.23 0.00 0.00 61.79 60.70 2oex h SER 421 Cb -0.03 -0.02 -0.08 0.00 -0.44 0.00 0.00 62.40 61.82 2oex h SER 421 CO -0.03 0.15 0.01 0.03 -0.53 0.00 0.00 176.83 176.46 2oex h ARG 422 N 0.03 0.12 -0.12 2.24 3.08 -0.45 -1.86 114.38 117.42 2oex h ARG 422 Ca 0.03 -0.01 0.04 0.00 0.07 0.00 0.00 59.98 60.11 2oex h ARG 422 Cb 0.08 -0.03 -0.04 0.00 0.08 0.00 0.00 29.97 30.06 2oex h ARG 422 CO -0.00 0.08 -0.12 1.03 -1.07 0.00 0.00 179.97 179.88 2oex h SER 423 N 0.12 -0.39 -0.69 7.04 0.87 -0.83 0.24 113.55 119.91 2oex h SER 423 Ca 0.24 0.08 0.11 0.00 -1.23 0.00 0.00 61.79 60.99 2oex h SER 423 Cb 0.36 0.19 -0.08 0.00 -0.44 0.00 0.00 62.40 62.43 2oex h SER 423 CO -0.40 -0.16 0.28 0.58 -0.53 0.00 0.00 176.83 176.60 2oex h VAL 424 N -0.15 0.74 -0.72 2.23 2.07 -1.01 -1.74 116.25 117.67 2oex h VAL 424 Ca 0.09 -0.16 -0.06 0.00 0.82 0.00 0.00 66.70 67.39 2oex h VAL 424 Cb 0.28 0.23 -0.03 0.00 -1.52 0.00 0.00 31.29 30.25 2oex h VAL 424 CO -0.21 0.09 0.21 0.40 0.02 0.00 0.00 177.57 178.07 2oex h ILE 425 N 0.47 1.26 0.00 4.57 2.04 -0.39 -0.74 117.51 124.72 2oex h ILE 425 Ca 0.36 -0.92 0.00 0.00 1.00 0.00 0.00 64.86 65.30 2oex h ILE 425 Cb 0.47 0.48 0.00 0.00 -0.74 0.00 0.00 36.82 37.04 2oex h ILE 425 CO -0.34 0.36 0.00 -0.08 0.00 0.00 0.00 178.15 178.09 2oex h GLU 426 N 1.08 0.00 -0.49 2.37 4.57 0.32 -2.60 114.58 119.83 2oex h GLU 426 Ca 0.23 0.00 -0.20 0.00 -1.18 0.00 0.00 59.36 58.22 2oex h GLU 426 Cb 0.33 0.00 -0.12 0.00 -0.16 0.00 0.00 28.75 28.80 2oex h GLU 426 CO -0.00 0.00 0.10 1.04 -1.18 0.00 0.00 179.01 178.97 2oex n GLN 427 N -3.00 2.43 -0.98 1.92 6.02 -0.78 -4.92 117.38 118.06 2oex n GLN 427 Ca -0.02 -3.07 0.00 0.00 -0.01 0.00 0.00 57.00 53.90 2oex n GLN 427 Cb 0.11 -1.94 0.00 0.00 1.02 0.00 0.00 30.24 29.43 2oex n GLN 427 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2oex n GLY 428 N -0.85 0.35 7.00 1.08 0.00 -0.98 -4.58 105.19 107.21 2oex n GLY 428 Ca 0.36 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.38 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 -1.52 1.81 0.08 -0.02 0.00 -0.35 -1.58 105.19 103.60 2oex n GLY 429 Ca 0.00 -0.25 0.07 0.00 0.00 0.00 0.00 46.02 45.84 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 1.26 -0.03 -0.61 0.13 -1.26 -2.33 119.36 116.51 2oex n ILE 430 Ca 0.00 0.46 -0.14 0.00 -1.10 0.00 0.00 62.75 61.97 2oex n ILE 430 Cb 0.00 -1.39 -0.09 0.00 -0.84 0.00 0.00 39.64 37.32 2oex n ILE 430 CO 0.00 0.00 0.00 -0.61 2.80 0.00 0.00 176.55 178.74 2oex h GLN 431 N 0.00 0.17 -0.47 9.51 4.15 -1.65 -2.64 115.11 124.17 2oex h GLN 431 Ca 0.00 -0.11 0.09 0.00 0.77 0.00 0.00 58.65 59.40 2oex h GLN 431 Cb 0.13 0.02 -0.10 0.00 0.21 0.00 0.00 27.48 27.74 2oex h GLN 431 CO 0.00 0.71 -0.27 1.15 -1.93 0.00 0.00 178.83 178.50 2oex h THR 432 N -0.35 0.29 -0.49 2.39 2.02 -1.40 -0.16 112.91 115.21 2oex h THR 432 Ca -0.00 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.13 2oex h THR 432 Cb 0.71 0.29 -0.02 0.00 -1.74 0.00 0.00 68.15 67.39 2oex h THR 432 CO 0.03 0.00 0.10 0.58 0.37 0.00 0.00 175.52 176.60 2oex h VAL 433 N -0.17 1.24 0.21 3.16 2.07 -1.65 -2.31 116.25 118.81 2oex h VAL 433 Ca 0.21 -0.88 0.00 0.00 0.82 0.00 0.00 66.70 66.85 2oex h VAL 433 Cb 0.50 0.87 -0.02 0.00 -1.52 0.00 0.00 31.29 31.13 2oex h VAL 433 CO -0.57 0.32 -0.20 0.44 0.02 0.00 0.00 177.57 177.58 2oex h ASP 434 N 0.68 -0.54 -0.87 0.57 3.32 -0.92 -1.15 116.42 117.52 2oex h ASP 434 Ca 0.15 0.05 -0.03 0.00 0.02 0.00 0.00 57.03 57.23 2oex h ASP 434 Cb 0.36 0.19 -0.04 0.00 0.22 0.00 0.00 39.33 40.05 2oex h ASP 434 CO 0.01 -0.30 0.44 0.06 -1.72 0.00 0.00 179.24 177.72 2oex h GLN 435 N -0.44 1.23 -0.45 3.56 3.07 -1.02 0.11 115.11 121.17 2oex h GLN 435 Ca -0.00 -0.17 -0.02 0.00 0.09 0.00 0.00 58.65 58.56 2oex h GLN 435 Cb 0.41 -0.23 -0.02 0.00 0.08 0.00 0.00 27.48 27.72 2oex h GLN 435 CO -0.05 0.93 0.22 -0.07 0.09 0.00 0.00 178.83 179.95 2oex h LEU 436 N 1.22 0.58 -0.80 0.06 3.38 -1.17 -2.44 115.31 116.14 2oex h LEU 436 Ca 0.30 -0.12 -0.00 0.00 0.09 0.00 0.00 57.88 58.15 2oex h LEU 436 Cb 0.08 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 40.64 2oex h LEU 436 CO -0.04 0.54 0.50 0.40 0.09 0.00 0.00 178.44 179.92 2oex h ILE 437 N 0.58 1.22 -0.98 1.22 1.08 -0.96 -2.67 117.51 117.00 2oex h ILE 437 Ca 0.15 -0.47 0.11 0.00 -0.39 0.00 0.00 64.86 64.26 2oex h ILE 437 Cb 0.11 0.09 -0.08 0.00 -3.07 0.00 0.00 36.82 33.86 2oex h ILE 437 CO -0.02 0.23 0.61 0.50 -0.69 0.00 0.00 178.15 178.78 2oex h LYS 438 N 1.10 0.96 0.00 2.37 1.63 -0.53 -3.19 116.57 118.91 2oex h LYS 438 Ca 0.29 -0.06 0.00 0.00 -0.85 0.00 0.00 60.65 60.03 2oex h LYS 438 Cb -0.06 -0.22 0.00 0.00 -0.60 0.00 0.00 32.23 31.35 2oex h LYS 438 CO -0.06 0.64 -1.19 -0.85 -3.45 0.00 0.00 179.45 174.54 2oex n GLU 439 N -4.62 0.20 0.07 1.90 0.28 -0.97 -4.55 120.64 112.95 2oex n GLU 439 Ca 0.18 -0.04 -0.12 0.00 -0.16 0.00 0.00 57.16 57.01 2oex n GLU 439 Cb 0.32 -1.52 -0.06 0.00 1.43 0.00 0.00 31.44 31.61 2oex n GLU 439 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 177.13 176.90 2oex h LEU 440 N 0.00 -0.23 -0.98 -1.84 3.38 -1.46 -2.40 115.31 111.77 2oex h LEU 440 Ca 0.00 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.00 2oex h LEU 440 Cb 0.65 0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.49 2oex h LEU 440 CO 0.00 -0.13 0.00 -0.65 0.09 0.00 0.00 178.44 177.75 2oex h PRO 441 N -0.17 0.00 -0.04 1.13 0.11 -1.80 -0.61 132.00 130.62 2oex h PRO 441 Ca 0.02 0.00 -0.23 0.00 0.11 0.00 0.00 66.00 65.90 2oex h PRO 441 Cb 0.19 0.00 0.01 0.00 0.11 0.00 0.00 31.00 31.31 2oex h PRO 441 CO -0.05 0.00 -0.92 0.93 -0.21 0.00 0.00 178.00 177.75 2oex h GLU 442 N 0.00 0.56 -0.28 1.05 5.08 -1.71 0.03 114.58 119.32 2oex h GLU 442 Ca 0.00 -0.56 -0.09 0.00 -1.00 0.00 0.00 59.36 57.71 2oex h GLU 442 Cb 0.34 0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.73 2oex h GLU 442 CO 0.00 1.18 -0.18 -0.07 -1.00 0.00 0.00 179.01 178.94 2oex h LEU 443 N 0.34 0.65 -0.42 1.33 4.07 -0.91 -2.54 115.31 117.83 2oex h LEU 443 Ca -0.08 -0.43 0.09 0.00 0.08 0.00 0.00 57.88 57.53 2oex h LEU 443 Cb 1.55 -0.18 -0.09 0.00 1.08 0.00 0.00 40.66 43.01 2oex h LEU 443 CO 0.17 0.94 -0.26 0.25 -1.08 0.00 0.00 178.44 178.47 2oex h LEU 444 N 0.36 -0.86 -1.28 1.67 6.46 -1.09 -2.36 115.31 118.22 2oex h LEU 444 Ca 0.06 0.18 -0.03 0.00 -0.12 0.00 0.00 57.88 57.96 2oex h LEU 444 Cb 0.72 0.44 -0.00 0.00 -0.73 0.00 0.00 40.66 41.08 2oex h LEU 444 CO 0.05 -0.27 -0.15 -0.61 -0.62 0.00 0.00 178.44 176.84 2oex h GLN 445 N -0.18 0.00 -0.23 1.25 5.75 -0.91 -2.04 115.11 118.76 2oex h GLN 445 Ca 0.20 0.00 -0.20 0.00 -0.15 0.00 0.00 58.65 58.49 2oex h GLN 445 Cb 0.49 0.00 0.01 0.00 1.07 0.00 0.00 27.48 29.04 2oex h GLN 445 CO -0.53 0.15 -0.66 -0.09 -2.65 0.00 0.00 178.83 175.05 2oex h ARG 446 N 0.00 0.85 -0.50 1.69 2.43 -1.00 -2.13 114.38 115.72 2oex h ARG 446 Ca -0.00 -0.61 -0.02 0.00 -0.81 0.00 0.00 59.98 58.54 2oex h ARG 446 Cb 0.64 0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 30.27 2oex h ARG 446 CO 0.02 1.23 0.23 -0.91 -1.51 0.00 0.00 179.97 179.03 2oex h ASN 447 N 0.62 0.67 -0.81 -3.80 2.35 -1.08 -2.83 115.58 110.71 2oex h ASN 447 Ca -0.02 -0.14 0.06 0.00 -0.55 0.00 0.00 56.30 55.66 2oex h ASN 447 Cb 1.28 -0.17 -0.06 0.00 0.05 0.00 0.00 38.32 39.41 2oex h ASN 447 CO 0.14 0.62 0.49 -0.09 -1.65 0.00 0.00 177.43 176.94 2oex h ARG 448 N 0.67 0.87 -0.72 0.81 2.43 -1.27 -2.38 114.38 114.77 2oex h ARG 448 Ca 0.17 -0.05 -0.03 0.00 -0.81 0.00 0.00 59.98 59.26 2oex h ARG 448 Cb 0.14 -0.20 -0.03 0.00 -0.42 0.00 0.00 29.97 29.46 2oex h ARG 448 CO -0.02 0.57 0.32 0.93 -1.51 0.00 0.00 179.97 180.27 2oex h GLU 449 N 0.89 1.05 -0.13 0.20 5.08 -1.20 -0.36 114.58 120.10 2oex h GLU 449 Ca 0.36 -0.16 -0.17 0.00 -1.00 0.00 0.00 59.36 58.39 2oex h GLU 449 Cb 0.18 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 2oex h GLU 449 CO -0.18 0.83 -0.62 0.82 -1.00 0.00 0.00 179.01 178.86 2oex h ILE 450 N 1.04 1.35 -0.25 3.13 2.04 -1.23 -1.74 117.51 121.85 2oex h ILE 450 Ca 0.25 -1.93 -0.08 0.00 1.00 0.00 0.00 64.86 64.09 2oex h ILE 450 Cb 0.14 1.92 -0.01 0.00 -0.74 0.00 0.00 36.82 38.13 2oex h ILE 450 CO -0.03 0.59 -0.16 0.25 0.00 0.00 0.00 178.15 178.80 2oex h LEU 451 N 0.35 0.57 -0.20 1.44 5.85 -1.10 0.42 115.31 122.64 2oex h LEU 451 Ca -0.01 -0.43 0.01 0.00 0.84 0.00 0.00 57.88 58.29 2oex h LEU 451 Cb 1.17 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 42.03 2oex h LEU 451 CO 0.11 0.88 0.10 0.44 -0.34 0.00 0.00 178.44 179.64 2oex h ASP 452 N 0.27 0.16 -0.56 1.25 3.32 -1.03 0.22 116.42 120.05 2oex h ASP 452 Ca 0.05 0.01 0.01 0.00 0.02 0.00 0.00 57.03 57.12 2oex h ASP 452 Cb 0.69 -0.02 -0.03 0.00 0.22 0.00 0.00 39.33 40.18 2oex h ASP 452 CO 0.04 0.12 0.36 -0.08 -1.72 0.00 0.00 179.24 177.96 2oex h GLU 453 N 0.22 0.70 -0.26 3.56 4.57 -1.29 0.83 114.58 122.92 2oex h GLU 453 Ca 0.08 -0.04 0.04 0.00 -1.18 0.00 0.00 59.36 58.26 2oex h GLU 453 Cb 0.01 -0.16 -0.07 0.00 -0.16 0.00 0.00 28.75 28.37 2oex h GLU 453 CO -0.05 0.47 -0.52 0.77 -1.18 0.00 0.00 179.01 178.49 2oex h SER 454 N 0.72 -1.70 0.46 1.04 0.02 -0.42 -1.82 113.55 111.85 2oex h SER 454 Ca 0.21 0.22 -0.01 0.00 -0.84 0.00 0.00 61.79 61.37 2oex h SER 454 Cb -0.04 0.69 -0.00 0.00 0.14 0.00 0.00 62.40 63.18 2oex h SER 454 CO -0.07 -0.44 -0.06 -0.07 -1.14 0.00 0.00 176.83 175.05 2oex h LEU 455 N -0.49 0.00 -0.17 5.07 3.38 -0.42 -2.28 115.31 120.41 2oex h LEU 455 Ca 0.06 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.80 2oex h LEU 455 Cb 0.64 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.40 2oex h LEU 455 CO -0.50 0.06 -0.88 -0.09 0.09 0.00 0.00 178.44 177.12 2oex h ARG 456 N 0.00 0.60 -0.40 1.13 2.43 -0.12 -2.48 114.38 115.53 2oex h ARG 456 Ca -0.00 -0.57 0.07 0.00 -0.81 0.00 0.00 59.98 58.67 2oex h ARG 456 Cb 0.31 0.14 -0.06 0.00 -0.42 0.00 0.00 29.97 29.94 2oex h ARG 456 CO 0.01 1.18 0.02 -0.07 -1.51 0.00 0.00 179.97 179.60 2oex h LEU 457 N 0.37 -0.12 -0.74 3.80 3.38 -0.74 -0.68 115.31 120.59 2oex h LEU 457 Ca -0.08 0.09 -0.03 0.00 0.09 0.00 0.00 57.88 57.95 2oex h LEU 457 Cb 1.51 0.15 -0.03 0.00 0.09 0.00 0.00 40.66 42.37 2oex h LEU 457 CO 0.17 -0.02 0.32 -0.07 0.09 0.00 0.00 178.44 178.93 2oex h LEU 458 N 0.13 0.99 -1.43 1.67 3.38 -1.57 -1.88 115.31 116.61 2oex h LEU 458 Ca 0.20 -0.15 -0.06 0.00 0.09 0.00 0.00 57.88 57.96 2oex h LEU 458 Cb 0.27 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.76 2oex h LEU 458 CO -0.31 0.87 -0.27 0.44 0.09 0.00 0.00 178.44 179.26 2oex h ASP 459 N 1.04 0.00 0.09 -0.43 5.19 -0.92 -1.40 116.42 120.00 2oex h ASP 459 Ca 0.25 0.00 -0.12 0.00 -0.62 0.00 0.00 57.03 56.54 2oex h ASP 459 Cb 0.17 0.00 0.01 0.00 0.18 0.00 0.00 39.33 39.69 2oex h ASP 459 CO -0.03 0.27 -0.52 -0.08 -3.12 0.00 0.00 179.24 175.76 2oex h GLU 460 N 0.00 0.19 -0.08 3.56 4.81 -0.79 -2.20 114.58 120.07 2oex h GLU 460 Ca -0.00 -0.33 0.04 0.00 -0.13 0.00 0.00 59.36 58.94 2oex h GLU 460 Cb 0.59 0.12 -0.05 0.00 0.63 0.00 0.00 28.75 30.04 2oex h GLU 460 CO 0.03 1.16 -0.20 1.49 -0.73 0.00 0.00 179.01 180.76 2oex h GLU 461 N -0.59 -0.27 -0.99 1.92 4.57 -1.31 -2.86 114.58 115.06 2oex h GLU 461 Ca -0.09 0.02 0.05 0.00 -1.18 0.00 0.00 59.36 58.16 2oex h GLU 461 Cb 1.41 0.06 -0.06 0.00 -0.16 0.00 0.00 28.75 30.00 2oex h GLU 461 CO 0.10 -0.18 0.64 1.49 -1.18 0.00 0.00 179.01 179.88 2oex h GLU 462 N -0.28 1.16 -0.39 1.92 4.81 -1.31 0.58 114.58 121.07 2oex h GLU 462 Ca 0.08 -0.07 0.02 0.00 -0.13 0.00 0.00 59.36 59.26 2oex h GLU 462 Cb 0.40 -0.26 -0.03 0.00 0.63 0.00 0.00 28.75 29.49 2oex h GLU 462 CO -0.24 0.77 0.23 0.00 -0.73 0.00 0.00 179.01 179.03 2oex h ALA 463 N 1.45 0.49 -0.25 2.92 0.00 -1.26 0.32 119.26 122.94 2oex h ALA 463 Ca 0.41 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 55.20 2oex h ALA 463 Cb 0.11 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 2oex h ALA 463 CO -0.15 -0.11 -0.30 1.15 0.00 0.00 0.00 179.25 179.84 2oex h THR 464 N 0.47 1.31 -0.59 0.00 2.02 -1.06 -1.23 112.91 113.83 2oex h THR 464 Ca 0.15 -1.49 0.11 0.00 0.77 0.00 0.00 66.41 65.96 2oex h THR 464 Cb 0.01 1.69 -0.09 0.00 -1.74 0.00 0.00 68.15 68.02 2oex h THR 464 CO -0.07 0.47 0.10 -0.78 0.37 0.00 0.00 175.52 175.60 2oex h ASP 465 N 0.36 -0.06 -0.25 4.18 3.58 -0.72 0.21 116.42 123.72 2oex h ASP 465 Ca 0.03 0.12 -0.12 0.00 0.42 0.00 0.00 57.03 57.48 2oex h ASP 465 Cb 0.88 0.17 -0.01 0.00 1.72 0.00 0.00 39.33 42.09 2oex h ASP 465 CO 0.07 -0.02 -0.26 0.78 -2.88 0.00 0.00 179.24 176.94 2oex h ASN 466 N 0.22 0.76 -0.62 2.28 2.35 -0.79 0.05 115.58 119.83 2oex h ASN 466 Ca 0.31 -0.29 -0.09 0.00 -0.55 0.00 0.00 56.30 55.69 2oex h ASN 466 Cb 0.47 -0.21 -0.02 0.00 0.05 0.00 0.00 38.32 38.61 2oex h ASN 466 CO -0.42 0.98 0.04 -0.78 -1.65 0.00 0.00 177.43 175.61 2oex h ASP 467 N 0.64 1.04 -0.83 5.81 3.58 -0.64 -0.87 116.42 125.15 2oex h ASP 467 Ca 0.08 -0.27 -0.04 0.00 0.42 0.00 0.00 57.03 57.22 2oex h ASP 467 Cb 0.77 -0.28 -0.04 0.00 1.72 0.00 0.00 39.33 41.50 2oex h ASP 467 CO 0.06 1.06 0.37 0.25 -2.88 0.00 0.00 179.24 178.11 2oex h LEU 468 N 0.99 1.11 -1.10 2.28 5.85 -0.34 -2.75 115.31 121.35 2oex h LEU 468 Ca 0.18 -0.15 -0.05 0.00 0.84 0.00 0.00 57.88 58.71 2oex h LEU 468 Cb 0.51 -0.29 -0.02 0.00 0.37 0.00 0.00 40.66 41.23 2oex h LEU 468 CO 0.02 0.95 0.10 0.03 -0.34 0.00 0.00 178.44 179.20 2oex h ARG 469 N 1.19 0.74 0.00 1.25 3.08 0.10 -0.90 114.38 119.84 2oex h ARG 469 Ca 0.28 -0.15 -0.11 0.00 0.07 0.00 0.00 59.98 60.07 2oex h ARG 469 Cb 0.15 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 30.08 2oex h ARG 469 CO -0.03 0.68 -0.52 0.00 -1.07 0.00 0.00 179.97 179.03 2oex h ALA 470 N 1.40 0.92 0.13 0.04 0.00 -1.03 -3.25 119.26 117.47 2oex h ALA 470 Ca 0.16 -0.48 -0.33 0.00 0.00 0.00 0.00 54.91 54.26 2oex h ALA 470 Cb 0.30 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 2oex h ALA 470 CO 0.00 0.65 -1.70 0.87 0.00 0.00 0.00 179.25 179.08 2oex h LYS 471 N 0.00 0.28 -3.71 0.00 1.57 -1.29 -3.43 116.57 109.99 2oex h LYS 471 Ca -0.01 -0.48 -0.74 0.00 -1.87 0.00 0.00 60.65 57.56 2oex h LYS 471 Cb 1.07 0.18 -0.31 0.00 0.08 0.00 0.00 32.23 33.24 2oex h LYS 471 CO 0.07 1.15 -0.18 0.12 -0.57 0.00 0.00 179.45 180.04 2oex s PHE 472 N -2.59 3.55 0.36 -1.35 5.36 -0.36 -4.96 117.98 117.99 2oex s PHE 472 Ca -0.13 -2.39 0.18 0.00 -0.96 0.00 0.00 56.93 53.63 2oex s PHE 472 Cb 0.06 -3.46 1.26 0.00 -0.34 0.00 0.00 43.02 40.54 2oex s PHE 472 CO 0.84 -0.91 1.60 0.87 -1.46 0.00 0.00 175.22 176.16 2oex h LYS 473 N 7.38 0.07 -0.04 10.12 1.57 -1.85 -1.19 116.57 132.62 2oex h LYS 473 Ca 0.03 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 2oex h LYS 473 Cb 0.99 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.29 2oex h LYS 473 CO 0.74 0.04 0.00 0.39 -0.57 0.00 0.00 179.45 180.05 2oex n GLU 474 N -5.23 1.27 0.00 3.15 -0.58 -1.26 -3.97 120.64 114.02 2oex n GLU 474 Ca 0.36 -0.40 0.04 0.00 -0.42 0.00 0.00 57.16 56.74 2oex n GLU 474 Cb 1.19 -1.38 0.21 0.00 -0.57 0.00 0.00 31.44 30.89 2oex n GLU 474 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 2oex n ARG 475 N -0.43 0.11 0.27 3.49 5.12 -0.45 -3.09 116.66 121.68 2oex n ARG 475 Ca 0.17 0.22 0.15 0.00 -1.93 0.00 0.00 57.85 56.46 2oex n ARG 475 Cb 0.18 -1.50 0.87 0.00 -1.16 0.00 0.00 32.46 30.85 2oex n ARG 475 CO 0.00 0.00 0.00 0.11 -1.93 0.00 0.00 177.63 175.81 2oex h TRP 476 N 0.00 0.00 0.00 -1.55 5.08 -1.84 -1.33 115.95 116.31 2oex h TRP 476 Ca 0.00 0.00 -0.04 0.00 1.08 0.00 0.00 58.89 59.93 2oex h TRP 476 Cb 0.09 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.24 2oex h TRP 476 CO 0.00 0.00 -0.18 1.96 -1.28 0.00 0.00 178.44 178.94 2oex h GLN 477 N 0.00 0.00 -5.56 0.12 4.20 -1.91 -3.42 115.11 108.55 2oex h GLN 477 Ca 0.02 0.00 -0.63 0.00 0.06 0.00 0.00 58.65 58.10 2oex h GLN 477 Cb 0.11 0.00 -0.09 0.00 0.30 0.00 0.00 27.48 27.80 2oex h GLN 477 CO -0.00 0.18 -0.43 0.50 -0.67 0.00 0.00 178.83 178.41 2oex s ARG 478 N -4.31 3.83 0.32 1.46 3.52 -0.50 -5.08 118.95 118.20 2oex s ARG 478 Ca -0.03 -0.06 -0.29 0.00 -0.13 0.00 0.00 55.73 55.22 2oex s ARG 478 Cb 0.14 -3.29 -0.11 0.00 -1.56 0.00 0.00 34.95 30.13 2oex s ARG 478 CO 0.64 0.55 1.44 0.99 -0.81 0.00 0.00 175.30 178.11 2oex s THR 479 N -0.42 2.38 0.39 4.11 2.01 -1.26 -4.98 115.64 117.86 2oex s THR 479 Ca 0.14 0.36 -0.20 0.00 0.31 0.00 0.00 61.69 62.30 2oex s THR 479 Cb -0.12 -3.23 -0.10 0.00 0.01 0.00 0.00 72.50 69.05 2oex s THR 479 CO 0.03 0.08 0.90 -2.16 -0.69 0.00 0.00 174.62 172.78 2oex s PRO 480 N -1.42 4.21 0.39 4.92 0.05 -1.26 -4.93 135.00 136.96 2oex s PRO 480 Ca 0.54 1.03 0.16 0.00 0.05 0.00 0.00 61.00 62.79 2oex s PRO 480 Cb -0.44 -2.31 1.04 0.00 0.05 0.00 0.00 34.50 32.84 2oex s PRO 480 CO 0.54 0.05 1.79 0.77 0.05 0.00 0.00 177.00 180.20 2oex h SER 481 N 2.14 0.49 -0.96 6.66 0.02 -1.94 -0.04 113.55 119.92 2oex h SER 481 Ca -0.49 0.08 0.25 0.00 -0.84 0.00 0.00 61.79 60.79 2oex h SER 481 Cb 1.18 -0.01 -0.18 0.00 0.14 0.00 0.00 62.40 63.54 2oex h SER 481 CO 0.62 0.14 0.01 -1.13 -1.14 0.00 0.00 176.83 175.33 2oex h ASN 482 N 0.46 -0.49 -0.24 3.07 -1.24 -1.92 0.20 115.58 115.41 2oex h ASN 482 Ca 0.56 0.27 -0.15 0.00 0.71 0.00 0.00 56.30 57.70 2oex h ASN 482 Cb 1.33 0.48 -0.00 0.00 0.73 0.00 0.00 38.32 40.85 2oex h ASN 482 CO -0.28 -0.33 -0.42 -0.33 -1.29 0.00 0.00 177.43 174.78 2oex h GLU 483 N 0.02 0.72 -0.73 6.67 4.39 -1.37 -3.09 114.58 121.18 2oex h GLU 483 Ca 0.57 -0.44 0.21 0.00 0.34 0.00 0.00 59.36 60.03 2oex h GLU 483 Cb 1.13 0.05 -0.03 0.00 -0.10 0.00 0.00 28.75 29.79 2oex h GLU 483 CO -0.90 1.07 0.52 1.25 -1.16 0.00 0.00 179.01 179.79 2oex h LEU 484 N 0.44 0.04 -1.55 1.33 7.12 -0.98 -2.27 115.31 119.44 2oex h LEU 484 Ca 0.02 0.00 0.00 0.00 0.13 0.00 0.00 57.88 58.03 2oex h LEU 484 Cb 1.02 -0.00 0.00 0.00 -0.53 0.00 0.00 40.66 41.14 2oex h LEU 484 CO 0.10 0.02 -0.15 -1.22 -0.13 0.00 0.00 178.44 177.06 2oex n TYR 485 N -4.34 0.00 -0.26 1.25 4.01 -0.91 -4.47 117.16 112.44 2oex n TYR 485 Ca 0.15 0.00 -0.02 0.00 -0.16 0.00 0.00 57.90 57.87 2oex n TYR 485 Cb 0.78 0.00 0.05 0.00 -0.31 0.00 0.00 39.34 39.85 2oex n TYR 485 CO 0.00 0.00 0.00 0.87 -0.46 0.00 0.00 176.86 177.27 2oex h LYS 486 N 3.60 -0.07 -0.01 -0.72 6.56 -1.43 -1.56 116.57 122.94 2oex h LYS 486 Ca 0.00 0.00 -0.14 0.00 -1.06 0.00 0.00 60.65 59.46 2oex h LYS 486 Cb 0.84 0.02 -0.02 0.00 -0.57 0.00 0.00 32.23 32.50 2oex h LYS 486 CO 0.00 -0.05 -0.64 -1.35 -2.06 0.00 0.00 179.45 175.36 2oex h PRO 487 N -0.07 0.02 -0.59 3.15 0.11 -1.82 -1.78 132.00 131.01 2oex h PRO 487 Ca 0.31 -0.02 -0.08 0.00 0.11 0.00 0.00 66.00 66.32 2oex h PRO 487 Cb 0.57 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.66 2oex h PRO 487 CO -0.78 0.65 0.08 -0.07 -0.21 0.00 0.00 178.00 177.67 2oex h LEU 488 N 0.01 0.96 -0.40 2.35 3.38 -1.74 -0.15 115.31 119.72 2oex h LEU 488 Ca -0.01 -0.27 -0.18 0.00 0.09 0.00 0.00 57.88 57.51 2oex h LEU 488 Cb 1.13 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.61 2oex h LEU 488 CO 0.08 0.99 -0.79 0.03 0.09 0.00 0.00 178.44 178.84 2oex h ARG 489 N 0.90 0.19 -0.08 1.13 3.08 -1.13 0.13 114.38 118.59 2oex h ARG 489 Ca 0.18 -0.18 -0.00 0.00 0.07 0.00 0.00 59.98 60.05 2oex h ARG 489 Cb 0.45 0.05 -0.00 0.00 0.08 0.00 0.00 29.97 30.54 2oex h ARG 489 CO 0.02 0.88 0.05 0.00 -1.07 0.00 0.00 179.97 179.85 2oex h ALA 490 N 1.06 0.11 -0.88 0.04 0.00 -1.13 0.15 119.26 118.61 2oex h ALA 490 Ca -0.03 -0.05 0.06 0.00 0.00 0.00 0.00 54.91 54.89 2oex h ALA 490 Cb 1.38 -0.03 -0.06 0.00 0.00 0.00 0.00 17.79 19.08 2oex h ALA 490 CO 0.12 -0.36 0.55 0.93 0.00 0.00 0.00 179.25 180.49 2oex h GLU 491 N 0.05 0.99 -0.32 0.00 5.08 -0.91 -2.56 114.58 116.91 2oex h GLU 491 Ca 0.03 -0.06 0.03 0.00 -1.00 0.00 0.00 59.36 58.36 2oex h GLU 491 Cb 0.07 -0.22 -0.03 0.00 0.50 0.00 0.00 28.75 29.06 2oex h GLU 491 CO -0.00 0.66 0.13 0.78 -1.00 0.00 0.00 179.01 179.57 2oex h GLY 492 N 1.02 0.41 1.43 -3.84 0.00 -0.26 -2.24 103.07 99.60 2oex h GLY 492 Ca 0.38 -0.08 -0.04 0.00 0.00 0.00 0.00 47.33 47.59 2oex h GLY 492 CO -0.16 0.05 0.13 -0.91 0.00 0.00 0.00 176.54 175.64 2oex h THR 493 N 0.27 1.20 0.00 4.70 1.35 -0.39 -1.65 112.91 118.40 2oex h THR 493 Ca 0.14 -0.72 -0.03 0.00 -0.55 0.00 0.00 66.41 65.25 2oex h THR 493 Cb 0.10 0.70 -0.00 0.00 -1.73 0.00 0.00 68.15 67.21 2oex h THR 493 CO -0.13 0.27 -0.14 0.78 -0.25 0.00 0.00 175.52 176.05 2oex h ASN 494 N 0.70 0.00 0.35 5.36 2.35 -1.08 -1.52 115.58 121.74 2oex h ASN 494 Ca 0.16 0.00 -0.25 0.00 -0.55 0.00 0.00 56.30 55.66 2oex h ASN 494 Cb 0.24 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.62 2oex h ASN 494 CO -0.00 0.14 -1.08 -0.26 -1.65 0.00 0.00 177.43 174.57 2oex h PHE 495 N 0.00 0.69 -0.35 1.19 0.05 -0.74 -2.40 116.94 115.37 2oex h PHE 495 Ca -0.00 -0.41 -0.07 0.00 3.82 0.00 0.00 57.97 61.30 2oex h PHE 495 Cb 0.26 -0.06 -0.02 0.00 2.00 0.00 0.00 35.95 38.13 2oex h PHE 495 CO 0.00 1.26 -0.08 -0.09 -0.18 0.00 0.00 178.31 179.22 2oex h ARG 496 N 0.21 0.58 -0.28 1.51 2.43 -0.99 -0.88 114.38 116.96 2oex h ARG 496 Ca -0.12 -0.16 -0.05 0.00 -0.81 0.00 0.00 59.98 58.84 2oex h ARG 496 Cb 1.75 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 31.22 2oex h ARG 496 CO 0.19 0.66 -0.02 1.15 -1.51 0.00 0.00 179.97 180.44 2oex h THR 497 N 0.54 1.27 -0.56 0.20 2.02 -1.27 -0.23 112.91 114.87 2oex h THR 497 Ca 0.10 -0.99 -0.06 0.00 0.77 0.00 0.00 66.41 66.23 2oex h THR 497 Cb 0.47 1.35 -0.02 0.00 -1.74 0.00 0.00 68.15 68.20 2oex h THR 497 CO 0.03 0.32 0.09 0.58 0.37 0.00 0.00 175.52 176.90 2oex h VAL 498 N 0.29 1.24 -0.29 3.16 2.07 -1.14 -0.97 116.25 120.62 2oex h VAL 498 Ca 0.08 -0.93 -0.17 0.00 0.82 0.00 0.00 66.70 66.49 2oex h VAL 498 Cb 0.47 0.71 -0.00 0.00 -1.52 0.00 0.00 31.29 30.95 2oex h VAL 498 CO 0.02 0.34 -0.49 -0.07 0.02 0.00 0.00 177.57 177.39 2oex h LEU 499 N 0.85 0.87 -0.56 2.57 3.38 -1.04 -1.33 115.31 120.05 2oex h LEU 499 Ca 0.18 -0.44 -0.16 0.00 0.09 0.00 0.00 57.88 57.55 2oex h LEU 499 Cb 0.38 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 2oex h LEU 499 CO 0.01 1.21 -0.65 0.44 0.09 0.00 0.00 178.44 179.54 2oex h ASP 500 N 0.63 0.31 0.25 -0.43 3.32 -0.82 -1.90 116.42 117.78 2oex h ASP 500 Ca 0.03 -0.19 -0.08 0.00 0.02 0.00 0.00 57.03 56.81 2oex h ASP 500 Cb 1.07 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 40.52 2oex h ASP 500 CO 0.11 0.88 -0.33 0.11 -1.72 0.00 0.00 179.24 178.28 2oex h LYS 501 N 0.19 0.13 -0.22 3.56 1.79 -1.10 -2.56 116.57 118.37 2oex h LYS 501 Ca -0.01 -0.05 -0.08 0.00 -2.18 0.00 0.00 60.65 58.33 2oex h LYS 501 Cb 1.18 -0.01 -0.00 0.00 -1.58 0.00 0.00 32.23 31.82 2oex h LYS 501 CO 0.10 0.45 -0.18 0.00 -1.08 0.00 0.00 179.45 178.75 2oex h ALA 502 N 1.55 0.32 -1.00 3.86 0.00 -0.68 -2.49 119.26 120.82 2oex h ALA 502 Ca 0.01 -0.34 0.10 0.00 0.00 0.00 0.00 54.91 54.68 2oex h ALA 502 Cb 0.65 -0.07 -0.08 0.00 0.00 0.00 0.00 17.79 18.29 2oex h ALA 502 CO 0.05 0.23 0.64 0.28 0.00 0.00 0.00 179.25 180.45 2oex h VAL 503 N 0.20 0.98 -0.00 0.00 2.07 -1.29 0.18 116.25 118.39 2oex h VAL 503 Ca 0.04 -0.36 -0.00 0.00 0.82 0.00 0.00 66.70 67.20 2oex h VAL 503 Cb 0.71 -0.16 0.00 0.00 -1.52 0.00 0.00 31.29 30.32 2oex h VAL 503 CO 0.05 0.19 -0.00 -0.61 0.02 0.00 0.00 177.57 177.22 2oex h GLN 504 N 1.05 0.00 -0.39 1.57 4.15 -1.34 0.37 115.11 120.52 2oex h GLN 504 Ca 0.47 -0.00 0.08 0.00 0.77 0.00 0.00 58.65 59.97 2oex h GLN 504 Cb 0.38 0.00 -0.09 0.00 0.21 0.00 0.00 27.48 27.98 2oex h GLN 504 CO -0.23 0.58 -0.20 0.00 -1.93 0.00 0.00 178.83 177.05 2oex h ALA 505 N 0.42 0.08 -0.99 3.38 0.00 -1.34 0.14 119.26 120.94 2oex h ALA 505 Ca 0.00 0.14 0.29 0.00 0.00 0.00 0.00 54.91 55.33 2oex h ALA 505 Cb 0.58 0.48 -0.14 0.00 0.00 0.00 0.00 17.79 18.72 2oex h ALA 505 CO 0.00 -0.57 0.56 -0.44 0.00 0.00 0.00 179.25 178.79 2oex h ASP 506 N -0.13 0.54 0.71 0.00 5.19 -0.80 -0.63 116.42 121.30 2oex h ASP 506 Ca 0.19 0.17 -0.03 0.00 -0.62 0.00 0.00 57.03 56.74 2oex h ASP 506 Cb 0.43 0.11 0.01 0.00 0.18 0.00 0.00 39.33 40.06 2oex h ASP 506 CO -0.48 -0.05 -0.34 1.23 -3.12 0.00 0.00 179.24 176.48 2oex h GLY 507 N 0.41 -1.00 0.97 2.75 0.00 0.15 -2.39 103.07 103.97 2oex h GLY 507 Ca 0.69 0.37 -0.01 0.00 0.00 0.00 0.00 47.33 48.38 2oex h GLY 507 CO -0.56 -0.36 0.24 0.06 0.00 0.00 0.00 176.54 175.91 2oex h GLN 508 N -1.05 0.59 -0.98 4.80 3.07 -1.12 -0.62 115.11 119.79 2oex h GLN 508 Ca -0.10 -0.06 0.20 0.00 0.09 0.00 0.00 58.65 58.78 2oex h GLN 508 Cb 0.75 -0.12 -0.09 0.00 0.08 0.00 0.00 27.48 28.11 2oex h GLN 508 CO 0.16 0.46 0.61 -0.24 0.09 0.00 0.00 178.83 179.92 2oex h VAL 509 N 0.55 0.69 0.14 1.86 3.04 -1.16 0.20 116.25 121.58 2oex h VAL 509 Ca 0.15 -0.21 -0.01 0.00 -1.01 0.00 0.00 66.70 65.62 2oex h VAL 509 Cb 0.04 0.01 0.00 0.00 -2.01 0.00 0.00 31.29 29.34 2oex h VAL 509 CO -0.02 0.11 -0.07 0.50 -1.01 0.00 0.00 177.57 177.08 2oex h LYS 510 N 0.62 -0.18 -0.36 4.17 3.64 -0.84 -2.38 116.57 121.24 2oex h LYS 510 Ca 0.54 0.01 0.07 0.00 -1.27 0.00 0.00 60.65 60.00 2oex h LYS 510 Cb 1.03 0.04 -0.09 0.00 -0.41 0.00 0.00 32.23 32.81 2oex h LYS 510 CO -0.30 0.23 -0.37 1.49 -2.27 0.00 0.00 179.45 178.23 2oex h GLU 511 N -0.67 -0.30 0.08 1.90 4.57 0.43 -0.52 114.58 120.08 2oex h GLU 511 Ca -0.02 0.02 0.02 0.00 -1.18 0.00 0.00 59.36 58.20 2oex h GLU 511 Cb 0.50 0.07 -0.05 0.00 -0.16 0.00 0.00 28.75 29.11 2oex h GLU 511 CO 0.03 -0.20 -0.51 0.00 -1.18 0.00 0.00 179.01 177.15 2oex h TYR 513 N -0.71 -0.81 -0.01 0.00 3.20 -0.83 -1.64 116.97 116.17 2oex h TYR 513 Ca 0.01 0.07 0.00 0.00 3.14 0.00 0.00 58.73 61.95 2oex h TYR 513 Cb 0.74 0.45 -0.00 0.00 1.54 0.00 0.00 36.73 39.46 2oex h TYR 513 CO -0.45 -0.37 0.01 1.96 -1.64 0.00 0.00 178.16 177.67 2oex h GLN 514 N -0.11 0.00 0.00 1.82 4.20 -0.96 0.80 115.11 120.85 2oex h GLN 514 Ca 0.27 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.98 2oex h GLN 514 Cb 0.55 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.33 2oex h GLN 514 CO -0.71 0.00 0.00 0.66 -0.67 0.00 0.00 178.83 178.11 2oex h SER 515 N 0.00 0.00 0.00 1.46 4.64 -1.12 -3.34 113.55 115.20 2oex h SER 515 Ca 0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 2oex h SER 515 Cb 0.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.12 2oex h SER 515 CO -0.00 0.00 -1.07 1.41 -0.87 0.00 0.00 176.83 176.30 2oex n HIS 516 N -2.76 0.00 -0.27 4.77 8.25 -0.19 -4.71 115.22 120.31 2oex n HIS 516 Ca 0.05 0.00 0.08 0.00 -0.26 0.00 0.00 57.72 57.58 2oex n HIS 516 Cb 0.49 -0.14 0.21 0.00 1.12 0.00 0.00 29.99 31.67 2oex n HIS 516 CO 0.00 0.00 0.00 -0.09 0.64 0.00 0.00 176.34 176.89 2oex h ARG 517 N 0.00 0.23 -0.47 -0.41 2.43 -1.05 -2.66 114.38 112.45 2oex h ARG 517 Ca 0.00 -0.01 -0.14 0.00 -0.81 0.00 0.00 59.98 59.02 2oex h ARG 517 Cb 0.40 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.88 2oex h ARG 517 CO 0.00 0.15 -0.24 -0.44 -1.51 0.00 0.00 179.97 177.93 2oex h ASP 518 N 0.24 1.03 0.38 -3.80 5.19 -1.84 -1.00 116.42 116.62 2oex h ASP 518 Ca 0.46 -0.40 -0.14 0.00 -0.62 0.00 0.00 57.03 56.32 2oex h ASP 518 Cb 0.83 -0.28 -0.01 0.00 0.18 0.00 0.00 39.33 40.04 2oex h ASP 518 CO -0.57 1.21 -0.59 0.74 -3.12 0.00 0.00 179.24 176.91 2oex h THR 519 N 0.85 1.38 -0.29 0.35 2.02 -1.86 -1.07 112.91 114.31 2oex h THR 519 Ca 0.10 -1.95 -0.10 0.00 0.77 0.00 0.00 66.41 65.24 2oex h THR 519 Cb 0.82 1.99 -0.01 0.00 -1.74 0.00 0.00 68.15 69.21 2oex h THR 519 CO 0.07 0.57 -0.23 0.40 0.37 0.00 0.00 175.52 176.71 2oex h ILE 520 N 0.16 1.26 -0.44 3.11 2.04 -1.11 0.91 117.51 123.45 2oex h ILE 520 Ca -0.00 -1.25 -0.10 0.00 1.00 0.00 0.00 64.86 64.51 2oex h ILE 520 Cb 1.08 1.29 -0.02 0.00 -0.74 0.00 0.00 36.82 38.43 2oex h ILE 520 CO 0.09 0.40 -0.13 0.58 0.00 0.00 0.00 178.15 179.09 2oex h VAL 521 N 0.48 1.26 -0.13 1.67 2.07 -0.61 -1.68 116.25 119.31 2oex h VAL 521 Ca 0.07 -1.21 0.01 0.00 0.82 0.00 0.00 66.70 66.40 2oex h VAL 521 Cb 0.66 1.06 -0.01 0.00 -1.52 0.00 0.00 31.29 31.47 2oex h VAL 521 CO 0.05 0.41 0.06 0.25 0.02 0.00 0.00 177.57 178.36 2oex h LEU 522 N 0.73 0.08 -2.41 2.57 6.46 -0.78 -2.58 115.31 119.38 2oex h LEU 522 Ca 0.12 0.01 0.02 0.00 -0.12 0.00 0.00 57.88 57.91 2oex h LEU 522 Cb 0.62 -0.01 -0.00 0.00 -0.73 0.00 0.00 40.66 40.54 2oex h LEU 522 CO 0.04 0.07 0.08 0.25 -0.62 0.00 0.00 178.44 178.26 2oex h LEU 523 N 0.13 0.00 0.00 2.25 6.46 -0.06 -0.55 115.31 123.54 2oex h LEU 523 Ca 0.05 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.81 2oex h LEU 523 Cb 0.02 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 39.95 2oex h LEU 523 CO -0.05 0.00 -0.43 0.00 -0.62 0.00 0.00 178.44 177.35 2oex s LYS 525 N -3.13 2.69 0.44 0.00 -0.14 -0.21 -4.92 119.74 114.47 2oex s LYS 525 Ca 0.08 1.82 -0.23 0.00 -1.36 0.00 0.00 55.97 56.28 2oex s LYS 525 Cb 0.14 -1.89 -0.11 0.00 -1.68 0.00 0.00 37.83 34.28 2oex s LYS 525 CO 0.68 -1.42 0.72 -2.30 -0.76 0.00 0.00 175.35 172.27 2oex n PRO 526 N -1.97 0.84 -0.26 -1.68 -0.02 -1.26 -4.48 135.00 126.16 2oex n PRO 526 Ca 0.14 0.30 0.07 0.00 -2.02 0.00 0.00 63.50 61.99 2oex n PRO 526 Cb 0.50 -1.73 0.20 0.00 -0.02 0.00 0.00 33.50 32.46 2oex n PRO 526 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 2oex h GLU 527 N 1.00 0.32 -0.73 -0.52 4.22 -1.97 0.71 114.58 117.60 2oex h GLU 527 Ca -0.42 -0.02 0.05 0.00 0.08 0.00 0.00 59.36 59.05 2oex h GLU 527 Cb 1.38 -0.07 -0.05 0.00 0.50 0.00 0.00 28.75 30.50 2oex h GLU 527 CO 0.53 0.21 0.44 -1.35 -2.18 0.00 0.00 179.01 176.66 2oex h PRO 528 N 0.33 0.79 -0.19 0.92 0.11 -1.99 0.11 132.00 132.07 2oex h PRO 528 Ca 0.44 -0.05 -0.02 0.00 0.11 0.00 0.00 66.00 66.48 2oex h PRO 528 Cb 0.76 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 31.68 2oex h PRO 528 CO -0.50 0.53 0.03 1.49 -0.21 0.00 0.00 178.00 179.34 2oex h GLU 529 N 0.82 0.32 -0.26 1.05 4.81 -1.26 -1.50 114.58 118.56 2oex h GLU 529 Ca 0.32 -0.09 0.06 0.00 -0.13 0.00 0.00 59.36 59.52 2oex h GLU 529 Cb 0.13 -0.04 -0.08 0.00 0.63 0.00 0.00 28.75 29.40 2oex h GLU 529 CO -0.16 0.49 -0.31 1.25 -0.73 0.00 0.00 179.01 179.55 2oex h LEU 530 N 0.10 -1.01 -1.50 1.64 5.85 -0.97 -1.80 115.31 117.62 2oex h LEU 530 Ca 0.06 0.16 -0.04 0.00 0.84 0.00 0.00 57.88 58.90 2oex h LEU 530 Cb 0.33 0.45 -0.01 0.00 0.37 0.00 0.00 40.66 41.80 2oex h LEU 530 CO 0.00 -0.33 -0.10 -1.13 -0.34 0.00 0.00 178.44 176.54 2oex h ASN 531 N -0.31 0.18 0.52 1.25 -1.24 -0.67 -1.22 115.58 114.09 2oex h ASN 531 Ca 0.13 -0.03 0.00 0.00 0.71 0.00 0.00 56.30 57.11 2oex h ASN 531 Cb 0.53 -0.05 0.00 0.00 0.73 0.00 0.00 38.32 39.53 2oex h ASN 531 CO -0.44 0.31 0.00 0.00 -1.29 0.00 0.00 177.43 176.02 2oex n ALA 532 N -2.50 1.94 0.83 1.57 0.00 -0.58 -2.74 120.51 119.04 2oex n ALA 532 Ca -0.01 -0.08 0.09 0.00 0.00 0.00 0.00 53.44 53.44 2oex n ALA 532 Cb 0.24 -1.31 -0.10 0.00 0.00 0.00 0.00 19.45 18.27 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 -1.40 4.32 -2.71 0.00 0.00 -0.47 -4.81 120.51 115.44 2oex n ALA 533 Ca 0.07 -0.51 -0.43 0.00 0.00 0.00 0.00 53.44 52.56 2oex n ALA 533 Cb 0.19 -0.66 -0.06 0.00 0.00 0.00 0.00 19.45 18.92 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 -2.74 4.72 0.22 0.00 -1.09 -1.11 -5.03 121.20 116.18 2oex s ILE 534 Ca 0.06 -0.20 -0.30 0.00 -2.23 0.00 0.00 60.65 57.98 2oex s ILE 534 Cb 0.14 -4.36 -0.16 0.00 -1.58 0.00 0.00 42.46 36.50 2oex s ILE 534 CO 0.75 -0.88 0.88 -2.65 -1.23 0.00 0.00 174.94 171.81 2oex n PRO 535 N 6.57 0.81 -2.85 2.79 -0.02 -1.26 -4.93 135.00 136.10 2oex n PRO 535 Ca -0.04 0.28 -0.30 0.00 -2.02 0.00 0.00 63.50 61.42 2oex n PRO 535 Cb 0.46 -1.57 -0.03 0.00 -0.02 0.00 0.00 33.50 32.34 2oex n PRO 535 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 2oex s SER 536 N -0.56 6.54 0.37 2.55 1.04 -1.26 -4.48 113.70 117.89 2oex s SER 536 Ca 0.65 1.16 -0.07 0.00 0.48 0.00 0.00 55.95 58.16 2oex s SER 536 Cb -0.83 -2.33 0.03 0.00 0.10 0.00 0.00 66.02 62.98 2oex s SER 536 CO 0.57 -0.40 0.61 0.00 0.98 0.00 0.00 173.24 175.00 2oex n ALA 537 N -1.26 -0.94 -1.81 5.32 0.00 -0.18 -4.84 120.51 116.80 2oex n ALA 537 Ca 0.03 -1.46 -0.42 0.00 0.00 0.00 0.00 53.44 51.59 2oex n ALA 537 Cb 0.54 1.17 -0.03 0.00 0.00 0.00 0.00 19.45 21.13 2oex n ALA 537 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 2oex s ASN 538 N -3.11 6.47 0.60 0.00 -0.87 -1.26 -4.58 114.94 112.19 2oex s ASN 538 Ca 0.23 2.75 -0.19 0.00 -1.57 0.00 0.00 52.86 54.08 2oex s ASN 538 Cb -0.03 -2.59 -0.03 0.00 -0.02 0.00 0.00 41.25 38.58 2oex s ASN 538 CO 0.17 -0.92 1.29 -2.16 -2.57 0.00 0.00 177.10 172.91 2oex s PRO 539 N 1.42 2.84 -0.31 -0.60 0.04 -1.26 -4.87 135.00 132.26 2oex s PRO 539 Ca 0.74 2.05 -0.29 0.00 0.04 0.00 0.00 61.00 63.54 2oex s PRO 539 Cb -0.47 -1.99 -0.02 0.00 0.04 0.00 0.00 34.50 32.06 2oex s PRO 539 CO 0.32 -1.37 1.70 0.00 0.04 0.00 0.00 177.00 177.69 2oex s ALA 540 N -1.42 3.01 0.14 8.56 0.00 -1.26 -4.89 121.76 125.91 2oex s ALA 540 Ca 0.78 0.28 0.09 0.00 0.00 0.00 0.00 51.96 53.11 2oex s ALA 540 Cb -0.36 -3.96 -0.00 0.00 0.00 0.00 0.00 23.12 18.79 2oex s ALA 540 CO 0.40 -2.40 1.40 0.87 0.00 0.00 0.00 175.76 176.03 2oex h LYS 541 N 11.99 0.00 -2.04 0.00 1.57 -1.93 -3.42 116.57 122.75 2oex h LYS 541 Ca -0.33 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.44 2oex h LYS 541 Cb 1.16 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.46 2oex h LYS 541 CO 1.03 0.83 -0.01 2.41 -0.57 0.00 0.00 179.45 183.14 2oex n THR 542 N -3.47 1.40 -2.66 -0.16 -1.04 -1.26 -5.01 114.28 102.08 2oex n THR 542 Ca -0.00 -0.40 -0.00 0.00 -2.04 0.00 0.00 64.05 61.60 2oex n THR 542 Cb 0.82 -1.38 -0.00 0.00 -1.82 0.00 0.00 70.33 67.94 2oex n THR 542 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2oex n GLN 544 N 1.77 -3.49 -2.61 -2.82 6.02 -1.26 -4.57 117.38 110.43 2oex n GLN 544 Ca 0.03 2.78 -0.07 0.00 -0.01 0.00 0.00 57.00 59.73 2oex n GLN 544 Cb 0.36 -5.22 0.04 0.00 1.02 0.00 0.00 30.24 26.44 2oex n GLN 544 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2oex n GLY 545 N 0.76 0.09 3.87 1.08 0.00 -1.26 -5.08 105.19 104.66 2oex n GLY 545 Ca -0.03 -0.22 -0.26 0.00 0.00 0.00 0.00 46.02 45.51 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 -3.58 4.63 0.02 1.61 1.04 -1.26 -5.02 113.70 111.15 2oex s SER 546 Ca 0.00 -1.19 -0.25 0.00 0.48 0.00 0.00 55.95 55.00 2oex s SER 546 Cb -0.00 0.20 -0.17 0.00 0.10 0.00 0.00 66.02 66.14 2oex s SER 546 CO 0.31 -0.97 1.38 -0.08 0.98 0.00 0.00 173.24 174.86 2oex h GLU 547 N 0.89 -0.23 -0.60 4.02 4.22 -1.98 -2.21 114.58 118.70 2oex h GLU 547 Ca -0.38 0.02 0.04 0.00 0.08 0.00 0.00 59.36 59.12 2oex h GLU 547 Cb 1.29 0.05 -0.03 0.00 0.50 0.00 0.00 28.75 30.56 2oex h GLU 547 CO 0.59 0.06 0.39 -0.39 -2.18 0.00 0.00 179.01 177.49 2oex h VAL 548 N -0.53 1.05 -0.14 0.32 -1.51 -1.97 -0.82 116.25 112.64 2oex h VAL 548 Ca -0.02 -0.22 -0.10 0.00 -1.23 0.00 0.00 66.70 65.12 2oex h VAL 548 Cb 0.40 0.34 0.00 0.00 -2.13 0.00 0.00 31.29 29.90 2oex h VAL 548 CO 0.04 0.12 -0.29 0.58 -1.23 0.00 0.00 177.57 176.79 2oex h VAL 549 N 0.65 1.36 -0.90 7.19 2.07 -1.95 -1.08 116.25 123.61 2oex h VAL 549 Ca 0.25 -1.55 0.13 0.00 0.82 0.00 0.00 66.70 66.35 2oex h VAL 549 Cb 0.16 2.00 -0.09 0.00 -1.52 0.00 0.00 31.29 31.84 2oex h VAL 549 CO -0.07 0.46 0.52 0.78 0.02 0.00 0.00 177.57 179.28 2oex h ASN 550 N 0.06 0.71 0.16 0.57 2.35 -0.93 0.16 115.58 118.66 2oex h ASN 550 Ca 0.00 0.07 -0.01 0.00 -0.55 0.00 0.00 56.30 55.81 2oex h ASN 550 Cb 0.88 -0.07 0.00 0.00 0.05 0.00 0.00 38.32 39.19 2oex h ASN 550 CO 0.06 0.35 -0.08 0.58 -1.65 0.00 0.00 177.43 176.70 2oex h VAL 551 N 0.79 0.00 -0.92 2.81 2.07 -1.05 -2.77 116.25 117.18 2oex h VAL 551 Ca 0.46 -0.04 0.30 0.00 0.82 0.00 0.00 66.70 68.25 2oex h VAL 551 Cb 0.54 0.00 -0.17 0.00 -1.52 0.00 0.00 31.29 30.14 2oex h VAL 551 CO -0.30 0.00 0.20 0.18 0.02 0.00 0.00 177.57 177.66 2oex n LEU 552 N -2.69 0.05 0.03 2.57 4.32 -0.42 -1.16 117.00 119.71 2oex n LEU 552 Ca -0.03 1.56 -0.10 0.00 -0.02 0.00 0.00 56.01 57.42 2oex n LEU 552 Cb 0.08 -0.64 -0.04 0.00 -1.62 0.00 0.00 43.42 41.21 2oex n LEU 552 CO 0.06 -1.64 0.77 0.11 -1.22 0.00 0.00 177.39 175.47 2oex h LYS 553 N 0.00 -0.19 -0.02 3.23 1.57 -0.84 0.25 116.57 120.57 2oex h LYS 553 Ca 0.64 0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 59.43 2oex h LYS 553 Cb 1.50 0.04 -0.00 0.00 0.08 0.00 0.00 32.23 33.85 2oex h LYS 553 CO -0.81 -0.13 -0.02 0.66 -0.57 0.00 0.00 179.45 178.58 2oex h SER 554 N -0.20 0.05 -0.87 0.86 4.64 -0.87 -1.40 113.55 115.76 2oex h SER 554 Ca 0.07 -0.50 0.21 0.00 -0.47 0.00 0.00 61.79 61.10 2oex h SER 554 Cb 0.29 -0.01 -0.12 0.00 -0.31 0.00 0.00 62.40 62.25 2oex h SER 554 CO -0.18 0.54 0.35 -0.07 -0.87 0.00 0.00 176.83 176.60 2oex h LEU 555 N -0.44 0.26 -0.91 5.97 4.07 -1.06 0.24 115.31 123.44 2oex h LEU 555 Ca 0.00 0.16 -0.11 0.00 0.08 0.00 0.00 57.88 58.01 2oex h LEU 555 Cb 0.53 0.15 -0.02 0.00 1.08 0.00 0.00 40.66 42.40 2oex h LEU 555 CO 0.01 -0.02 -0.52 -0.07 -1.08 0.00 0.00 178.44 176.76 2oex h LEU 556 N 0.37 0.00 0.00 1.67 3.38 -0.37 -2.13 115.31 118.23 2oex h LEU 556 Ca 0.54 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 58.34 2oex h LEU 556 Cb 1.01 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.74 2oex h LEU 556 CO -0.54 0.52 -0.83 0.77 0.09 0.00 0.00 178.44 178.45 2oex h SER 557 N 0.00 0.00 -0.07 -0.43 4.64 0.49 -2.62 113.55 115.56 2oex h SER 557 Ca -0.01 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.28 2oex h SER 557 Cb 0.96 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.05 2oex h SER 557 CO 0.07 0.80 -0.10 0.78 -0.87 0.00 0.00 176.83 177.51 2oex h ASN 558 N 0.00 0.21 -0.18 4.97 2.35 -0.69 -2.36 115.58 119.89 2oex h ASN 558 Ca -0.02 -0.52 0.05 0.00 -0.55 0.00 0.00 56.30 55.26 2oex h ASN 558 Cb 1.63 -0.06 -0.01 0.00 0.05 0.00 0.00 38.32 39.93 2oex h ASN 558 CO 0.10 0.69 0.14 0.25 -1.65 0.00 0.00 177.43 176.96 2oex h LEU 559 N -0.26 0.00 -0.92 1.61 5.85 -1.44 -0.15 115.31 120.00 2oex h LEU 559 Ca 0.01 0.00 -0.11 0.00 0.84 0.00 0.00 57.88 58.62 2oex h LEU 559 Cb 0.64 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.66 2oex h LEU 559 CO 0.02 0.00 -0.52 -0.78 -0.34 0.00 0.00 178.44 176.83 2oex h ASP 560 N 0.00 0.00 0.55 1.25 3.58 -1.18 -2.49 116.42 118.13 2oex h ASP 560 Ca 0.08 0.00 -0.15 0.00 0.42 0.00 0.00 57.03 57.38 2oex h ASP 560 Cb 0.35 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 41.39 2oex h ASP 560 CO -0.00 0.52 -0.68 -0.33 -2.88 0.00 0.00 179.24 175.87 2oex h GLU 561 N 0.00 0.11 -0.17 0.28 5.08 -0.51 -1.92 114.58 117.45 2oex h GLU 561 Ca -0.01 -0.09 -0.03 0.00 -1.00 0.00 0.00 59.36 58.24 2oex h GLU 561 Cb 0.96 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.22 2oex h GLU 561 CO 0.07 0.74 0.01 0.28 -1.00 0.00 0.00 179.01 179.11 2oex h VAL 562 N 0.08 1.25 -0.17 3.13 2.07 -1.26 0.12 116.25 121.47 2oex h VAL 562 Ca -0.01 -0.81 -0.00 0.00 0.82 0.00 0.00 66.70 66.69 2oex h VAL 562 Cb 1.20 1.45 -0.01 0.00 -1.52 0.00 0.00 31.29 32.42 2oex h VAL 562 CO 0.10 0.24 0.10 0.11 0.02 0.00 0.00 177.57 178.14 2oex h LYS 563 N 0.05 0.24 0.00 1.57 1.57 -1.50 -2.41 116.57 116.10 2oex h LYS 563 Ca 0.05 -0.03 -0.08 0.00 -1.87 0.00 0.00 60.65 58.72 2oex h LYS 563 Cb 0.36 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.61 2oex h LYS 563 CO 0.01 0.23 -0.40 0.87 -0.57 0.00 0.00 179.45 179.59 2oex h LYS 564 N 0.18 0.00 -0.35 3.15 1.57 -1.24 -2.59 116.57 117.29 2oex h LYS 564 Ca 0.06 0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 58.70 2oex h LYS 564 Cb 0.06 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.36 2oex h LYS 564 CO -0.01 0.40 -0.35 1.49 -0.57 0.00 0.00 179.45 180.41 2oex h GLU 565 N 0.00 0.80 0.00 3.15 4.81 -0.66 -3.24 114.58 119.45 2oex h GLU 565 Ca -0.00 -0.39 0.00 0.00 -0.13 0.00 0.00 59.36 58.83 2oex h GLU 565 Cb 0.84 -0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.22 2oex h GLU 565 CO 0.05 1.02 0.04 0.54 -0.73 0.00 0.00 179.01 179.94 2oex n ARG 566 N -4.06 0.00 0.01 1.92 1.74 -0.91 -0.55 116.66 114.80 2oex n ARG 566 Ca -0.01 0.45 -0.11 0.00 -0.77 0.00 0.00 57.85 57.41 2oex n ARG 566 Cb 0.51 -1.54 -0.14 0.00 -1.02 0.00 0.00 32.46 30.27 2oex n ARG 566 CO 0.00 0.00 0.00 1.49 -1.52 0.00 0.00 177.63 177.60 2oex h GLU 567 N 0.00 0.07 -0.17 5.56 4.57 -1.69 -3.02 114.58 119.91 2oex h GLU 567 Ca 0.00 -0.12 -0.03 0.00 -1.18 0.00 0.00 59.36 58.03 2oex h GLU 567 Cb 0.08 0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 28.71 2oex h GLU 567 CO 0.00 0.77 -0.01 0.78 -1.18 0.00 0.00 179.01 179.38 2oex h GLY 568 N 2.84 0.33 0.99 1.92 0.00 -1.01 -2.32 103.07 105.82 2oex h GLY 568 Ca -0.24 -0.25 0.00 0.00 0.00 0.00 0.00 47.33 46.85 2oex h GLY 568 CO 0.11 0.23 0.21 1.41 0.00 0.00 0.00 176.54 178.49 2oex h LEU 569 N 0.04 0.36 -0.44 3.11 3.38 -1.64 0.16 115.31 120.29 2oex h LEU 569 Ca 0.05 -0.01 0.08 0.00 0.09 0.00 0.00 57.88 58.09 2oex h LEU 569 Cb 0.40 -0.09 -0.07 0.00 0.09 0.00 0.00 40.66 40.99 2oex h LEU 569 CO 0.01 0.26 0.02 -0.08 0.09 0.00 0.00 178.44 178.75 2oex h GLU 570 N 0.43 0.13 -0.21 1.13 4.81 -1.54 0.15 114.58 119.49 2oex h GLU 570 Ca 0.12 -0.01 -0.08 0.00 -0.13 0.00 0.00 59.36 59.26 2oex h GLU 570 Cb -0.04 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.29 2oex h GLU 570 CO -0.03 0.09 -0.23 -0.91 -0.73 0.00 0.00 179.01 177.20 2oex h ASN 571 N 0.14 0.37 -0.19 1.04 2.35 -0.88 -2.37 115.58 116.04 2oex h ASN 571 Ca 0.22 -0.11 -0.04 0.00 -0.55 0.00 0.00 56.30 55.82 2oex h ASN 571 Cb 0.30 -0.10 -0.01 0.00 0.05 0.00 0.00 38.32 38.57 2oex h ASN 571 CO -0.34 0.61 -0.02 0.44 -1.65 0.00 0.00 177.43 176.47 2oex h ASP 572 N 0.34 0.35 -0.90 5.81 3.32 0.30 -2.58 116.42 123.07 2oex h ASP 572 Ca 0.05 -0.34 0.04 0.00 0.02 0.00 0.00 57.03 56.80 2oex h ASP 572 Cb 0.59 -0.10 -0.05 0.00 0.22 0.00 0.00 39.33 39.99 2oex h ASP 572 CO 0.04 0.61 0.58 -0.07 -1.72 0.00 0.00 179.24 178.68 2oex h LEU 573 N 0.09 0.96 -0.35 1.55 3.38 -0.64 -2.90 115.31 117.40 2oex h LEU 573 Ca 0.05 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.02 2oex h LEU 573 Cb 0.44 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.97 2oex h LEU 573 CO 0.01 0.66 0.00 0.50 0.09 0.00 0.00 178.44 179.70 2oex h LYS 574 N 1.12 0.00 -0.02 1.13 3.64 -1.35 -3.28 116.57 117.81 2oex h LYS 574 Ca 0.36 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.74 2oex h LYS 574 Cb 0.01 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.83 2oex h LYS 574 CO -0.12 0.00 -0.00 -1.13 -2.27 0.00 0.00 179.45 175.93 2oex n SER 575 N -2.87 2.31 -4.63 4.20 3.41 -0.98 -4.89 113.62 110.18 2oex n SER 575 Ca 0.03 -1.66 -0.43 0.00 -0.26 0.00 0.00 58.87 56.56 2oex n SER 575 Cb 0.44 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.37 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 -1.32 3.32 -0.22 -3.33 1.01 -1.11 -4.96 120.40 113.80 2oex s VAL 576 Ca 0.18 0.36 0.02 0.00 0.00 0.00 0.00 61.98 62.54 2oex s VAL 576 Cb 0.13 -3.34 0.04 0.00 0.00 0.00 0.00 36.38 33.22 2oex s VAL 576 CO 0.20 -0.15 -0.14 0.21 0.00 0.00 0.00 175.10 175.22 2oex s ASN 577 N 5.58 3.76 0.01 3.32 2.47 -1.26 -5.09 114.94 123.73 2oex s ASN 577 Ca 0.84 -1.02 0.07 0.00 0.42 0.00 0.00 52.86 53.17 2oex s ASN 577 Cb -0.31 -1.46 -0.02 0.00 -1.45 0.00 0.00 41.25 38.00 2oex s ASN 577 CO 0.34 -0.11 -0.22 0.12 -3.72 0.00 0.00 177.10 173.51 2oex s PHE 578 N 1.23 1.98 0.26 0.43 5.36 -1.26 -5.27 117.98 120.71 2oex s PHE 578 Ca -0.02 -0.38 -0.19 0.00 -0.96 0.00 0.00 56.93 55.38 2oex s PHE 578 Cb -0.17 -1.23 -0.09 0.00 -0.34 0.00 0.00 43.02 41.20 2oex s PHE 578 CO -0.09 0.03 0.75 0.34 -1.46 0.00 0.00 175.22 174.79 2oex s ASP 579 N -0.83 6.99 0.00 6.13 2.15 -1.26 -5.10 116.67 124.75 2oex s ASP 579 Ca 0.09 1.41 0.00 0.00 0.43 0.00 0.00 52.55 54.48 2oex s ASP 579 Cb -0.09 -2.42 0.00 0.00 -0.30 0.00 0.00 42.92 40.11 2oex s ASP 579 CO 0.00 -0.05 0.00 0.41 -0.17 0.00 0.00 175.17 175.36 2oex n THR 581 N 0.37 0.00 -0.06 1.71 -1.04 -1.26 -4.08 114.28 109.92 2oex n THR 581 Ca -0.00 0.00 0.03 0.00 -2.04 0.00 0.00 64.05 62.04 2oex n THR 581 Cb 0.52 0.00 0.38 0.00 -1.82 0.00 0.00 70.33 69.41 2oex n THR 581 CO 0.00 0.00 0.00 0.28 -0.64 0.00 0.00 175.07 174.71 2oex h SER 582 N 0.00 0.57 0.05 8.00 0.02 -1.98 -0.68 113.55 119.53 2oex h SER 582 Ca 0.00 -0.01 -0.25 0.00 -0.84 0.00 0.00 61.79 60.69 2oex h SER 582 Cb 0.00 -0.14 0.01 0.00 0.14 0.00 0.00 62.40 62.41 2oex h SER 582 CO 0.00 0.41 -0.97 0.11 -1.14 0.00 0.00 176.83 175.24 2oex h LYS 583 N 0.67 0.65 -0.79 3.45 1.79 -2.00 -1.11 116.57 119.24 2oex h LYS 583 Ca 0.19 -0.66 -0.01 0.00 -2.18 0.00 0.00 60.65 57.99 2oex h LYS 583 Cb -0.05 0.18 -0.04 0.00 -1.58 0.00 0.00 32.23 30.75 2oex h LYS 583 CO -0.04 1.26 0.45 0.74 -1.08 0.00 0.00 179.45 180.77 2oex h PHE 584 N 0.39 1.07 -0.25 -1.35 0.04 -1.87 -1.07 116.94 113.90 2oex h PHE 584 Ca -0.10 -0.02 -0.02 0.00 2.80 0.00 0.00 57.97 60.63 2oex h PHE 584 Cb 1.61 -0.34 -0.01 0.00 2.20 0.00 0.00 35.95 39.40 2oex h PHE 584 CO 0.09 0.74 0.06 -0.07 -0.60 0.00 0.00 178.31 178.53 2oex h LEU 585 N 1.09 0.38 -0.05 1.54 3.38 -1.12 -2.35 115.31 118.18 2oex h LEU 585 Ca 0.28 -0.23 0.02 0.00 0.09 0.00 0.00 57.88 58.04 2oex h LEU 585 Cb 0.01 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 2oex h LEU 585 CO -0.05 0.51 -0.06 0.74 0.09 0.00 0.00 178.44 179.67 2oex h THR 586 N 0.23 0.82 -0.04 0.22 2.02 -0.91 0.23 112.91 115.47 2oex h THR 586 Ca 0.08 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.29 2oex h THR 586 Cb 0.28 0.82 -0.05 0.00 -1.74 0.00 0.00 68.15 67.46 2oex h THR 586 CO 0.00 0.00 -0.27 0.00 0.37 0.00 0.00 175.52 175.62 2oex h ALA 587 N 0.95 -0.35 -0.05 6.16 0.00 -1.21 -1.35 119.26 123.40 2oex h ALA 587 Ca 0.04 0.01 0.03 0.00 0.00 0.00 0.00 54.91 54.98 2oex h ALA 587 Cb 0.15 0.50 -0.03 0.00 0.00 0.00 0.00 17.79 18.40 2oex h ALA 587 CO -0.10 -0.77 -0.11 1.25 0.00 0.00 0.00 179.25 179.53 2oex h LEU 588 N -0.39 -0.32 -1.87 0.00 5.85 -1.11 0.36 115.31 117.83 2oex h LEU 588 Ca 0.07 0.06 0.19 0.00 0.84 0.00 0.00 57.88 59.04 2oex h LEU 588 Cb 0.50 0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.65 2oex h LEU 588 CO -0.27 -0.15 0.61 0.00 -0.34 0.00 0.00 178.44 178.30 2oex h ALA 589 N 0.87 2.44 0.00 1.25 0.00 -0.26 -0.62 119.26 122.94 2oex h ALA 589 Ca 0.06 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2oex h ALA 589 Cb 0.23 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.07 2oex h ALA 589 CO -0.15 -0.94 -0.35 1.04 0.00 0.00 0.00 179.25 178.86 2oex n GLN 590 N -3.80 0.24 0.04 0.00 6.02 -0.13 -4.69 117.38 115.07 2oex n GLN 590 Ca 0.13 0.28 0.12 0.00 -0.01 0.00 0.00 57.00 57.53 2oex n GLN 590 Cb 0.85 -1.13 0.29 0.00 1.02 0.00 0.00 30.24 31.26 2oex n GLN 590 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 2oex n ASP 591 N -3.46 0.55 0.00 1.08 2.03 -0.07 -4.94 116.55 111.74 2oex n ASP 591 Ca -0.05 0.12 0.00 0.00 0.52 0.00 0.00 54.79 55.38 2oex n ASP 591 Cb 0.18 -0.02 0.00 0.00 -0.72 0.00 0.00 41.12 40.56 2oex n ASP 591 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2oex n GLY 592 N 1.41 0.54 3.06 0.27 0.00 -0.24 -5.00 105.19 105.22 2oex n GLY 592 Ca 0.05 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.97 2oex n GLY 592 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2oex s VAL 593 N -2.30 0.12 -0.24 1.61 0.11 -1.26 -5.02 120.40 113.41 2oex s VAL 593 Ca 0.00 -0.98 -0.02 0.00 -2.93 0.00 0.00 61.98 58.04 2oex s VAL 593 Cb 0.00 -0.59 0.02 0.00 -1.53 0.00 0.00 36.38 34.28 2oex s VAL 593 CO 0.00 -0.54 -0.06 -0.63 -3.33 0.00 0.00 175.10 170.54 2oex s ILE 594 N -1.97 2.97 -1.06 7.04 1.01 -1.26 -4.26 121.20 123.67 2oex s ILE 594 Ca -0.11 -0.88 -0.13 0.00 0.00 0.00 0.00 60.65 59.54 2oex s ILE 594 Cb -0.05 -2.45 0.21 0.00 0.01 0.00 0.00 42.46 40.18 2oex s ILE 594 CO -0.02 0.28 1.14 0.21 0.00 0.00 0.00 174.94 176.55 2oex s ASN 595 N 1.37 7.04 0.26 3.58 3.84 -1.26 -4.92 114.94 124.84 2oex s ASN 595 Ca 0.02 -3.01 -0.02 0.00 0.21 0.00 0.00 52.86 50.06 2oex s ASN 595 Cb -0.16 -2.30 0.52 0.00 -0.55 0.00 0.00 41.25 38.76 2oex s ASN 595 CO -0.05 -0.60 1.73 -0.08 -2.79 0.00 0.00 177.10 175.32 2oex h GLU 596 N 7.36 0.48 0.48 0.43 4.22 -1.96 -2.80 114.58 122.80 2oex h GLU 596 Ca 0.20 -0.03 -0.02 0.00 0.08 0.00 0.00 59.36 59.59 2oex h GLU 596 Cb 0.93 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.08 2oex h GLU 596 CO 1.05 0.32 -0.23 1.49 -2.18 0.00 0.00 179.01 179.45 2oex h GLU 597 N 0.49 -0.62 -0.10 1.92 4.81 -1.97 -1.57 114.58 117.53 2oex h GLU 597 Ca 0.45 0.04 -0.08 0.00 -0.13 0.00 0.00 59.36 59.64 2oex h GLU 597 Cb 0.69 0.14 -0.01 0.00 0.63 0.00 0.00 28.75 30.20 2oex h GLU 597 CO -0.41 -0.34 -0.32 0.00 -0.73 0.00 0.00 179.01 177.22 2oex h ALA 598 N -0.41 1.28 0.12 2.92 0.00 -1.98 -2.07 119.26 119.12 2oex h ALA 598 Ca -0.07 -0.34 -0.01 0.00 0.00 0.00 0.00 54.91 54.50 2oex h ALA 598 Cb 0.57 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.28 2oex h ALA 598 CO 0.11 0.50 -0.06 1.25 0.00 0.00 0.00 179.25 181.05 2oex h LEU 599 N 0.18 -0.14 0.51 0.00 6.46 -1.46 -2.53 115.31 118.33 2oex h LEU 599 Ca 0.02 -0.30 -0.03 0.00 -0.12 0.00 0.00 57.88 57.46 2oex h LEU 599 Cb 0.65 0.04 0.01 0.00 -0.73 0.00 0.00 40.66 40.62 2oex h LEU 599 CO 0.05 0.24 -0.25 0.28 -0.62 0.00 0.00 178.44 178.14 2oex h SER 600 N -0.53 -0.58 -1.02 1.25 0.02 -1.17 -2.39 113.55 109.13 2oex h SER 600 Ca -0.02 -0.04 0.29 0.00 -0.84 0.00 0.00 61.79 61.18 2oex h SER 600 Cb 0.43 0.15 -0.05 0.00 0.14 0.00 0.00 62.40 63.07 2oex h SER 600 CO 0.03 -0.31 0.72 0.58 -1.14 0.00 0.00 176.83 176.70 2oex h VAL 601 N -0.84 0.51 0.15 2.27 2.07 -1.48 0.26 116.25 119.19 2oex h VAL 601 Ca -0.07 -0.02 -0.01 0.00 0.82 0.00 0.00 66.70 67.42 2oex h VAL 601 Cb 0.59 0.43 0.00 0.00 -1.52 0.00 0.00 31.29 30.79 2oex h VAL 601 CO 0.12 0.01 -0.07 0.74 0.02 0.00 0.00 177.57 178.38 2oex h THR 602 N 0.07 0.97 -0.12 2.57 2.02 -1.16 -2.80 112.91 114.47 2oex h THR 602 Ca 0.50 -1.00 -0.11 0.00 0.77 0.00 0.00 66.41 66.56 2oex h THR 602 Cb 1.85 1.54 -0.01 0.00 -1.74 0.00 0.00 68.15 69.79 2oex h THR 602 CO -0.05 0.22 -0.43 -0.33 0.37 0.00 0.00 175.52 175.29 2oex h GLU 603 N -0.73 0.27 -0.17 6.66 4.39 -0.67 -2.38 114.58 121.96 2oex h GLU 603 Ca -0.02 -0.14 -0.01 0.00 0.34 0.00 0.00 59.36 59.53 2oex h GLU 603 Cb 0.51 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.16 2oex h GLU 603 CO 0.03 0.66 0.05 -0.07 -1.16 0.00 0.00 179.01 178.52 2oex h LEU 604 N 0.22 0.25 -0.04 1.33 3.38 -0.66 -1.29 115.31 118.50 2oex h LEU 604 Ca 0.02 -0.21 0.03 0.00 0.09 0.00 0.00 57.88 57.81 2oex h LEU 604 Cb 0.86 -0.07 -0.06 0.00 0.09 0.00 0.00 40.66 41.48 2oex h LEU 604 CO 0.07 0.39 -0.51 -0.78 0.09 0.00 0.00 178.44 177.70 2oex h ASP 605 N 0.10 -1.59 -0.80 -0.43 3.58 -1.43 0.71 116.42 116.56 2oex h ASP 605 Ca 0.06 0.18 0.19 0.00 0.42 0.00 0.00 57.03 57.88 2oex h ASP 605 Cb 0.23 0.61 -0.13 0.00 1.72 0.00 0.00 39.33 41.77 2oex h ASP 605 CO -0.00 -0.50 0.15 0.03 -2.88 0.00 0.00 179.24 176.04 2oex h ARG 606 N -0.63 0.20 0.00 0.28 3.08 -1.22 0.45 114.38 116.54 2oex h ARG 606 Ca 0.03 -0.01 -0.30 0.00 0.07 0.00 0.00 59.98 59.77 2oex h ARG 606 Cb 0.70 -0.04 -0.05 0.00 0.08 0.00 0.00 29.97 30.65 2oex h ARG 606 CO -0.38 0.13 -2.02 1.33 -1.07 0.00 0.00 179.97 177.96 2oex n VAL 607 N -5.24 1.36 -0.02 2.04 0.24 -0.50 -4.47 118.33 111.74 2oex n VAL 607 Ca 0.17 -0.80 0.04 0.00 -2.04 0.00 0.00 64.34 61.72 2oex n VAL 607 Cb 0.55 -0.66 -0.11 0.00 -1.47 0.00 0.00 33.84 32.15 2oex n VAL 607 CO 0.00 0.00 0.00 -1.22 -2.14 0.00 0.00 176.83 173.47 2oex n TYR 608 N -2.84 0.00 -0.36 6.34 4.02 0.23 -4.67 117.16 119.88 2oex n TYR 608 Ca -0.23 0.00 0.29 0.00 -0.01 0.00 0.00 57.90 57.95 2oex n TYR 608 Cb 1.05 -0.40 0.60 0.00 -0.02 0.00 0.00 39.34 40.57 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 2.68 0.92 0.78 2.72 0.00 -0.12 0.36 103.07 110.40 2oex h GLY 609 Ca -0.08 -0.13 -0.05 0.00 0.00 0.00 0.00 47.33 47.07 2oex h GLY 609 CO 0.00 -0.16 -0.08 -1.33 0.00 0.00 0.00 176.54 174.98 2oex h GLY 610 N 0.23 0.40 1.00 4.60 0.00 -1.83 -1.69 103.07 105.77 2oex h GLY 610 Ca 0.64 -0.35 -0.15 0.00 0.00 0.00 0.00 47.33 47.47 2oex h GLY 610 CO -0.25 0.32 -0.44 1.41 0.00 0.00 0.00 176.54 177.58 2oex h LEU 611 N 0.05 0.78 -1.36 3.11 4.07 -0.76 -2.76 115.31 118.44 2oex h LEU 611 Ca 0.04 -0.54 -0.06 0.00 0.08 0.00 0.00 57.88 57.40 2oex h LEU 611 Cb 0.55 -0.22 -0.01 0.00 1.08 0.00 0.00 40.66 42.06 2oex h LEU 611 CO 0.02 1.18 -0.19 0.71 -1.08 0.00 0.00 178.44 179.08 2oex h THR 612 N 0.41 1.20 0.45 0.22 1.35 -0.74 -1.89 112.91 113.91 2oex h THR 612 Ca 0.01 -0.90 -0.01 0.00 -0.55 0.00 0.00 66.41 64.96 2oex h THR 612 Cb 1.05 1.33 -0.02 0.00 -1.73 0.00 0.00 68.15 68.77 2oex h THR 612 CO 0.10 0.27 -0.49 0.74 -0.25 0.00 0.00 175.52 175.89 2oex h THR 613 N 0.17 0.00 -0.80 6.82 2.02 -1.16 -2.71 112.91 117.24 2oex h THR 613 Ca 0.03 0.00 0.17 0.00 0.77 0.00 0.00 66.41 67.38 2oex h THR 613 Cb 0.45 0.00 -0.11 0.00 -1.74 0.00 0.00 68.15 66.75 2oex h THR 613 CO 0.03 0.00 0.31 0.11 0.37 0.00 0.00 175.52 176.34 2oex h LYS 614 N -0.96 0.40 -0.13 6.66 1.57 -1.25 -1.23 116.57 121.64 2oex h LYS 614 Ca -0.06 -0.02 0.05 0.00 -1.87 0.00 0.00 60.65 58.75 2oex h LYS 614 Cb 0.84 -0.09 -0.06 0.00 0.08 0.00 0.00 32.23 33.00 2oex h LYS 614 CO -0.08 0.26 -0.28 0.28 -0.57 0.00 0.00 179.45 179.06 2oex h VAL 615 N 0.41 0.35 -0.18 0.50 2.07 -1.19 0.52 116.25 118.74 2oex h VAL 615 Ca 0.46 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.94 2oex h VAL 615 Cb 0.78 0.35 -0.01 0.00 -1.52 0.00 0.00 31.29 30.89 2oex h VAL 615 CO -0.46 0.00 -0.07 1.56 0.02 0.00 0.00 177.57 178.62 2oex h GLN 616 N -0.35 0.27 0.55 1.57 1.08 -1.01 0.14 115.11 117.36 2oex h GLN 616 Ca 0.10 -0.05 -0.03 0.00 -1.45 0.00 0.00 58.65 57.22 2oex h GLN 616 Cb 0.50 -0.04 0.01 0.00 -0.05 0.00 0.00 27.48 27.89 2oex h GLN 616 CO -0.33 0.35 -0.27 1.49 -0.95 0.00 0.00 178.83 179.13 2oex h GLU 617 N 0.26 -0.72 -0.89 1.46 4.57 -0.54 -1.90 114.58 116.83 2oex h GLU 617 Ca 0.06 0.05 0.16 0.00 -1.18 0.00 0.00 59.36 58.44 2oex h GLU 617 Cb 0.29 0.16 -0.10 0.00 -0.16 0.00 0.00 28.75 28.94 2oex h GLU 617 CO 0.01 -0.43 0.47 1.03 -1.18 0.00 0.00 179.01 178.91 2oex h SER 618 N -0.86 0.58 -0.51 1.04 0.87 0.67 0.26 113.55 115.60 2oex h SER 618 Ca -0.08 0.10 -0.08 0.00 -1.23 0.00 0.00 61.79 60.50 2oex h SER 618 Cb 0.61 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.55 2oex h SER 618 CO 0.12 0.22 0.02 -0.07 -0.53 0.00 0.00 176.83 176.60 2oex h LEU 619 N 0.65 0.90 0.08 2.23 3.38 -0.71 -2.60 115.31 119.24 2oex h LEU 619 Ca 0.49 -0.23 -0.26 0.00 0.09 0.00 0.00 57.88 57.98 2oex h LEU 619 Cb 0.72 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 41.23 2oex h LEU 619 CO -0.38 0.94 -1.18 0.50 0.09 0.00 0.00 178.44 178.41 2oex h LYS 620 N 0.86 0.24 -0.76 1.13 1.63 -0.31 -2.71 116.57 116.65 2oex h LYS 620 Ca 0.16 -0.40 0.02 0.00 -0.85 0.00 0.00 60.65 59.58 2oex h LYS 620 Cb 0.48 0.15 -0.04 0.00 -0.60 0.00 0.00 32.23 32.21 2oex h LYS 620 CO 0.02 1.18 0.50 -0.22 -3.45 0.00 0.00 179.45 177.48 2oex h LYS 621 N 0.07 0.97 -0.02 1.90 3.64 -0.52 -2.74 116.57 119.88 2oex h LYS 621 Ca -0.11 -0.06 0.02 0.00 -1.27 0.00 0.00 60.65 59.23 2oex h LYS 621 Cb 1.91 -0.22 -0.02 0.00 -0.41 0.00 0.00 32.23 33.49 2oex h LYS 621 CO 0.19 0.64 -0.08 0.37 -2.27 0.00 0.00 179.45 178.30 2oex h GLN 622 N 1.00 -0.13 -0.60 1.90 4.15 -1.47 -2.40 115.11 117.56 2oex h GLN 622 Ca 0.29 0.01 0.12 0.00 0.77 0.00 0.00 58.65 59.84 2oex h GLN 622 Cb -0.08 0.03 -0.10 0.00 0.21 0.00 0.00 27.48 27.54 2oex h GLN 622 CO -0.08 -0.09 -0.03 1.49 -1.93 0.00 0.00 178.83 178.20 2oex h GLU 623 N -0.14 0.09 -0.12 1.69 4.81 -1.19 0.13 114.58 119.84 2oex h GLU 623 Ca 0.04 -0.01 -0.13 0.00 -0.13 0.00 0.00 59.36 59.13 2oex h GLU 623 Cb 0.19 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.55 2oex h GLU 623 CO -0.10 0.06 -0.43 0.78 -0.73 0.00 0.00 179.01 178.59 2oex h GLY 624 N 0.09 0.56 0.56 1.92 0.00 -1.54 -2.24 103.07 102.42 2oex h GLY 624 Ca 0.31 -0.75 0.00 0.00 0.00 0.00 0.00 47.33 46.89 2oex h GLY 624 CO -0.54 0.67 -0.36 1.41 0.00 0.00 0.00 176.54 177.72 2oex h LEU 625 N 0.12 -1.00 -1.91 3.11 3.38 -1.04 0.16 115.31 118.13 2oex h LEU 625 Ca -0.02 0.09 0.26 0.00 0.09 0.00 0.00 57.88 58.31 2oex h LEU 625 Cb 1.06 0.35 -0.04 0.00 0.09 0.00 0.00 40.66 42.12 2oex h LEU 625 CO 0.09 -0.49 0.66 -0.07 0.09 0.00 0.00 178.44 178.72 2oex h LEU 626 N -0.71 0.07 -0.04 1.67 3.38 -0.84 0.16 115.31 119.00 2oex h LEU 626 Ca -0.01 0.01 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 2oex h LEU 626 Cb 0.66 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.41 2oex h LEU 626 CO -0.10 0.02 -0.12 0.50 0.09 0.00 0.00 178.44 178.83 2oex h LYS 627 N 0.06 0.15 -0.05 1.13 3.64 -0.70 -2.96 116.57 117.84 2oex h LYS 627 Ca 0.45 -0.11 -0.07 0.00 -1.27 0.00 0.00 60.65 59.66 2oex h LYS 627 Cb 1.70 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 33.53 2oex h LYS 627 CO -0.04 0.73 -0.30 -0.91 -2.27 0.00 0.00 179.45 176.66 2oex h ASN 628 N -0.41 0.09 -0.87 4.20 -0.26 0.32 -2.46 115.58 116.19 2oex h ASN 628 Ca -0.00 -0.03 -0.02 0.00 -0.56 0.00 0.00 56.30 55.68 2oex h ASN 628 Cb 0.74 -0.02 -0.04 0.00 -1.06 0.00 0.00 38.32 37.93 2oex h ASN 628 CO 0.02 0.39 0.45 0.40 -1.06 0.00 0.00 177.43 177.63 2oex h ILE 629 N 0.08 1.26 -0.33 2.81 2.04 -0.79 -2.06 117.51 120.52 2oex h ILE 629 Ca 0.01 -0.69 -0.01 0.00 1.00 0.00 0.00 64.86 65.17 2oex h ILE 629 Cb 0.58 0.12 -0.01 0.00 -0.74 0.00 0.00 36.82 36.76 2oex h ILE 629 CO 0.04 0.30 0.15 -0.61 0.00 0.00 0.00 178.15 178.04 2oex h GLN 630 N 1.23 0.47 -0.32 2.37 5.75 -1.27 -0.69 115.11 122.65 2oex h GLN 630 Ca 0.30 -0.07 0.01 0.00 -0.15 0.00 0.00 58.65 58.74 2oex h GLN 630 Cb 0.08 -0.08 -0.02 0.00 1.07 0.00 0.00 27.48 28.53 2oex h GLN 630 CO -0.04 0.44 0.21 0.28 -2.65 0.00 0.00 178.83 177.06 2oex h VAL 631 N 0.39 1.07 -0.01 2.39 2.07 -1.42 -1.89 116.25 118.86 2oex h VAL 631 Ca 0.11 -0.15 -0.12 0.00 0.82 0.00 0.00 66.70 67.36 2oex h VAL 631 Cb 0.13 0.61 -0.02 0.00 -1.52 0.00 0.00 31.29 30.49 2oex h VAL 631 CO -0.01 0.08 -0.58 0.28 0.02 0.00 0.00 177.57 177.35 2oex h SER 632 N 0.42 0.03 0.05 0.57 0.02 -1.26 -2.65 113.55 110.74 2oex h SER 632 Ca 0.12 -0.02 -0.08 0.00 -0.84 0.00 0.00 61.79 60.97 2oex h SER 632 Cb -0.04 -0.01 -0.01 0.00 0.14 0.00 0.00 62.40 62.48 2oex h SER 632 CO -0.03 0.61 -0.24 -0.74 -1.14 0.00 0.00 176.83 175.28 2oex h HIS 633 N 0.02 0.36 -0.01 3.45 6.17 -0.93 -1.34 115.15 122.87 2oex h HIS 633 Ca -0.01 -0.07 0.02 0.00 0.71 0.00 0.00 60.37 61.03 2oex h HIS 633 Cb 1.04 -0.09 -0.03 0.00 2.52 0.00 0.00 27.41 30.85 2oex h HIS 633 CO 0.00 0.55 -0.14 1.96 0.71 0.00 0.00 177.93 181.02 2oex h GLN 634 N 0.29 -0.21 0.00 5.26 1.08 -0.97 0.92 115.11 121.48 2oex h GLN 634 Ca 0.05 0.01 -0.11 0.00 -1.45 0.00 0.00 58.65 57.15 2oex h GLN 634 Cb 0.59 0.05 -0.02 0.00 -0.05 0.00 0.00 27.48 28.06 2oex h GLN 634 CO 0.04 -0.14 -0.54 1.49 -0.95 0.00 0.00 178.83 178.73 2oex h GLU 635 N -0.22 0.00 0.00 1.46 4.81 -1.47 -2.40 114.58 116.76 2oex h GLU 635 Ca 0.05 0.00 -0.10 0.00 -0.13 0.00 0.00 59.36 59.18 2oex h GLU 635 Cb 0.29 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.65 2oex h GLU 635 CO -0.14 0.54 -0.48 0.35 -0.73 0.00 0.00 179.01 178.54 2oex h PHE 636 N 0.00 0.00 0.00 0.92 3.57 -0.96 -2.97 116.94 117.50 2oex h PHE 636 Ca -0.01 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.49 2oex h PHE 636 Cb 0.97 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 39.71 2oex h PHE 636 CO 0.00 0.48 -0.04 0.77 -2.23 0.00 0.00 178.31 177.29 2oex h SER 637 N 0.00 0.00 0.00 0.41 0.02 -0.28 -3.34 113.55 110.36 2oex h SER 637 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2oex h SER 637 Cb 0.90 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.44 2oex h SER 637 CO 0.06 0.04 0.00 0.29 -1.14 0.00 0.00 176.83 176.09 2oex n LYS 638 N -3.87 0.19 -1.56 3.45 5.02 -1.13 -4.88 118.16 115.39 2oex n LYS 638 Ca -0.03 0.00 0.07 0.00 -2.02 0.00 0.00 58.31 56.34 2oex n LYS 638 Cb 0.13 -1.40 -0.04 0.00 -0.02 0.00 0.00 35.03 33.70 2oex n LYS 638 CO 0.00 0.00 0.00 0.36 -0.52 0.00 0.00 177.40 177.24 2oex n LYS 640 N 0.95 -3.88 -2.70 1.97 2.85 -1.26 -5.17 118.16 110.92 2oex n LYS 640 Ca 0.00 3.08 -0.38 0.00 -1.05 0.00 0.00 58.31 59.96 2oex n LYS 640 Cb 0.10 -4.05 -0.06 0.00 -0.65 0.00 0.00 35.03 30.37 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 -5.02 4.54 -0.20 -1.58 -1.52 -1.26 -4.97 119.66 109.65 2oex s GLN 641 Ca 0.00 1.43 0.13 0.00 -1.95 0.00 0.00 55.36 54.97 2oex s GLN 641 Cb 0.00 -2.84 0.41 0.00 -0.22 0.00 0.00 33.01 30.35 2oex s GLN 641 CO 0.00 0.22 1.26 0.45 -0.25 0.00 0.00 175.29 176.97 2oex n SER 642 N 0.61 2.16 -4.60 5.90 2.88 -1.26 -4.75 113.62 114.56 2oex n SER 642 Ca 0.02 -3.61 -0.36 0.00 -1.33 0.00 0.00 58.87 53.58 2oex n SER 642 Cb 0.49 -0.52 0.08 0.00 -0.75 0.00 0.00 64.21 63.50 2oex n SER 642 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 2oex n ASN 643 N -1.16 0.36 -0.15 -3.46 5.03 -1.26 -4.87 115.26 109.75 2oex n ASN 643 Ca 0.21 0.69 0.13 0.00 0.87 0.00 0.00 54.58 56.48 2oex n ASN 643 Cb 0.75 -1.38 0.47 0.00 -1.02 0.00 0.00 39.78 38.61 2oex n ASN 643 CO 0.00 0.00 0.00 -1.13 -1.83 0.00 0.00 177.26 174.30 2oex h ASN 644 N -0.08 0.44 1.89 6.41 -1.24 -2.01 -1.73 115.58 119.24 2oex h ASN 644 Ca -0.47 0.02 0.00 0.00 0.71 0.00 0.00 56.30 56.55 2oex h ASN 644 Cb 1.34 -0.07 0.00 0.00 0.73 0.00 0.00 38.32 40.32 2oex h ASN 644 CO 0.47 0.24 0.00 1.05 -1.29 0.00 0.00 177.43 177.91 2oex h GLU 645 N 0.48 0.00 -0.05 6.67 9.09 -1.92 -2.91 114.58 125.94 2oex h GLU 645 Ca 0.34 0.00 -0.14 0.00 0.05 0.00 0.00 59.36 59.61 2oex h GLU 645 Cb 0.67 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.76 2oex h GLU 645 CO -0.11 0.00 -0.61 0.00 0.05 0.00 0.00 179.01 178.34 2oex h ALA 646 N 2.07 0.89 -0.02 1.06 0.00 -1.64 -2.36 119.26 119.27 2oex h ALA 646 Ca 0.00 -0.55 -0.16 0.00 0.00 0.00 0.00 54.91 54.21 2oex h ALA 646 Cb 0.94 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 18.66 2oex h ALA 646 CO 0.00 0.74 -0.60 -0.91 0.00 0.00 0.00 179.25 178.48 2oex h ASN 647 N 0.12 0.56 -0.36 0.00 2.35 -1.41 -1.82 115.58 115.03 2oex h ASN 647 Ca -0.01 -0.74 0.07 0.00 -0.55 0.00 0.00 56.30 55.07 2oex h ASN 647 Cb 1.10 -0.17 -0.06 0.00 0.05 0.00 0.00 38.32 39.24 2oex h ASN 647 CO 0.09 1.22 -0.02 -0.07 -1.65 0.00 0.00 177.43 177.01 2oex h LEU 648 N -0.04 -0.18 -1.29 1.61 3.38 -1.54 0.14 115.31 117.38 2oex h LEU 648 Ca -0.07 0.09 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 2oex h LEU 648 Cb 1.30 0.16 -0.02 0.00 0.09 0.00 0.00 40.66 42.18 2oex h LEU 648 CO 0.12 -0.05 0.20 -0.09 0.09 0.00 0.00 178.44 178.71 2oex h ARG 649 N 0.08 0.69 -0.08 1.13 2.43 -1.45 -2.58 114.38 114.60 2oex h ARG 649 Ca 0.17 -0.09 -0.05 0.00 -0.81 0.00 0.00 59.98 59.20 2oex h ARG 649 Cb 0.24 -0.13 -0.00 0.00 -0.42 0.00 0.00 29.97 29.67 2oex h ARG 649 CO -0.30 0.56 -0.14 1.49 -1.51 0.00 0.00 179.97 180.07 2oex h GLU 650 N 0.68 0.24 -0.46 0.20 4.81 -0.37 -1.88 114.58 117.81 2oex h GLU 650 Ca 0.17 -0.15 0.08 0.00 -0.13 0.00 0.00 59.36 59.33 2oex h GLU 650 Cb 0.13 0.02 -0.07 0.00 0.63 0.00 0.00 28.75 29.45 2oex h GLU 650 CO -0.02 0.72 0.05 0.93 -0.73 0.00 0.00 179.01 179.96 2oex h GLU 651 N -0.22 0.17 -0.59 1.92 5.08 -0.71 -0.70 114.58 119.53 2oex h GLU 651 Ca 0.01 -0.01 -0.10 0.00 -1.00 0.00 0.00 59.36 58.26 2oex h GLU 651 Cb 0.70 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.89 2oex h GLU 651 CO 0.03 0.11 -0.01 0.28 -1.00 0.00 0.00 179.01 178.42 2oex h VAL 652 N 0.17 1.27 -0.48 3.13 2.07 -1.46 -0.38 116.25 120.57 2oex h VAL 652 Ca 0.23 -1.17 -0.08 0.00 0.82 0.00 0.00 66.70 66.50 2oex h VAL 652 Cb 0.31 0.83 -0.02 0.00 -1.52 0.00 0.00 31.29 30.89 2oex h VAL 652 CO -0.33 0.42 -0.03 -0.07 0.02 0.00 0.00 177.57 177.58 2oex h LEU 653 N 0.96 0.79 0.05 2.57 3.38 -0.85 -1.95 115.31 120.25 2oex h LEU 653 Ca 0.17 -0.21 -0.00 0.00 0.09 0.00 0.00 57.88 57.93 2oex h LEU 653 Cb 0.58 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.12 2oex h LEU 653 CO 0.03 0.87 -0.02 0.11 0.09 0.00 0.00 178.44 179.53 2oex h LYS 654 N 0.76 -0.06 -1.00 1.13 1.57 -0.81 -2.27 116.57 115.89 2oex h LYS 654 Ca 0.14 0.00 0.31 0.00 -1.87 0.00 0.00 60.65 59.23 2oex h LYS 654 Cb 0.50 0.01 -0.14 0.00 0.08 0.00 0.00 32.23 32.68 2oex h LYS 654 CO 0.03 0.27 0.56 -0.91 -0.57 0.00 0.00 179.45 178.82 2oex h ASN 655 N -0.39 0.53 0.26 0.86 2.35 -0.97 -0.63 115.58 117.60 2oex h ASN 655 Ca -0.01 0.18 -0.15 0.00 -0.55 0.00 0.00 56.30 55.77 2oex h ASN 655 Cb 0.35 0.12 -0.01 0.00 0.05 0.00 0.00 38.32 38.83 2oex h ASN 655 CO 0.01 -0.09 -0.61 -0.07 -1.65 0.00 0.00 177.43 175.02 2oex h LEU 656 N 0.37 0.39 -0.25 1.61 3.38 -0.81 0.21 115.31 120.19 2oex h LEU 656 Ca 0.71 -0.22 -0.21 0.00 0.09 0.00 0.00 57.88 58.26 2oex h LEU 656 Cb 1.58 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 42.22 2oex h LEU 656 CO -0.58 0.90 -0.71 0.00 0.09 0.00 0.00 178.44 178.14 2oex h ALA 657 N 1.10 0.42 -0.60 1.53 0.00 -0.63 -2.51 119.26 118.57 2oex h ALA 657 Ca -0.01 -0.58 -0.05 0.00 0.00 0.00 0.00 54.91 54.28 2oex h ALA 657 Cb 1.13 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.86 2oex h ALA 657 CO 0.10 0.70 0.18 1.15 0.00 0.00 0.00 179.25 181.38 2oex h THR 658 N 0.52 1.24 -0.48 0.00 2.02 -1.13 -2.39 112.91 112.70 2oex h THR 658 Ca -0.03 -0.83 0.03 0.00 0.77 0.00 0.00 66.41 66.35 2oex h THR 658 Cb 1.32 0.66 -0.04 0.00 -1.74 0.00 0.00 68.15 68.35 2oex h THR 658 CO 0.14 0.31 0.27 0.00 0.37 0.00 0.00 175.52 176.61 2oex h ALA 659 N 1.05 0.62 0.66 6.16 0.00 -0.86 -1.37 119.26 125.52 2oex h ALA 659 Ca 0.19 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.07 2oex h ALA 659 Cb 0.29 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 17.99 2oex h ALA 659 CO -0.01 -0.06 -0.32 -0.92 0.00 0.00 0.00 179.25 177.95 2oex h TYR 660 N 0.53 -0.82 -0.53 0.00 3.20 -1.28 -1.58 116.97 116.49 2oex h TYR 660 Ca 0.20 -0.02 0.10 0.00 3.14 0.00 0.00 58.73 62.16 2oex h TYR 660 Cb 0.07 0.27 -0.11 0.00 1.54 0.00 0.00 36.73 38.51 2oex h TYR 660 CO -0.08 -0.51 -0.24 -0.44 -1.64 0.00 0.00 178.16 175.25 2oex h ASP 661 N -0.88 -0.83 -0.88 -2.11 3.32 -1.16 0.17 116.42 114.03 2oex h ASP 661 Ca -0.09 0.19 0.07 0.00 0.02 0.00 0.00 57.03 57.22 2oex h ASP 661 Cb 0.68 0.45 -0.06 0.00 0.22 0.00 0.00 39.33 40.62 2oex h ASP 661 CO 0.15 -0.26 0.58 0.78 -1.72 0.00 0.00 179.24 178.76 2oex h ASN 662 N -0.11 0.87 0.34 6.45 2.35 -1.20 0.29 115.58 124.57 2oex h ASN 662 Ca 0.24 0.01 -0.02 0.00 -0.55 0.00 0.00 56.30 55.98 2oex h ASN 662 Cb 0.49 -0.18 0.00 0.00 0.05 0.00 0.00 38.32 38.69 2oex h ASN 662 CO -0.60 0.56 -0.16 0.15 -1.65 0.00 0.00 177.43 175.72 2oex h PHE 663 N 0.99 -0.42 -0.76 1.19 3.57 0.30 0.82 116.94 122.61 2oex h PHE 663 Ca 0.38 -0.01 0.09 0.00 3.53 0.00 0.00 57.97 61.96 2oex h PHE 663 Cb 0.22 0.14 -0.07 0.00 2.79 0.00 0.00 35.95 39.03 2oex h PHE 663 CO -0.00 -0.24 0.42 0.28 -2.23 0.00 0.00 178.31 176.54 2oex h VAL 664 N -0.50 0.89 -0.10 1.41 2.07 -0.61 0.13 116.25 119.55 2oex h VAL 664 Ca -0.05 -0.24 -0.07 0.00 0.82 0.00 0.00 66.70 67.16 2oex h VAL 664 Cb 0.38 0.12 0.00 0.00 -1.52 0.00 0.00 31.29 30.27 2oex h VAL 664 CO 0.08 0.13 -0.22 -0.33 0.02 0.00 0.00 177.57 177.25 2oex h GLU 665 N 0.71 0.32 -0.43 1.57 4.39 -0.58 0.42 114.58 120.98 2oex h GLU 665 Ca 0.37 -0.22 -0.02 0.00 0.34 0.00 0.00 59.36 59.83 2oex h GLU 665 Cb 0.35 0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 29.00 2oex h GLU 665 CO -0.25 0.82 0.19 -0.07 -1.16 0.00 0.00 179.01 178.54 2oex h LEU 666 N -0.12 0.55 -0.48 1.33 3.38 0.89 -0.94 115.31 119.91 2oex h LEU 666 Ca 0.00 -0.05 -0.15 0.00 0.09 0.00 0.00 57.88 57.77 2oex h LEU 666 Cb 0.82 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.42 2oex h LEU 666 CO 0.05 0.49 -0.39 0.58 0.09 0.00 0.00 178.44 179.26 2oex h VAL 667 N 0.61 1.28 0.45 1.22 2.07 -0.65 -2.33 116.25 118.89 2oex h VAL 667 Ca 0.15 -1.56 -0.02 0.00 0.82 0.00 0.00 66.70 66.09 2oex h VAL 667 Cb 0.10 1.42 0.00 0.00 -1.52 0.00 0.00 31.29 31.30 2oex h VAL 667 CO -0.02 0.51 -0.21 0.00 0.02 0.00 0.00 177.57 177.87 2oex h ALA 668 N 0.87 -1.11 -0.83 1.67 0.00 -0.44 -3.08 119.26 116.34 2oex h ALA 668 Ca 0.06 -0.13 0.08 0.00 0.00 0.00 0.00 54.91 54.91 2oex h ALA 668 Cb 0.96 0.23 -0.10 0.00 0.00 0.00 0.00 17.79 18.88 2oex h ALA 668 CO 0.09 -1.07 -0.49 -1.71 0.00 0.00 0.00 179.25 176.07 2oex n ASN 669 N -3.68 -0.88 0.11 0.00 2.85 -0.40 -1.03 115.26 112.23 2oex n ASN 669 Ca -0.07 1.58 0.14 0.00 -0.11 0.00 0.00 54.58 56.11 2oex n ASN 669 Cb 0.24 -0.24 0.65 0.00 1.24 0.00 0.00 39.78 41.67 2oex n ASN 669 CO 0.00 0.00 0.00 -0.07 -2.11 0.00 0.00 177.26 175.08 2oex h LEU 670 N 0.00 0.03 -0.09 1.20 3.38 -1.53 0.11 115.31 118.41 2oex h LEU 670 Ca 0.13 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.96 2oex h LEU 670 Cb 0.34 -0.01 0.01 0.00 0.09 0.00 0.00 40.66 41.09 2oex h LEU 670 CO -0.78 0.02 -0.49 0.11 0.09 0.00 0.00 178.44 177.38 2oex h LYS 671 N 0.03 0.49 -0.42 1.13 1.57 -0.98 -1.03 116.57 117.36 2oex h LYS 671 Ca 0.14 -0.41 -0.00 0.00 -1.87 0.00 0.00 60.65 58.51 2oex h LYS 671 Cb 0.51 0.09 -0.02 0.00 0.08 0.00 0.00 32.23 32.89 2oex h LYS 671 CO -0.01 1.04 0.25 0.93 -0.57 0.00 0.00 179.45 181.09 2oex h GLU 672 N 0.07 0.56 -0.02 3.15 5.08 -0.84 -1.86 114.58 120.72 2oex h GLU 672 Ca -0.04 -0.04 -0.00 0.00 -1.00 0.00 0.00 59.36 58.28 2oex h GLU 672 Cb 1.14 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 30.27 2oex h GLU 672 CO 0.10 0.40 0.01 0.78 -1.00 0.00 0.00 179.01 179.30 2oex h GLY 673 N 0.62 0.03 2.00 -3.84 0.00 -0.84 0.92 103.07 101.96 2oex h GLY 673 Ca 0.15 -0.02 -0.13 0.00 0.00 0.00 0.00 47.33 47.33 2oex h GLY 673 CO -0.03 0.02 -0.60 -0.91 0.00 0.00 0.00 176.54 175.02 2oex h THR 674 N -0.17 1.40 -0.11 4.70 1.35 -1.02 -1.09 112.91 117.96 2oex h THR 674 Ca 0.01 -2.09 -0.07 0.00 -0.55 0.00 0.00 66.41 63.70 2oex h THR 674 Cb 0.21 2.14 0.00 0.00 -1.73 0.00 0.00 68.15 68.77 2oex h THR 674 CO -0.00 0.59 -0.21 0.50 -0.25 0.00 0.00 175.52 176.15 2oex h LYS 675 N 0.00 0.35 -0.16 4.72 3.64 -1.31 -2.01 116.57 121.79 2oex h LYS 675 Ca -0.01 -0.22 0.05 0.00 -1.27 0.00 0.00 60.65 59.20 2oex h LYS 675 Cb 1.09 0.03 -0.05 0.00 -0.41 0.00 0.00 32.23 32.89 2oex h LYS 675 CO 0.08 0.81 -0.16 0.35 -2.27 0.00 0.00 179.45 178.26 2oex h PHE 676 N -0.08 -0.41 -0.66 1.91 3.57 -0.75 -0.86 116.94 119.67 2oex h PHE 676 Ca 0.01 0.03 0.05 0.00 3.53 0.00 0.00 57.97 61.58 2oex h PHE 676 Cb 0.80 0.21 -0.05 0.00 2.79 0.00 0.00 35.95 39.69 2oex h PHE 676 CO 0.10 -0.23 0.38 1.88 -2.23 0.00 0.00 178.31 178.21 2oex h TYR 677 N -0.18 0.70 -0.04 0.41 0.99 -1.20 0.11 116.97 117.75 2oex h TYR 677 Ca 0.11 0.02 -0.00 0.00 2.00 0.00 0.00 58.73 60.86 2oex h TYR 677 Cb 0.34 -0.22 -0.00 0.00 1.00 0.00 0.00 36.73 37.85 2oex h TYR 677 CO -0.29 0.35 0.02 -0.91 -0.00 0.00 0.00 178.16 177.33 2oex h ASN 678 N 0.71 0.05 0.76 3.88 2.35 -1.10 -2.24 115.58 119.98 2oex h ASN 678 Ca 0.29 -0.15 0.00 0.00 -0.55 0.00 0.00 56.30 55.88 2oex h ASN 678 Cb 0.14 -0.01 0.00 0.00 0.05 0.00 0.00 38.32 38.49 2oex h ASN 678 CO -0.16 0.19 0.00 1.05 -1.65 0.00 0.00 177.43 176.86 2oex h GLU 679 N -0.09 0.00 -0.09 0.81 4.11 -0.90 -2.15 114.58 116.26 2oex h GLU 679 Ca 0.01 0.00 -0.19 0.00 0.07 0.00 0.00 59.36 59.25 2oex h GLU 679 Cb 0.16 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.41 2oex h GLU 679 CO -0.00 0.00 -0.75 1.25 0.07 0.00 0.00 179.01 179.58 2oex h LEU 680 N 0.00 0.58 0.11 3.06 6.46 -0.23 -3.15 115.31 122.15 2oex h LEU 680 Ca 0.00 -0.39 0.01 0.00 -0.12 0.00 0.00 57.88 57.38 2oex h LEU 680 Cb 0.38 -0.17 -0.01 0.00 -0.73 0.00 0.00 40.66 40.12 2oex h LEU 680 CO 0.00 1.14 -0.12 0.74 -0.62 0.00 0.00 178.44 179.58 2oex h THR 681 N 0.33 0.73 -0.98 1.05 2.02 -0.85 -0.50 112.91 114.71 2oex h THR 681 Ca -0.04 0.00 0.20 0.00 0.77 0.00 0.00 66.41 67.34 2oex h THR 681 Cb 1.34 0.73 -0.11 0.00 -1.74 0.00 0.00 68.15 68.37 2oex h THR 681 CO 0.14 0.00 0.58 -0.33 0.37 0.00 0.00 175.52 176.27 2oex h GLU 682 N -0.26 0.67 -0.31 6.66 5.08 -1.61 0.22 114.58 125.03 2oex h GLU 682 Ca 0.01 -0.04 -0.14 0.00 -1.00 0.00 0.00 59.36 58.19 2oex h GLU 682 Cb 0.25 -0.15 -0.00 0.00 0.50 0.00 0.00 28.75 29.35 2oex h GLU 682 CO -0.04 0.45 -0.34 0.82 -1.00 0.00 0.00 179.01 178.89 2oex h ILE 683 N 0.70 1.29 0.00 3.13 2.04 -1.28 -2.96 117.51 120.43 2oex h ILE 683 Ca 0.58 -1.52 -0.10 0.00 1.00 0.00 0.00 64.86 64.82 2oex h ILE 683 Cb 0.94 1.56 -0.01 0.00 -0.74 0.00 0.00 36.82 38.57 2oex h ILE 683 CO -0.41 0.49 -0.47 -0.07 0.00 0.00 0.00 178.15 177.70 2oex h LEU 684 N 0.54 0.00 -1.10 1.44 3.38 -0.37 -2.67 115.31 116.53 2oex h LEU 684 Ca 0.04 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.93 2oex h LEU 684 Cb 0.93 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.66 2oex h LEU 684 CO 0.08 0.47 -0.40 0.58 0.09 0.00 0.00 178.44 179.26 2oex h VAL 685 N 0.00 1.08 -0.05 1.22 2.07 -0.94 -0.64 116.25 118.99 2oex h VAL 685 Ca -0.00 -1.47 -0.17 0.00 0.82 0.00 0.00 66.70 65.87 2oex h VAL 685 Cb 1.03 1.84 0.01 0.00 -1.52 0.00 0.00 31.29 32.65 2oex h VAL 685 CO 0.06 0.39 -0.63 0.03 0.02 0.00 0.00 177.57 177.44 2oex h ARG 686 N 0.00 0.52 -0.52 1.57 3.08 -1.37 -2.58 114.38 115.09 2oex h ARG 686 Ca -0.00 -0.49 0.07 0.00 0.07 0.00 0.00 59.98 59.63 2oex h ARG 686 Cb 0.81 0.12 -0.06 0.00 0.08 0.00 0.00 29.97 30.92 2oex h ARG 686 CO 0.05 1.12 0.18 0.35 -1.07 0.00 0.00 179.97 180.60 2oex h PHE 687 N 0.09 0.31 0.01 3.04 3.57 -1.21 0.60 116.94 123.35 2oex h PHE 687 Ca -0.06 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.46 2oex h PHE 687 Cb 1.31 -0.06 0.00 0.00 2.79 0.00 0.00 35.95 39.99 2oex h PHE 687 CO 0.12 0.09 -0.00 0.37 -2.23 0.00 0.00 178.31 176.66 2oex h GLN 688 N 0.35 -0.01 -0.45 1.11 4.15 -1.17 0.86 115.11 119.95 2oex h GLN 688 Ca 0.25 0.00 0.09 0.00 0.77 0.00 0.00 58.65 59.76 2oex h GLN 688 Cb 0.28 0.00 -0.07 0.00 0.21 0.00 0.00 27.48 27.90 2oex h GLN 688 CO -0.26 0.10 -0.01 -0.91 -1.93 0.00 0.00 178.83 175.82 2oex h ASN 689 N -0.11 -0.21 0.52 -0.69 2.35 -1.02 0.15 115.58 116.58 2oex h ASN 689 Ca -0.00 0.11 -0.02 0.00 -0.55 0.00 0.00 56.30 55.84 2oex h ASN 689 Cb 0.11 0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.66 2oex h ASN 689 CO 0.00 -0.07 -0.40 0.50 -1.65 0.00 0.00 177.43 175.82 2oex h LYS 690 N 0.10 -0.87 -0.85 0.81 3.64 -0.50 0.27 116.57 119.18 2oex h LYS 690 Ca 0.22 0.06 0.22 0.00 -1.27 0.00 0.00 60.65 59.88 2oex h LYS 690 Cb 0.33 0.20 -0.14 0.00 -0.41 0.00 0.00 32.23 32.21 2oex h LYS 690 CO -0.38 -0.58 0.17 0.00 -2.27 0.00 0.00 179.45 176.39 2oex h SER 692 N 0.18 0.83 0.34 0.00 0.87 0.36 -1.39 113.55 114.74 2oex h SER 692 Ca 0.52 -0.35 -0.06 0.00 -1.23 0.00 0.00 61.79 60.66 2oex h SER 692 Cb 1.01 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 62.74 2oex h SER 692 CO -0.67 0.99 -0.30 0.44 -0.53 0.00 0.00 176.83 176.76 2oex h ASP 693 N 0.65 0.00 0.07 6.23 3.32 0.56 -0.74 116.42 126.51 2oex h ASP 693 Ca 0.11 0.00 -0.20 0.00 0.02 0.00 0.00 57.03 56.96 2oex h ASP 693 Cb 0.62 0.00 0.02 0.00 0.22 0.00 0.00 39.33 40.19 2oex h ASP 693 CO 0.04 0.30 -0.82 0.40 -1.72 0.00 0.00 179.24 177.44 2oex h ILE 694 N 0.00 1.42 -0.62 0.35 1.08 -0.77 -2.80 117.51 116.18 2oex h ILE 694 Ca -0.00 -2.31 0.01 0.00 -0.39 0.00 0.00 64.86 62.17 2oex h ILE 694 Cb 0.55 2.81 -0.03 0.00 -3.07 0.00 0.00 36.82 37.08 2oex h ILE 694 CO 0.04 0.67 0.41 0.58 -0.69 0.00 0.00 178.15 179.16 2oex h VAL 695 N -0.10 1.15 -0.65 1.67 2.07 -1.16 -1.71 116.25 117.53 2oex h VAL 695 Ca -0.12 -0.28 -0.07 0.00 0.82 0.00 0.00 66.70 67.05 2oex h VAL 695 Cb 1.56 0.24 -0.03 0.00 -1.52 0.00 0.00 31.29 31.55 2oex h VAL 695 CO 0.16 0.15 0.14 0.15 0.02 0.00 0.00 177.57 178.19 2oex h PHE 696 N 0.83 1.10 -0.17 1.57 3.57 -1.18 0.95 116.94 123.60 2oex h PHE 696 Ca 0.23 -0.14 -0.02 0.00 3.53 0.00 0.00 57.97 61.57 2oex h PHE 696 Cb -0.08 -0.31 -0.01 0.00 2.79 0.00 0.00 35.95 38.35 2oex h PHE 696 CO -0.03 0.92 0.02 0.00 -2.23 0.00 0.00 178.31 176.98 2oex h ALA 697 N 1.05 0.23 -0.18 2.41 0.00 -1.42 -2.67 119.26 118.68 2oex h ALA 697 Ca 0.20 -0.18 0.05 0.00 0.00 0.00 0.00 54.91 54.98 2oex h ALA 697 Cb 0.39 -0.07 -0.07 0.00 0.00 0.00 0.00 17.79 18.04 2oex h ALA 697 CO 0.01 -0.09 -0.40 -0.09 0.00 0.00 0.00 179.25 178.68 2oex h ARG 698 N 0.07 -0.42 0.00 0.00 9.65 -1.07 -0.90 114.38 121.71 2oex h ARG 698 Ca 0.05 0.03 0.00 0.00 -1.10 0.00 0.00 59.98 58.96 2oex h ARG 698 Cb 0.33 0.10 0.00 0.00 -1.39 0.00 0.00 29.97 29.01 2oex h ARG 698 CO 0.01 -0.28 0.00 -0.22 2.80 0.00 0.00 179.97 182.27 2oex h LYS 699 N -0.44 0.00 0.00 0.20 3.64 -0.72 -3.25 116.57 116.00 2oex h LYS 699 Ca 0.09 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.47 2oex h LYS 699 Cb 0.60 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.42 2oex h LYS 699 CO -0.42 0.00 -0.79 2.41 -2.27 0.00 0.00 179.45 178.39 2oex n THR 700 N -2.42 0.00 0.00 1.00 -1.04 -0.86 -4.82 114.28 106.13 2oex n THR 700 Ca -0.01 -0.04 0.00 0.00 -2.04 0.00 0.00 64.05 61.96 2oex n THR 700 Cb 0.10 0.48 0.00 0.00 -1.82 0.00 0.00 70.33 69.09 2oex n THR 700 CO 0.00 0.00 0.00 -1.84 -0.64 0.00 0.00 175.07 172.59 2oex n GLU 701 N -1.25 0.00 -0.72 -2.82 0.28 -0.40 -5.06 120.64 110.66 2oex n GLU 701 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 2oex n GLU 701 Cb 0.00 -0.65 0.00 0.00 1.43 0.00 0.00 31.44 32.22 2oex n GLU 701 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51