#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dtd s ASN 364 N 0.00 6.17 0.01 -2.13 3.84 -1.26 -4.91 114.94 116.67 1dtd s ASN 364 Ca 0.00 -0.79 0.24 0.00 0.21 0.00 0.00 52.86 52.51 1dtd s ASN 364 Cb 0.00 -2.21 1.00 0.00 -0.55 0.00 0.00 41.25 39.49 1dtd s ASN 364 CO 0.00 -0.57 1.75 0.49 -2.79 0.00 0.00 177.10 175.98 1dtd n PHE 365 N 5.49 0.06 -0.78 0.43 3.01 -1.26 -3.53 117.46 120.88 1dtd n PHE 365 Ca -0.09 0.02 -0.19 0.00 1.01 0.00 0.00 57.45 58.21 1dtd n PHE 365 Cb 0.47 -0.53 0.15 0.00 -0.01 0.00 0.00 39.48 39.56 1dtd n PHE 365 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1dtd n GLY 366 N 0.93 3.98 3.09 1.37 0.00 -1.26 -4.73 105.19 108.56 1dtd n GLY 366 Ca 0.06 -0.87 -0.08 0.00 0.00 0.00 0.00 46.02 45.12 1dtd n GLY 366 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dtd s ALA 367 N -2.64 0.18 0.19 4.61 0.00 -1.23 -4.62 121.76 118.24 1dtd s ALA 367 Ca 0.46 -0.82 -0.28 0.00 0.00 0.00 0.00 51.96 51.32 1dtd s ALA 367 Cb 0.38 0.26 -0.08 0.00 0.00 0.00 0.00 23.12 23.68 1dtd s ALA 367 CO 0.09 -0.32 0.87 0.71 0.00 0.00 0.00 175.76 177.11 1dtd s TYR 368 N -3.00 3.93 0.24 0.00 1.51 -1.26 -4.99 117.35 113.78 1dtd s TYR 368 Ca -0.02 1.78 0.09 0.00 -1.01 0.00 0.00 57.07 57.92 1dtd s TYR 368 Cb 0.01 -2.90 -0.05 0.00 -0.11 0.00 0.00 41.96 38.91 1dtd s TYR 368 CO -0.07 0.44 -0.16 -1.01 -1.11 0.00 0.00 175.55 173.65 1dtd s HIS 369 N -0.98 1.97 0.84 2.71 3.76 -1.26 -5.14 115.29 117.19 1dtd s HIS 369 Ca 0.40 -0.49 -0.12 0.00 -0.15 0.00 0.00 55.06 54.70 1dtd s HIS 369 Cb -0.24 -0.92 0.09 0.00 1.11 0.00 0.00 32.58 32.62 1dtd s HIS 369 CO 0.29 0.50 1.10 0.95 -0.85 0.00 0.00 174.74 176.73 1dtd s THR 370 N -2.79 2.87 0.36 1.30 -4.23 -1.26 -4.82 115.64 107.07 1dtd s THR 370 Ca 0.26 0.28 0.05 0.00 -1.18 0.00 0.00 61.69 61.10 1dtd s THR 370 Cb -0.02 -2.95 0.20 0.00 1.34 0.00 0.00 72.50 71.08 1dtd s THR 370 CO 0.11 -0.37 1.95 0.25 -0.54 0.00 0.00 174.62 176.02 1dtd h LEU 371 N -1.26 0.51 -0.79 4.79 5.85 -1.97 -0.89 115.31 121.55 1dtd h LEU 371 Ca -0.48 -0.06 -0.06 0.00 0.84 0.00 0.00 57.88 58.12 1dtd h LEU 371 Cb 1.28 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 42.15 1dtd h LEU 371 CO 0.58 0.49 0.21 -0.33 -0.34 0.00 0.00 178.44 179.05 1dtd h GLU 372 N 0.56 1.12 -0.41 1.25 3.07 -2.00 -1.14 114.58 117.03 1dtd h GLU 372 Ca 0.13 -0.24 -0.08 0.00 -0.50 0.00 0.00 59.36 58.67 1dtd h GLU 372 Cb 0.16 -0.16 -0.01 0.00 -0.84 0.00 0.00 28.75 27.90 1dtd h GLU 372 CO -0.01 0.96 -0.06 0.93 -1.40 0.00 0.00 179.01 179.43 1dtd h GLU 373 N 1.07 0.76 -0.12 2.33 5.08 -1.72 -1.97 114.58 120.01 1dtd h GLU 373 Ca 0.23 -0.27 0.01 0.00 -1.00 0.00 0.00 59.36 58.33 1dtd h GLU 373 Cb 0.32 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.50 1dtd h GLU 373 CO -0.01 0.87 0.04 0.82 -1.00 0.00 0.00 179.01 179.74 1dtd h ILE 374 N 0.58 0.98 -0.89 3.13 2.04 -0.96 -2.01 117.51 120.37 1dtd h ILE 374 Ca 0.11 -0.03 -0.00 0.00 1.00 0.00 0.00 64.86 65.93 1dtd h ILE 374 Cb 0.57 0.87 -0.04 0.00 -0.74 0.00 0.00 36.82 37.47 1dtd h ILE 374 CO 0.03 0.02 0.54 0.28 0.00 0.00 0.00 178.15 179.02 1dtd h SER 375 N 0.10 1.07 -0.79 1.72 0.02 -1.09 -1.40 113.55 113.18 1dtd h SER 375 Ca 0.05 -0.07 -0.02 0.00 -0.84 0.00 0.00 61.79 60.91 1dtd h SER 375 Cb 0.02 -0.27 -0.04 0.00 0.14 0.00 0.00 62.40 62.26 1dtd h SER 375 CO -0.05 0.82 0.42 -0.61 -1.14 0.00 0.00 176.83 176.27 1dtd h GLN 376 N 1.22 1.11 -0.44 3.45 -0.00 -1.10 -1.13 115.11 118.23 1dtd h GLN 376 Ca 0.32 -0.14 -0.09 0.00 -0.00 0.00 0.00 58.65 58.74 1dtd h GLN 376 Cb -0.06 -0.21 -0.02 0.00 0.00 0.00 0.00 27.48 27.19 1dtd h GLN 376 CO -0.06 0.84 -0.10 1.49 0.00 0.00 0.00 178.83 181.00 1dtd h GLU 377 N 1.10 0.78 -0.66 1.69 4.57 -0.99 0.10 114.58 121.17 1dtd h GLU 377 Ca 0.28 -0.26 0.02 0.00 -1.18 0.00 0.00 59.36 58.22 1dtd h GLU 377 Cb 0.06 -0.07 -0.04 0.00 -0.16 0.00 0.00 28.75 28.55 1dtd h GLU 377 CO -0.04 0.86 0.43 0.52 -1.18 0.00 0.00 179.01 179.59 1dtd h MET 378 N 0.71 0.84 -0.22 1.92 2.86 -0.72 0.64 114.93 120.96 1dtd h MET 378 Ca 0.12 -0.05 -0.09 0.00 -2.06 0.00 0.00 59.70 57.62 1dtd h MET 378 Cb 0.58 -0.19 -0.01 0.00 0.06 0.00 0.00 31.60 32.03 1dtd h MET 378 CO 0.04 0.55 -0.27 -0.44 1.06 0.00 0.00 176.91 177.85 1dtd h ASP 379 N 0.86 0.42 -0.40 1.22 3.32 -0.86 -2.46 116.42 118.51 1dtd h ASP 379 Ca 0.25 -0.14 -0.14 0.00 0.02 0.00 0.00 57.03 57.02 1dtd h ASP 379 Cb -0.05 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.37 1dtd h ASP 379 CO -0.07 0.69 -0.29 0.78 -1.72 0.00 0.00 179.24 178.63 1dtd h ASN 380 N 0.37 0.97 -0.23 6.45 2.35 0.02 -1.75 115.58 123.76 1dtd h ASN 380 Ca 0.05 -0.40 0.04 0.00 -0.55 0.00 0.00 56.30 55.45 1dtd h ASN 380 Cb 0.67 -0.27 -0.04 0.00 0.05 0.00 0.00 38.32 38.73 1dtd h ASN 380 CO 0.05 1.18 -0.04 -0.07 -1.65 0.00 0.00 177.43 176.90 1dtd h LEU 381 N 0.79 -0.18 -0.32 1.61 4.07 -0.70 -1.35 115.31 119.21 1dtd h LEU 381 Ca 0.09 0.06 0.01 0.00 0.08 0.00 0.00 57.88 58.12 1dtd h LEU 381 Cb 0.86 0.13 -0.02 0.00 1.08 0.00 0.00 40.66 42.71 1dtd h LEU 381 CO 0.08 -0.06 0.20 0.58 -1.08 0.00 0.00 178.44 178.16 1dtd h VAL 382 N 0.02 1.06 0.00 1.22 2.07 -1.28 -2.41 116.25 116.92 1dtd h VAL 382 Ca 0.11 -0.14 -0.07 0.00 0.82 0.00 0.00 66.70 67.42 1dtd h VAL 382 Cb 0.16 0.61 -0.01 0.00 -1.52 0.00 0.00 31.29 30.53 1dtd h VAL 382 CO -0.22 0.08 -0.33 0.00 0.02 0.00 0.00 177.57 177.11 1dtd h ALA 383 N 1.13 1.45 -0.01 1.67 0.00 -1.12 -2.82 119.26 119.56 1dtd h ALA 383 Ca 0.12 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1dtd h ALA 383 Cb -0.02 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.71 1dtd h ALA 383 CO -0.04 0.42 -0.35 -0.85 0.00 0.00 0.00 179.25 178.43 1dtd n GLU 384 N -4.14 0.64 -3.11 0.00 0.28 -0.53 -4.49 120.64 109.29 1dtd n GLU 384 Ca -0.02 -0.39 -0.17 0.00 -0.16 0.00 0.00 57.16 56.42 1dtd n GLU 384 Cb 0.37 -1.49 -0.01 0.00 1.43 0.00 0.00 31.44 31.74 1dtd n GLU 384 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 177.13 177.69 1dtd n HIS 385 N -0.84 -0.40 -0.04 -1.84 8.25 -0.92 -5.00 115.22 114.43 1dtd n HIS 385 Ca 0.10 -3.50 0.10 0.00 -0.26 0.00 0.00 57.72 54.17 1dtd n HIS 385 Cb 0.35 -0.04 0.50 0.00 1.12 0.00 0.00 29.99 31.92 1dtd n HIS 385 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 1dtd h PRO 386 N 3.05 0.38 -0.00 -0.41 0.11 -1.73 -1.84 132.00 131.56 1dtd h PRO 386 Ca 0.06 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.15 1dtd h PRO 386 Cb 0.99 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.01 1dtd h PRO 386 CO 0.43 0.25 -0.00 0.41 -0.21 0.00 0.00 178.00 178.89 1dtd n GLY 387 N -1.52 -0.68 0.00 -0.55 0.00 -1.26 -4.14 105.19 97.04 1dtd n GLY 387 Ca 0.07 -0.28 0.00 0.00 0.00 0.00 0.00 46.02 45.82 1dtd n GLY 387 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1dtd n LEU 388 N -0.63 1.78 -4.36 0.99 7.94 -1.02 -4.79 117.00 116.92 1dtd n LEU 388 Ca 0.22 0.00 -0.31 0.00 -1.11 0.00 0.00 56.01 54.81 1dtd n LEU 388 Cb 0.19 0.00 -0.15 0.00 0.53 0.00 0.00 43.42 43.99 1dtd n LEU 388 CO 0.18 0.30 -0.54 -0.69 -1.11 0.00 0.00 177.39 175.52 1dtd s VAL 389 N -1.75 2.31 0.06 1.96 1.01 -0.72 -1.19 120.40 122.07 1dtd s VAL 389 Ca 0.00 -1.05 -0.02 0.00 0.00 0.00 0.00 61.98 60.91 1dtd s VAL 389 Cb 0.00 -1.84 -0.03 0.00 0.00 0.00 0.00 36.38 34.51 1dtd s VAL 389 CO 0.00 0.55 0.00 -0.94 0.00 0.00 0.00 175.10 174.72 1dtd s SER 390 N -0.72 0.43 -0.19 3.32 1.04 -0.50 -4.59 113.70 112.49 1dtd s SER 390 Ca 0.11 -0.95 -0.08 0.00 0.48 0.00 0.00 55.95 55.51 1dtd s SER 390 Cb -0.10 0.22 -0.04 0.00 0.10 0.00 0.00 66.02 66.20 1dtd s SER 390 CO -0.00 -0.62 0.07 -0.75 0.98 0.00 0.00 173.24 172.92 1dtd s LYS 391 N -3.91 3.96 -0.19 4.02 2.20 -1.26 -0.59 119.74 123.97 1dtd s LYS 391 Ca 0.07 -0.35 -0.00 0.00 -0.36 0.00 0.00 55.97 55.34 1dtd s LYS 391 Cb 0.08 -3.25 0.01 0.00 -1.51 0.00 0.00 37.83 33.15 1dtd s LYS 391 CO -0.10 0.22 -0.16 0.08 -0.36 0.00 0.00 175.35 175.03 1dtd s VAL 392 N 0.52 2.37 -0.11 4.02 1.01 -0.14 -4.97 120.40 123.10 1dtd s VAL 392 Ca 0.04 -0.84 -0.18 0.00 0.00 0.00 0.00 61.98 61.00 1dtd s VAL 392 Cb -0.13 -2.01 -0.04 0.00 0.00 0.00 0.00 36.38 34.20 1dtd s VAL 392 CO 0.01 0.51 0.47 0.21 0.00 0.00 0.00 175.10 176.30 1dtd s ASN 393 N 1.29 6.69 0.00 3.32 3.84 -1.26 -0.71 114.94 128.10 1dtd s ASN 393 Ca 0.04 0.82 0.10 0.00 0.21 0.00 0.00 52.86 54.03 1dtd s ASN 393 Cb -0.13 -2.28 0.03 0.00 -0.55 0.00 0.00 41.25 38.31 1dtd s ASN 393 CO -0.10 0.02 0.71 2.30 -2.79 0.00 0.00 177.10 177.24 1dtd n ILE 394 N 3.55 0.00 -2.92 -5.21 -5.35 -0.54 -5.00 119.36 103.89 1dtd n ILE 394 Ca -0.08 -0.44 0.00 0.00 -0.27 0.00 0.00 62.75 61.96 1dtd n ILE 394 Cb 0.52 1.16 0.00 0.00 -1.74 0.00 0.00 39.64 39.57 1dtd n ILE 394 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1dtd n GLY 395 N 0.76 -0.51 3.19 3.28 0.00 -1.24 -4.76 105.19 105.90 1dtd n GLY 395 Ca 0.05 -0.97 -0.10 0.00 0.00 0.00 0.00 46.02 45.00 1dtd n GLY 395 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1dtd s SER 396 N -4.00 0.09 0.86 1.61 1.04 -1.26 -1.01 113.70 111.02 1dtd s SER 396 Ca 0.00 -0.51 -0.12 0.00 0.48 0.00 0.00 55.95 55.81 1dtd s SER 396 Cb 0.00 0.31 0.15 0.00 0.10 0.00 0.00 66.02 66.57 1dtd s SER 396 CO 0.00 -0.63 1.20 -0.94 0.98 0.00 0.00 173.24 173.85 1dtd s SER 397 N -2.43 3.82 0.18 7.02 1.04 0.15 -4.31 113.70 119.16 1dtd s SER 397 Ca -0.01 0.30 -0.13 0.00 0.48 0.00 0.00 55.95 56.59 1dtd s SER 397 Cb 0.02 -0.57 0.13 0.00 0.10 0.00 0.00 66.02 65.69 1dtd s SER 397 CO -0.07 -2.28 1.78 0.15 0.98 0.00 0.00 173.24 173.81 1dtd h PHE 398 N -1.21 0.45 -0.20 5.02 3.04 -1.95 -0.05 116.94 122.03 1dtd h PHE 398 Ca -0.44 0.02 -0.04 0.00 3.98 0.00 0.00 57.97 61.49 1dtd h PHE 398 Cb 1.27 -0.13 -0.02 0.00 2.56 0.00 0.00 35.95 39.62 1dtd h PHE 398 CO -0.51 0.22 0.05 0.39 -2.02 0.00 0.00 178.31 176.44 1dtd n GLU 399 N -4.89 1.92 -1.24 1.11 1.02 -1.26 -4.91 120.64 112.38 1dtd n GLU 399 Ca 0.04 -0.90 -0.08 0.00 -0.02 0.00 0.00 57.16 56.20 1dtd n GLU 399 Cb 0.13 -1.62 -0.04 0.00 -0.02 0.00 0.00 31.44 29.90 1dtd n GLU 399 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1dtd n ASN 400 N 0.14 -4.18 -4.76 1.62 4.13 -0.03 -5.02 115.26 107.14 1dtd n ASN 400 Ca 0.11 0.21 -0.39 0.00 1.68 0.00 0.00 54.58 56.18 1dtd n ASN 400 Cb 0.61 -2.42 -0.06 0.00 -1.54 0.00 0.00 39.78 36.37 1dtd n ASN 400 CO 0.00 0.00 0.00 -0.13 0.28 0.00 0.00 177.26 177.41 1dtd s ARG 401 N -2.57 4.72 0.26 3.52 0.52 -1.26 -4.62 118.95 119.52 1dtd s ARG 401 Ca 0.00 1.38 -0.30 0.00 -0.52 0.00 0.00 55.73 56.29 1dtd s ARG 401 Cb 0.00 -3.13 -0.10 0.00 0.52 0.00 0.00 34.95 32.24 1dtd s ARG 401 CO 0.00 0.46 1.40 -1.25 0.02 0.00 0.00 175.30 175.92 1dtd s PRO 402 N -1.45 4.30 -0.71 3.54 0.04 -1.26 0.30 135.00 139.76 1dtd s PRO 402 Ca 0.43 2.25 -0.18 0.00 0.04 0.00 0.00 61.00 63.55 1dtd s PRO 402 Cb -0.23 -3.11 0.14 0.00 0.04 0.00 0.00 34.50 31.33 1dtd s PRO 402 CO 0.28 -0.36 0.79 -1.64 0.04 0.00 0.00 177.00 176.12 1dtd s MET 403 N -0.61 3.28 -0.21 4.56 -1.94 -0.18 -4.82 119.30 119.38 1dtd s MET 403 Ca 0.57 -1.70 -0.08 0.00 -1.71 0.00 0.00 55.69 52.76 1dtd s MET 403 Cb -0.41 -4.43 -0.04 0.00 2.01 0.00 0.00 34.83 31.96 1dtd s MET 403 CO 0.44 -1.52 0.09 -0.80 -0.01 0.00 0.00 175.02 173.23 1dtd s ASN 404 N 3.28 5.64 0.00 3.03 0.02 -1.26 -1.46 114.94 124.19 1dtd s ASN 404 Ca 0.17 0.02 -0.00 0.00 -1.02 0.00 0.00 52.86 52.02 1dtd s ASN 404 Cb -0.17 -1.99 -0.04 0.00 0.02 0.00 0.00 41.25 39.07 1dtd s ASN 404 CO -0.01 0.09 0.09 -0.69 0.02 0.00 0.00 177.10 176.60 1dtd s VAL 405 N 0.85 4.75 -0.16 1.60 1.01 0.11 -4.64 120.40 123.91 1dtd s VAL 405 Ca 0.05 -0.43 -0.15 0.00 0.00 0.00 0.00 61.98 61.45 1dtd s VAL 405 Cb -0.13 -3.18 -0.04 0.00 0.00 0.00 0.00 36.38 33.02 1dtd s VAL 405 CO 0.03 0.33 0.35 -0.76 0.00 0.00 0.00 175.10 175.04 1dtd s LEU 406 N -1.81 4.23 -0.24 3.92 1.43 0.40 -0.97 118.68 125.64 1dtd s LEU 406 Ca 0.24 0.56 -0.07 0.00 -1.03 0.00 0.00 54.13 53.83 1dtd s LEU 406 Cb -0.12 -2.46 -0.03 0.00 0.03 0.00 0.00 46.19 43.61 1dtd s LEU 406 CO 0.15 0.04 0.05 -0.75 0.23 0.00 0.00 176.35 176.07 1dtd s LYS 407 N 0.69 3.62 -0.26 1.70 2.20 0.24 -0.88 119.74 127.05 1dtd s LYS 407 Ca 0.19 -0.50 -0.10 0.00 -0.36 0.00 0.00 55.97 55.20 1dtd s LYS 407 Cb -0.14 -3.26 -0.05 0.00 -1.51 0.00 0.00 37.83 32.87 1dtd s LYS 407 CO 0.06 -0.17 0.16 -0.06 -0.36 0.00 0.00 175.35 174.97 1dtd s PHE 408 N 1.55 3.21 -0.12 4.03 0.40 0.17 -1.41 117.98 125.81 1dtd s PHE 408 Ca 0.06 0.04 -0.18 0.00 -0.60 0.00 0.00 56.93 56.25 1dtd s PHE 408 Cb -0.15 -2.32 0.04 0.00 0.51 0.00 0.00 43.02 41.10 1dtd s PHE 408 CO 0.02 -0.14 0.46 0.45 0.70 0.00 0.00 175.22 176.71 1dtd s SER 409 N 1.55 -0.44 0.00 1.36 0.15 -0.34 -1.67 113.70 114.32 1dtd s SER 409 Ca 0.07 0.72 0.23 0.00 0.70 0.00 0.00 55.95 57.66 1dtd s SER 409 Cb -0.15 0.76 0.07 0.00 -1.71 0.00 0.00 66.02 64.98 1dtd s SER 409 CO 0.08 -0.29 1.14 0.41 1.20 0.00 0.00 173.24 175.79 1dtd n THR 410 N 2.22 0.00 0.00 6.45 -1.04 -1.26 -4.40 114.28 116.24 1dtd n THR 410 Ca -0.16 -0.36 0.00 0.00 -2.04 0.00 0.00 64.05 61.49 1dtd n THR 410 Cb 0.57 1.35 0.00 0.00 -1.82 0.00 0.00 70.33 70.43 1dtd n THR 410 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1dtd n GLY 411 N 1.37 2.52 0.00 3.41 0.00 -1.26 -5.10 105.19 106.13 1dtd n GLY 411 Ca 0.11 -1.92 0.00 0.00 0.00 0.00 0.00 46.02 44.21 1dtd n GLY 411 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1dtd n GLY 412 N 1.18 2.07 3.51 -0.02 0.00 -1.26 -4.90 105.19 105.77 1dtd n GLY 412 Ca 0.00 -1.95 -0.43 0.00 0.00 0.00 0.00 46.02 43.64 1dtd n GLY 412 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1dtd s ASP 413 N 0.00 6.29 0.11 1.61 2.15 -1.26 -5.00 116.67 120.57 1dtd s ASP 413 Ca 0.00 -0.49 -0.01 0.00 0.43 0.00 0.00 52.55 52.48 1dtd s ASP 413 Cb 0.00 -2.44 -0.04 0.00 -0.30 0.00 0.00 42.92 40.14 1dtd s ASP 413 CO 0.00 -1.33 0.04 -1.59 -0.17 0.00 0.00 175.17 172.12 1dtd s LYS 414 N 4.13 0.83 1.10 4.34 -2.85 -1.26 -5.14 119.74 120.89 1dtd s LYS 414 Ca 0.29 -1.36 -0.13 0.00 -1.00 0.00 0.00 55.97 53.78 1dtd s LYS 414 Cb -0.13 0.24 0.25 0.00 -2.06 0.00 0.00 37.83 36.12 1dtd s LYS 414 CO 0.17 -0.22 1.05 -1.25 0.10 0.00 0.00 175.35 175.21 1dtd s PRO 415 N -4.01 -0.38 0.06 1.78 0.04 -1.26 -4.76 135.00 126.48 1dtd s PRO 415 Ca 0.19 0.74 -0.02 0.00 0.04 0.00 0.00 61.00 61.94 1dtd s PRO 415 Cb 0.08 -1.62 -0.03 0.00 0.04 0.00 0.00 34.50 32.96 1dtd s PRO 415 CO -0.02 -3.33 0.01 0.00 0.04 0.00 0.00 177.00 173.70 1dtd s ALA 416 N -2.65 0.39 -0.14 8.56 0.00 -0.37 -1.41 121.76 126.14 1dtd s ALA 416 Ca 0.67 -1.11 -0.03 0.00 0.00 0.00 0.00 51.96 51.49 1dtd s ALA 416 Cb -0.23 0.33 -0.03 0.00 0.00 0.00 0.00 23.12 23.19 1dtd s ALA 416 CO 0.62 -0.40 -0.04 0.42 0.00 0.00 0.00 175.76 176.36 1dtd s ILE 417 N -3.91 3.90 -0.14 0.00 1.01 -0.29 -0.52 121.20 121.24 1dtd s ILE 417 Ca 0.07 -0.36 -0.06 0.00 0.00 0.00 0.00 60.65 60.30 1dtd s ILE 417 Cb 0.07 -2.69 -0.04 0.00 0.01 0.00 0.00 42.46 39.81 1dtd s ILE 417 CO -0.10 0.51 0.05 0.86 0.00 0.00 0.00 174.94 176.26 1dtd s TRP 418 N 0.18 3.26 -0.05 3.97 -0.11 -0.20 -0.85 118.94 125.15 1dtd s TRP 418 Ca -0.02 0.15 0.01 0.00 1.22 0.00 0.00 56.10 57.46 1dtd s TRP 418 Cb -0.14 -1.97 0.02 0.00 -1.50 0.00 0.00 33.47 29.89 1dtd s TRP 418 CO 0.03 0.32 -0.06 -1.17 -4.62 0.00 0.00 176.95 171.45 1dtd s LEU 419 N -0.20 1.33 0.17 5.86 2.96 0.04 -0.92 118.68 127.91 1dtd s LEU 419 Ca 0.07 -0.17 0.03 0.00 -0.22 0.00 0.00 54.13 53.85 1dtd s LEU 419 Cb -0.12 -0.54 -0.05 0.00 0.50 0.00 0.00 46.19 45.98 1dtd s LEU 419 CO 0.01 -0.05 -0.05 1.51 -1.32 0.00 0.00 176.35 176.45 1dtd s ASP 420 N 0.99 1.63 0.08 3.68 3.84 -0.38 -1.20 116.67 125.30 1dtd s ASP 420 Ca -0.10 -1.10 -0.12 0.00 -0.00 0.00 0.00 52.55 51.23 1dtd s ASP 420 Cb -0.14 0.03 0.02 0.00 -1.38 0.00 0.00 42.92 41.44 1dtd s ASP 420 CO -0.00 -0.44 0.28 0.00 -0.00 0.00 0.00 175.17 175.01 1dtd s ALA 421 N -3.44 -0.56 -0.63 2.11 0.00 -0.46 -0.90 121.76 117.88 1dtd s ALA 421 Ca 0.21 -0.26 0.00 0.00 0.00 0.00 0.00 51.96 51.91 1dtd s ALA 421 Cb 0.04 0.48 0.00 0.00 0.00 0.00 0.00 23.12 23.65 1dtd s ALA 421 CO 0.03 -0.51 0.00 0.41 0.00 0.00 0.00 175.76 175.69 1dtd n GLY 422 N 0.12 0.60 0.25 0.00 0.00 -1.25 -1.47 105.19 103.43 1dtd n GLY 422 Ca -0.17 -0.72 0.01 0.00 0.00 0.00 0.00 46.02 45.15 1dtd n GLY 422 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1dtd h ILE 423 N 0.00 1.19 -3.76 -0.61 2.10 -1.90 -2.78 117.51 111.75 1dtd h ILE 423 Ca -0.14 -0.83 -0.65 0.00 1.08 0.00 0.00 64.86 64.33 1dtd h ILE 423 Cb 0.66 1.15 -0.20 0.00 -1.09 0.00 0.00 36.82 37.35 1dtd h ILE 423 CO 0.19 0.27 -0.58 -1.00 -1.08 0.00 0.00 178.15 175.95 1dtd s HIS 424 N -4.77 3.15 0.18 2.19 3.76 -1.26 -4.57 115.29 113.97 1dtd s HIS 424 Ca -0.06 -0.18 -0.17 0.00 -0.15 0.00 0.00 55.06 54.50 1dtd s HIS 424 Cb 0.15 -2.31 0.13 0.00 1.11 0.00 0.00 32.58 31.67 1dtd s HIS 424 CO 0.75 -0.27 1.65 0.00 -0.85 0.00 0.00 174.74 176.01 1dtd h ALA 425 N 8.30 0.26 0.00 -1.40 0.00 -1.63 -2.58 119.26 122.21 1dtd h ALA 425 Ca -0.37 0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1dtd h ALA 425 Cb 1.18 0.39 0.00 0.00 0.00 0.00 0.00 17.79 19.36 1dtd h ALA 425 CO 0.57 -0.47 0.00 2.89 0.00 0.00 0.00 179.25 182.23 1dtd n ARG 426 N -5.36 0.03 -2.16 0.00 1.85 -0.70 -4.24 116.66 106.08 1dtd n ARG 426 Ca 0.04 0.24 -0.42 0.00 -1.00 0.00 0.00 57.85 56.70 1dtd n ARG 426 Cb 0.26 -1.50 0.00 0.00 -1.05 0.00 0.00 32.46 30.18 1dtd n ARG 426 CO 0.00 0.00 0.00 0.39 -0.01 0.00 0.00 177.63 178.01 1dtd n GLU 427 N -1.47 3.55 0.27 2.89 1.02 -0.97 -4.79 120.64 121.15 1dtd n GLU 427 Ca 0.04 -3.31 0.11 0.00 -0.02 0.00 0.00 57.16 53.98 1dtd n GLU 427 Cb 0.16 -2.97 0.75 0.00 -0.02 0.00 0.00 31.44 29.36 1dtd n GLU 427 CO 0.00 0.00 0.00 -1.49 1.18 0.00 0.00 177.13 176.82 1dtd h TRP 428 N 5.68 0.00 0.00 -0.32 4.06 -1.80 -0.60 115.95 122.96 1dtd h TRP 428 Ca 0.46 0.00 -0.02 0.00 2.06 0.00 0.00 58.89 61.40 1dtd h TRP 428 Cb 0.60 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.75 1dtd h TRP 428 CO 1.33 0.02 -0.07 -0.24 -3.56 0.00 0.00 178.44 175.92 1dtd h VAL 429 N 0.00 0.52 0.06 1.49 3.04 -1.87 -2.83 116.25 116.66 1dtd h VAL 429 Ca -0.00 -0.34 -0.00 0.00 -1.01 0.00 0.00 66.70 65.35 1dtd h VAL 429 Cb 0.03 1.22 0.00 0.00 -2.01 0.00 0.00 31.29 30.53 1dtd h VAL 429 CO 0.00 0.07 -0.03 0.71 -1.01 0.00 0.00 177.57 177.32 1dtd h THR 430 N 0.00 1.18 -0.75 3.17 1.35 -1.44 -1.05 112.91 115.37 1dtd h THR 430 Ca -0.00 -0.81 -0.01 0.00 -0.55 0.00 0.00 66.41 65.04 1dtd h THR 430 Cb 0.21 1.71 -0.04 0.00 -1.73 0.00 0.00 68.15 68.31 1dtd h THR 430 CO 0.01 0.20 0.44 1.56 -0.25 0.00 0.00 175.52 177.48 1dtd h GLN 431 N -0.44 1.02 -0.68 4.72 7.50 -1.67 -1.15 115.11 124.41 1dtd h GLN 431 Ca -0.01 -0.10 -0.02 0.00 0.50 0.00 0.00 58.65 59.03 1dtd h GLN 431 Cb 0.39 -0.21 -0.03 0.00 0.05 0.00 0.00 27.48 27.68 1dtd h GLN 431 CO 0.01 0.73 0.36 0.00 -1.50 0.00 0.00 178.83 178.43 1dtd h ALA 432 N 1.23 0.87 -0.65 3.87 0.00 -1.50 -1.69 119.26 121.39 1dtd h ALA 432 Ca 0.27 -0.12 -0.05 0.00 0.00 0.00 0.00 54.91 55.01 1dtd h ALA 432 Cb -0.02 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.47 1dtd h ALA 432 CO -0.05 0.40 0.22 1.15 0.00 0.00 0.00 179.25 180.97 1dtd h THR 433 N 0.93 1.25 -0.81 0.00 2.02 -0.96 -2.04 112.91 113.31 1dtd h THR 433 Ca 0.24 -0.82 -0.01 0.00 0.77 0.00 0.00 66.41 66.59 1dtd h THR 433 Cb 0.06 0.56 -0.04 0.00 -1.74 0.00 0.00 68.15 66.99 1dtd h THR 433 CO -0.04 0.32 0.46 0.00 0.37 0.00 0.00 175.52 176.63 1dtd h ALA 434 N 1.09 1.03 -0.52 6.16 0.00 -0.89 -0.69 119.26 125.44 1dtd h ALA 434 Ca 0.21 -0.11 -0.11 0.00 0.00 0.00 0.00 54.91 54.89 1dtd h ALA 434 Cb 0.27 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 1dtd h ALA 434 CO -0.01 0.53 -0.12 1.25 0.00 0.00 0.00 179.25 180.90 1dtd h LEU 435 N 1.12 1.01 -0.81 0.00 5.85 -1.12 -1.71 115.31 119.65 1dtd h LEU 435 Ca 0.29 -0.36 -0.11 0.00 0.84 0.00 0.00 57.88 58.54 1dtd h LEU 435 Cb 0.01 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 40.75 1dtd h LEU 435 CO -0.05 1.13 -0.28 -0.25 -0.34 0.00 0.00 178.44 178.65 1dtd h TRP 436 N 0.87 0.66 -0.74 1.25 7.01 -1.18 -2.57 115.95 121.25 1dtd h TRP 436 Ca 0.13 -0.15 -0.02 0.00 2.11 0.00 0.00 58.89 60.96 1dtd h TRP 436 Cb 0.68 -0.16 -0.03 0.00 -2.10 0.00 0.00 29.16 27.55 1dtd h TRP 436 CO 0.05 0.80 0.37 1.15 -2.79 0.00 0.00 178.44 178.02 1dtd h THR 437 N 0.50 1.24 -0.53 2.65 2.02 -0.76 0.09 112.91 118.12 1dtd h THR 437 Ca 0.07 -0.65 0.05 0.00 0.77 0.00 0.00 66.41 66.65 1dtd h THR 437 Cb 0.74 0.29 -0.05 0.00 -1.74 0.00 0.00 68.15 67.40 1dtd h THR 437 CO 0.06 0.27 0.27 0.00 0.37 0.00 0.00 175.52 176.49 1dtd h ALA 438 N 1.19 0.68 -0.61 6.16 0.00 -0.93 -1.14 119.26 124.61 1dtd h ALA 438 Ca 0.26 0.03 -0.09 0.00 0.00 0.00 0.00 54.91 55.10 1dtd h ALA 438 Cb 0.10 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1dtd h ALA 438 CO -0.03 -0.08 0.01 -0.97 0.00 0.00 0.00 179.25 178.18 1dtd h ASN 439 N 0.51 1.04 -0.68 0.00 -1.24 -1.17 -2.92 115.58 111.12 1dtd h ASN 439 Ca 0.24 -0.30 -0.03 0.00 0.71 0.00 0.00 56.30 56.91 1dtd h ASN 439 Cb 0.15 -0.28 -0.03 0.00 0.73 0.00 0.00 38.32 38.89 1dtd h ASN 439 CO -0.17 1.09 0.31 0.50 -1.29 0.00 0.00 177.43 177.87 1dtd h LYS 440 N 0.97 1.02 -0.09 6.67 1.63 -0.58 -1.04 116.57 125.15 1dtd h LYS 440 Ca 0.17 -0.16 -0.01 0.00 -0.85 0.00 0.00 60.65 59.81 1dtd h LYS 440 Cb 0.54 -0.18 -0.00 0.00 -0.60 0.00 0.00 32.23 31.99 1dtd h LYS 440 CO 0.03 0.81 0.02 0.82 -3.45 0.00 0.00 179.45 177.68 1dtd h ILE 441 N 1.01 1.21 -0.06 2.00 2.04 -1.10 -1.50 117.51 121.10 1dtd h ILE 441 Ca 0.24 -0.64 -0.07 0.00 1.00 0.00 0.00 64.86 65.39 1dtd h ILE 441 Cb 0.15 1.48 -0.01 0.00 -0.74 0.00 0.00 36.82 37.70 1dtd h ILE 441 CO -0.03 0.18 -0.28 -0.37 0.00 0.00 0.00 178.15 177.66 1dtd h VAL 442 N -0.09 1.23 -0.01 1.67 -1.51 -1.37 -1.04 116.25 115.13 1dtd h VAL 442 Ca 0.03 -1.07 -0.20 0.00 -1.23 0.00 0.00 66.70 64.23 1dtd h VAL 442 Cb 0.27 1.49 -0.01 0.00 -2.13 0.00 0.00 31.29 30.92 1dtd h VAL 442 CO 0.00 0.31 -0.87 0.28 -1.23 0.00 0.00 177.57 176.06 1dtd h SER 443 N 0.09 0.34 0.17 4.19 0.02 -0.99 -3.32 113.55 114.05 1dtd h SER 443 Ca 0.01 -0.27 0.00 0.00 -0.84 0.00 0.00 61.79 60.69 1dtd h SER 443 Cb 0.55 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 62.98 1dtd h SER 443 CO 0.04 1.06 -1.11 0.47 -1.14 0.00 0.00 176.83 176.15 1dtd n ASP 444 N -3.70 0.69 -4.70 3.07 9.92 -0.58 -4.86 116.55 116.39 1dtd n ASP 444 Ca -0.04 -0.55 -0.42 0.00 -0.53 0.00 0.00 54.79 53.25 1dtd n ASP 444 Cb 0.80 1.02 -0.03 0.00 -0.64 0.00 0.00 41.12 42.27 1dtd n ASP 444 CO 0.00 0.00 0.00 -0.47 0.13 0.00 0.00 177.20 176.86 1dtd s TYR 445 N -3.13 2.42 0.00 1.24 5.04 -0.40 -1.43 117.35 121.09 1dtd s TYR 445 Ca 0.05 0.10 0.00 0.00 -2.44 0.00 0.00 57.07 54.78 1dtd s TYR 445 Cb 0.15 -4.17 0.00 0.00 0.35 0.00 0.00 41.96 38.29 1dtd s TYR 445 CO 0.84 -4.70 0.00 0.41 -1.34 0.00 0.00 175.55 170.76 1dtd n GLY 446 N 4.15 2.19 0.53 8.97 0.00 -1.26 -4.81 105.19 114.95 1dtd n GLY 446 Ca 0.17 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.11 1dtd n GLY 446 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1dtd n LYS 447 N -2.00 0.30 -2.39 1.61 5.02 -0.51 -4.94 118.16 115.25 1dtd n LYS 447 Ca 0.00 0.12 -0.43 0.00 -2.02 0.00 0.00 58.31 55.99 1dtd n LYS 447 Cb 0.00 -1.01 -0.02 0.00 -0.02 0.00 0.00 35.03 33.97 1dtd n LYS 447 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1dtd s ASP 448 N -6.06 6.95 0.36 4.39 2.15 -0.65 -4.92 116.67 118.90 1dtd s ASP 448 Ca -0.17 1.82 0.05 0.00 0.43 0.00 0.00 52.55 54.68 1dtd s ASP 448 Cb 0.04 -2.55 0.70 0.00 -0.30 0.00 0.00 42.92 40.81 1dtd s ASP 448 CO 0.24 -0.70 1.95 -0.65 -0.17 0.00 0.00 175.17 175.85 1dtd h PRO 449 N 7.97 0.56 0.29 4.34 0.11 -1.92 -2.77 132.00 140.57 1dtd h PRO 449 Ca -0.31 -0.08 -0.01 0.00 0.11 0.00 0.00 66.00 65.70 1dtd h PRO 449 Cb 1.14 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.15 1dtd h PRO 449 CO 0.93 0.48 -0.14 0.77 -0.21 0.00 0.00 178.00 179.83 1dtd h SER 450 N 0.56 -0.32 -0.53 -2.05 0.02 -1.97 -1.91 113.55 107.35 1dtd h SER 450 Ca 0.14 -0.18 -0.02 0.00 -0.84 0.00 0.00 61.79 60.88 1dtd h SER 450 Cb 0.15 0.08 -0.03 0.00 0.14 0.00 0.00 62.40 62.74 1dtd h SER 450 CO -0.01 0.03 0.25 -0.29 -1.14 0.00 0.00 176.83 175.67 1dtd h ILE 451 N -0.72 1.20 -0.63 3.27 6.09 -1.91 -0.63 117.51 124.18 1dtd h ILE 451 Ca -0.04 -0.58 0.01 0.00 -1.37 0.00 0.00 64.86 62.88 1dtd h ILE 451 Cb 0.49 0.49 -0.03 0.00 0.47 0.00 0.00 36.82 38.24 1dtd h ILE 451 CO 0.06 0.24 0.41 0.74 -3.07 0.00 0.00 178.15 176.53 1dtd h THR 452 N 0.81 1.16 0.00 2.19 2.02 -1.46 -1.60 112.91 116.03 1dtd h THR 452 Ca 0.20 -0.30 -0.15 0.00 0.77 0.00 0.00 66.41 66.93 1dtd h THR 452 Cb 0.12 0.24 -0.02 0.00 -1.74 0.00 0.00 68.15 66.75 1dtd h THR 452 CO -0.02 0.16 -0.73 0.77 0.37 0.00 0.00 175.52 176.06 1dtd h SER 453 N 0.85 0.00 -0.11 4.18 4.64 -0.79 -2.17 113.55 120.16 1dtd h SER 453 Ca 0.23 0.00 0.01 0.00 -0.47 0.00 0.00 61.79 61.55 1dtd h SER 453 Cb -0.10 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 61.99 1dtd h SER 453 CO -0.05 0.73 0.06 0.40 -0.87 0.00 0.00 176.83 177.10 1dtd h ILE 454 N 0.00 1.00 0.00 0.95 2.04 -0.80 -2.77 117.51 117.93 1dtd h ILE 454 Ca -0.01 -0.04 0.00 0.00 1.00 0.00 0.00 64.86 65.81 1dtd h ILE 454 Cb 1.45 0.87 0.00 0.00 -0.74 0.00 0.00 36.82 38.40 1dtd h ILE 454 CO 0.10 0.02 0.00 -0.07 0.00 0.00 0.00 178.15 178.20 1dtd h LEU 455 N 0.12 0.00 -0.47 1.44 3.38 -1.17 0.16 115.31 118.77 1dtd h LEU 455 Ca 0.04 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.86 1dtd h LEU 455 Cb 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 1dtd h LEU 455 CO -0.03 0.00 -0.36 -0.78 0.09 0.00 0.00 178.44 177.36 1dtd h ASP 456 N 0.00 0.93 0.55 -0.43 3.58 -1.12 -3.33 116.42 116.60 1dtd h ASP 456 Ca 0.00 -0.41 -0.29 0.00 0.42 0.00 0.00 57.03 56.75 1dtd h ASP 456 Cb 0.56 -0.26 -0.01 0.00 1.72 0.00 0.00 39.33 41.34 1dtd h ASP 456 CO 0.00 1.19 -1.44 0.00 -2.88 0.00 0.00 179.24 176.11 1dtd h ALA 457 N 0.86 0.30 -2.46 -0.78 0.00 -1.20 -3.49 119.26 112.50 1dtd h ALA 457 Ca 0.07 -1.09 -0.18 0.00 0.00 0.00 0.00 54.91 53.71 1dtd h ALA 457 Cb 0.93 0.21 -0.17 0.00 0.00 0.00 0.00 17.79 18.76 1dtd h ALA 457 CO 0.09 1.17 -0.70 -0.51 0.00 0.00 0.00 179.25 179.30 1dtd s LEU 458 N -6.89 2.43 0.11 0.00 1.43 -0.02 -4.34 118.68 111.40 1dtd s LEU 458 Ca -0.07 -0.88 -0.04 0.00 -1.03 0.00 0.00 54.13 52.12 1dtd s LEU 458 Cb 0.07 0.04 -0.05 0.00 0.03 0.00 0.00 46.19 46.28 1dtd s LEU 458 CO 0.85 -0.46 0.32 -1.81 0.23 0.00 0.00 176.35 175.48 1dtd s ASP 459 N -2.60 6.46 -0.10 2.29 1.01 -0.50 -4.22 116.67 119.00 1dtd s ASP 459 Ca 0.04 0.51 0.02 0.00 0.71 0.00 0.00 52.55 53.83 1dtd s ASP 459 Cb 0.02 -2.06 -0.01 0.00 1.01 0.00 0.00 42.92 41.89 1dtd s ASP 459 CO -0.06 0.10 -0.19 -0.63 0.21 0.00 0.00 175.17 174.61 1dtd s ILE 460 N -1.59 2.53 -0.15 0.77 1.01 -0.67 -1.14 121.20 121.97 1dtd s ILE 460 Ca 0.38 -0.86 -0.01 0.00 0.00 0.00 0.00 60.65 60.17 1dtd s ILE 460 Cb -0.12 -2.01 -0.01 0.00 0.01 0.00 0.00 42.46 40.32 1dtd s ILE 460 CO 0.25 0.55 -0.12 -0.36 0.00 0.00 0.00 174.94 175.26 1dtd s PHE 461 N 0.23 2.84 -0.12 3.97 0.08 -0.03 -0.66 117.98 124.30 1dtd s PHE 461 Ca -0.12 -0.73 -0.01 0.00 0.12 0.00 0.00 56.93 56.19 1dtd s PHE 461 Cb -0.16 -1.90 0.03 0.00 -0.57 0.00 0.00 43.02 40.42 1dtd s PHE 461 CO 0.07 -0.29 -0.06 -1.17 -0.10 0.00 0.00 175.22 173.67 1dtd s LEU 462 N 0.59 1.14 -0.53 -0.37 1.98 -0.05 -0.78 118.68 120.64 1dtd s LEU 462 Ca -0.07 -0.33 -0.07 0.00 -2.89 0.00 0.00 54.13 50.77 1dtd s LEU 462 Cb -0.15 -0.77 0.14 0.00 0.66 0.00 0.00 46.19 46.06 1dtd s LEU 462 CO 0.03 -0.15 0.39 -0.22 -1.89 0.00 0.00 176.35 174.52 1dtd s LEU 463 N 1.75 5.65 0.26 -0.68 2.96 -0.34 -0.45 118.68 127.83 1dtd s LEU 463 Ca 0.04 -2.22 -0.00 0.00 -0.22 0.00 0.00 54.13 51.73 1dtd s LEU 463 Cb -0.13 -1.97 0.34 0.00 0.50 0.00 0.00 46.19 44.93 1dtd s LEU 463 CO -0.08 -0.59 1.71 -0.65 -1.32 0.00 0.00 176.35 175.43 1dtd h PRO 464 N 8.01 0.62 -3.10 0.98 0.11 -1.83 -1.21 132.00 135.58 1dtd h PRO 464 Ca -0.12 -0.22 -0.61 0.00 0.11 0.00 0.00 66.00 65.16 1dtd h PRO 464 Cb 1.04 -0.05 -0.40 0.00 0.11 0.00 0.00 31.00 31.70 1dtd h PRO 464 CO 0.79 0.77 -0.73 0.08 -0.21 0.00 0.00 178.00 178.70 1dtd s VAL 465 N -4.64 1.43 0.06 3.15 1.01 -1.25 -4.23 120.40 115.92 1dtd s VAL 465 Ca -0.08 -2.48 0.19 0.00 0.00 0.00 0.00 61.98 59.62 1dtd s VAL 465 Cb 0.14 -2.01 0.14 0.00 0.00 0.00 0.00 36.38 34.65 1dtd s VAL 465 CO 0.81 -0.86 1.67 0.74 0.00 0.00 0.00 175.10 177.46 1dtd h THR 466 N 5.42 0.78 -2.55 3.92 2.02 -1.37 -3.37 112.91 117.75 1dtd h THR 466 Ca -0.03 -1.61 -0.60 0.00 0.77 0.00 0.00 66.41 64.94 1dtd h THR 466 Cb 0.94 2.03 -0.41 0.00 -1.74 0.00 0.00 68.15 68.97 1dtd h THR 466 CO 0.49 0.36 -0.74 -3.20 0.37 0.00 0.00 175.52 172.80 1dtd n ASN 467 N -3.40 2.08 -0.06 4.18 5.15 -1.05 -4.88 115.26 117.28 1dtd n ASN 467 Ca 0.01 -3.02 -0.03 0.00 -0.60 0.00 0.00 54.58 50.93 1dtd n ASN 467 Cb 0.55 -0.68 0.20 0.00 -0.53 0.00 0.00 39.78 39.33 1dtd n ASN 467 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 1dtd h PRO 468 N 4.93 0.67 -0.26 1.20 0.13 -1.88 -1.56 132.00 135.22 1dtd h PRO 468 Ca 0.18 -0.18 -0.02 0.00 -0.87 0.00 0.00 66.00 65.10 1dtd h PRO 468 Cb 0.78 -0.08 -0.01 0.00 0.13 0.00 0.00 31.00 31.82 1dtd h PRO 468 CO 0.64 0.72 0.07 -0.44 -0.23 0.00 0.00 178.00 178.76 1dtd h ASP 469 N 0.63 0.39 -0.60 1.44 3.32 -1.96 -1.44 116.42 118.20 1dtd h ASP 469 Ca 0.12 -0.22 -0.03 0.00 0.02 0.00 0.00 57.03 56.92 1dtd h ASP 469 Cb 0.46 -0.10 -0.03 0.00 0.22 0.00 0.00 39.33 39.87 1dtd h ASP 469 CO 0.02 0.51 0.27 1.23 -1.72 0.00 0.00 179.24 179.56 1dtd h GLY 470 N 0.26 0.94 0.82 2.75 0.00 -1.76 -1.89 103.07 104.19 1dtd h GLY 470 Ca 0.08 -0.48 0.02 0.00 0.00 0.00 0.00 47.33 46.95 1dtd h GLY 470 CO -0.00 0.46 0.06 -1.82 0.00 0.00 0.00 176.54 175.24 1dtd h TYR 471 N 0.83 0.11 -0.59 5.60 5.03 -0.88 -0.21 116.97 126.86 1dtd h TYR 471 Ca 0.21 0.01 -0.03 0.00 2.58 0.00 0.00 58.73 61.50 1dtd h TYR 471 Cb 0.15 -0.02 -0.03 0.00 1.55 0.00 0.00 36.73 38.38 1dtd h TYR 471 CO 0.00 0.05 0.27 0.28 -1.32 0.00 0.00 178.16 177.44 1dtd h VAL 472 N 0.15 1.22 -0.92 1.81 2.07 -1.19 -1.76 116.25 117.63 1dtd h VAL 472 Ca 0.09 -0.63 0.01 0.00 0.82 0.00 0.00 66.70 66.99 1dtd h VAL 472 Cb 0.07 0.53 -0.05 0.00 -1.52 0.00 0.00 31.29 30.32 1dtd h VAL 472 CO -0.10 0.25 0.60 0.15 0.02 0.00 0.00 177.57 178.49 1dtd h PHE 473 N 0.81 1.16 0.00 1.57 3.57 -1.12 -1.68 116.94 121.26 1dtd h PHE 473 Ca 0.20 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.69 1dtd h PHE 473 Cb 0.14 -0.39 -0.01 0.00 2.79 0.00 0.00 35.95 38.48 1dtd h PHE 473 CO 0.00 0.74 -0.18 0.66 -2.23 0.00 0.00 178.31 177.31 1dtd h SER 474 N 1.25 0.00 1.25 0.41 4.64 -0.57 0.68 113.55 121.20 1dtd h SER 474 Ca 0.33 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.65 1dtd h SER 474 Cb -0.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 61.97 1dtd h SER 474 CO -0.07 0.18 -0.68 1.56 -0.87 0.00 0.00 176.83 176.95 1dtd h GLN 475 N 0.00 0.00 0.00 4.77 4.20 -0.56 -3.24 115.11 120.27 1dtd h GLN 475 Ca -0.00 0.00 -0.12 0.00 0.06 0.00 0.00 58.65 58.58 1dtd h GLN 475 Cb 0.49 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.25 1dtd h GLN 475 CO 0.02 0.00 -1.47 0.25 -0.67 0.00 0.00 178.83 176.96 1dtd n THR 476 N -2.72 0.48 -0.01 -0.54 -2.24 -0.71 -4.96 114.28 103.58 1dtd n THR 476 Ca 0.02 -0.20 -0.02 0.00 -2.27 0.00 0.00 64.05 61.57 1dtd n THR 476 Cb 0.53 -0.80 -0.01 0.00 -2.10 0.00 0.00 70.33 67.95 1dtd n THR 476 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1dtd n LYS 477 N -2.64 0.05 -3.66 -0.78 4.76 0.15 -5.03 118.16 111.00 1dtd n LYS 477 Ca -0.14 0.02 -0.27 0.00 -2.87 0.00 0.00 58.31 55.05 1dtd n LYS 477 Cb 0.67 -0.60 -0.17 0.00 -1.84 0.00 0.00 35.03 33.09 1dtd n LYS 477 CO 0.00 0.00 0.00 1.21 -1.37 0.00 0.00 177.40 177.24 1dtd s ASN 478 N -5.16 2.63 0.49 4.39 3.04 -0.71 -5.02 114.94 114.60 1dtd s ASN 478 Ca -0.03 -0.73 0.32 0.00 0.04 0.00 0.00 52.86 52.46 1dtd s ASN 478 Cb 0.01 -0.40 1.42 0.00 -1.54 0.00 0.00 41.25 40.75 1dtd s ASN 478 CO 0.04 -0.33 1.96 -0.09 -3.04 0.00 0.00 177.10 175.64 1dtd h ARG 479 N 8.34 0.00 -0.68 0.43 9.65 -1.83 -2.11 114.38 128.18 1dtd h ARG 479 Ca -0.16 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.72 1dtd h ARG 479 Cb 1.13 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.71 1dtd h ARG 479 CO 0.32 0.00 0.00 -1.33 2.80 0.00 0.00 179.97 181.76 1dtd n MET 480 N -2.84 3.56 -2.08 0.20 2.81 -1.26 -4.64 117.12 112.87 1dtd n MET 480 Ca 0.00 -2.85 -0.41 0.00 -1.81 0.00 0.00 57.70 52.64 1dtd n MET 480 Cb 0.24 -1.84 -0.02 0.00 -0.71 0.00 0.00 33.22 30.88 1dtd n MET 480 CO 0.00 0.00 0.00 -0.46 1.51 0.00 0.00 175.97 177.02 1dtd s TRP 481 N -1.69 3.03 -0.08 2.03 -0.11 -0.79 -4.85 118.94 116.47 1dtd s TRP 481 Ca 0.51 1.31 -0.02 0.00 1.22 0.00 0.00 56.10 59.12 1dtd s TRP 481 Cb 0.32 -3.72 -0.04 0.00 -1.50 0.00 0.00 33.47 28.52 1dtd s TRP 481 CO 0.27 -2.09 -0.09 -2.13 -4.62 0.00 0.00 176.95 168.28 1dtd n ARG 482 N 1.19 0.19 -0.98 5.86 0.63 -1.26 -1.72 116.66 120.56 1dtd n ARG 482 Ca 0.02 0.07 -0.18 0.00 -0.92 0.00 0.00 57.85 56.83 1dtd n ARG 482 Cb 0.41 -0.95 0.14 0.00 0.45 0.00 0.00 32.46 32.51 1dtd n ARG 482 CO 0.00 0.00 0.00 1.63 -2.51 0.00 0.00 177.63 176.75 1dtd n LYS 483 N -3.12 -1.38 -0.43 -0.14 5.02 -1.26 -2.46 118.16 114.38 1dtd n LYS 483 Ca -0.16 -1.21 -0.09 0.00 -2.02 0.00 0.00 58.31 54.83 1dtd n LYS 483 Cb 0.63 -0.91 0.07 0.00 -0.02 0.00 0.00 35.03 34.80 1dtd n LYS 483 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1dtd n THR 484 N -3.45 0.00 -1.24 -0.18 -2.24 -0.50 -4.45 114.28 102.21 1dtd n THR 484 Ca 0.10 -0.21 0.08 0.00 -2.27 0.00 0.00 64.05 61.74 1dtd n THR 484 Cb 0.36 -1.41 0.17 0.00 -2.10 0.00 0.00 70.33 67.36 1dtd n THR 484 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1dtd n ARG 485 N -2.24 1.54 -1.66 -0.78 5.12 -1.26 -4.10 116.66 113.27 1dtd n ARG 485 Ca 0.05 -2.85 -0.33 0.00 -1.93 0.00 0.00 57.85 52.79 1dtd n ARG 485 Cb 0.18 -1.58 0.06 0.00 -1.16 0.00 0.00 32.46 29.95 1dtd n ARG 485 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 1dtd s SER 486 N -2.89 4.96 0.04 0.55 1.04 -1.26 -4.61 113.70 111.53 1dtd s SER 486 Ca 0.35 2.00 -0.17 0.00 0.48 0.00 0.00 55.95 58.61 1dtd s SER 486 Cb 0.32 -2.55 -0.06 0.00 0.10 0.00 0.00 66.02 63.83 1dtd s SER 486 CO 0.00 -1.73 0.49 -0.54 0.98 0.00 0.00 173.24 172.44 1dtd s LYS 487 N -4.20 4.06 -0.02 4.02 -0.14 -1.26 -0.52 119.74 121.69 1dtd s LYS 487 Ca 0.67 0.57 -0.30 0.00 -1.36 0.00 0.00 55.97 55.55 1dtd s LYS 487 Cb -0.20 -3.22 -0.03 0.00 -1.68 0.00 0.00 37.83 32.70 1dtd s LYS 487 CO 0.44 0.66 1.03 0.08 -0.76 0.00 0.00 175.35 176.80 1dtd s VAL 488 N -1.11 4.69 -2.00 3.17 1.01 -1.26 -4.92 120.40 119.99 1dtd s VAL 488 Ca 0.27 1.94 0.06 0.00 0.00 0.00 0.00 61.98 64.25 1dtd s VAL 488 Cb -0.18 -4.24 0.18 0.00 0.00 0.00 0.00 36.38 32.13 1dtd s VAL 488 CO 0.16 0.11 0.80 -1.20 0.00 0.00 0.00 175.10 174.97 1dtd n SER 489 N 4.22 0.00 0.00 3.32 7.64 -1.26 -3.20 113.62 124.34 1dtd n SER 489 Ca 0.07 -0.68 0.00 0.00 1.01 0.00 0.00 58.87 59.27 1dtd n SER 489 Cb 0.50 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.70 1dtd n SER 489 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1dtd n ALA 490 N -0.72 0.00 -3.16 -0.43 0.00 -1.26 -4.83 120.51 110.10 1dtd n ALA 490 Ca 0.05 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.28 1dtd n ALA 490 Cb 0.02 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.43 1dtd n ALA 490 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1dtd n GLY 491 N 5.00 3.82 3.59 0.00 0.00 -1.26 -4.92 105.19 111.41 1dtd n GLY 491 Ca 0.00 -1.85 -0.24 0.00 0.00 0.00 0.00 46.02 43.93 1dtd n GLY 491 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1dtd s SER 492 N -2.41 4.12 0.00 1.61 0.15 -1.19 -4.86 113.70 111.12 1dtd s SER 492 Ca 0.41 -0.90 0.26 0.00 0.70 0.00 0.00 55.95 56.41 1dtd s SER 492 Cb 0.31 -0.56 0.55 0.00 -1.71 0.00 0.00 66.02 64.61 1dtd s SER 492 CO -0.09 -0.08 1.45 0.18 1.20 0.00 0.00 173.24 175.90 1dtd n LEU 493 N -0.84 1.99 -4.85 3.45 4.77 -1.26 -4.75 117.00 115.51 1dtd n LEU 493 Ca -0.05 -0.66 -0.27 0.00 -0.03 0.00 0.00 56.01 55.00 1dtd n LEU 493 Cb 0.61 -0.02 -0.05 0.00 -2.33 0.00 0.00 43.42 41.63 1dtd n LEU 493 CO 0.41 0.34 -0.19 0.00 -1.33 0.00 0.00 177.39 176.62 1dtd s VAL 495 N -1.67 3.11 0.00 0.00 1.01 -1.26 -4.13 120.40 117.46 1dtd s VAL 495 Ca 0.32 -1.01 0.00 0.00 0.00 0.00 0.00 61.98 61.29 1dtd s VAL 495 Cb -0.11 -2.32 0.00 0.00 0.00 0.00 0.00 36.38 33.95 1dtd s VAL 495 CO 0.25 0.37 0.00 0.61 0.00 0.00 0.00 175.10 176.33 1dtd n GLY 496 N 1.60 -0.32 3.41 4.51 0.00 0.33 -4.92 105.19 109.79 1dtd n GLY 496 Ca -0.16 -1.51 -0.30 0.00 0.00 0.00 0.00 46.02 44.05 1dtd n GLY 496 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1dtd s VAL 497 N -2.97 2.47 -0.32 1.61 1.01 -1.26 -4.84 120.40 116.10 1dtd s VAL 497 Ca 0.00 -1.39 -0.29 0.00 0.00 0.00 0.00 61.98 60.30 1dtd s VAL 497 Cb 0.00 -2.03 0.00 0.00 0.00 0.00 0.00 36.38 34.35 1dtd s VAL 497 CO 0.00 0.28 1.28 -0.62 0.00 0.00 0.00 175.10 176.04 1dtd s ASP 498 N -1.54 6.68 0.27 3.32 -1.08 0.40 -1.41 116.67 123.31 1dtd s ASP 498 Ca 0.14 1.13 0.24 0.00 -0.52 0.00 0.00 52.55 53.54 1dtd s ASP 498 Cb -0.10 -2.54 0.99 0.00 -1.46 0.00 0.00 42.92 39.81 1dtd s ASP 498 CO 0.05 -1.09 1.73 -0.81 0.52 0.00 0.00 175.17 175.57 1dtd n PRO 499 N 7.34 0.21 -1.00 4.34 -0.04 -1.26 -1.59 135.00 142.99 1dtd n PRO 499 Ca 0.14 0.43 -0.02 0.00 -0.04 0.00 0.00 63.50 64.01 1dtd n PRO 499 Cb 0.47 -1.89 0.35 0.00 -0.04 0.00 0.00 33.50 32.38 1dtd n PRO 499 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 1dtd n ASN 500 N -2.28 5.21 -0.07 3.54 5.15 -1.26 -3.44 115.26 122.11 1dtd n ASN 500 Ca 0.02 -3.13 0.02 0.00 -0.60 0.00 0.00 54.58 50.89 1dtd n ASN 500 Cb 0.24 -0.73 0.02 0.00 -0.53 0.00 0.00 39.78 38.78 1dtd n ASN 500 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 1dtd n ARG 501 N 0.13 1.41 -0.23 1.20 5.12 -0.62 -3.62 116.66 120.05 1dtd n ARG 501 Ca 0.37 -1.29 0.08 0.00 -1.93 0.00 0.00 57.85 55.08 1dtd n ARG 501 Cb 1.34 -0.86 0.21 0.00 -1.16 0.00 0.00 32.46 31.99 1dtd n ARG 501 CO 0.00 0.00 0.00 -1.71 -1.93 0.00 0.00 177.63 173.99 1dtd n ASN 502 N -0.43 3.25 -4.91 0.55 4.05 -1.02 -4.55 115.26 112.19 1dtd n ASN 502 Ca 0.02 -1.96 -0.28 0.00 0.45 0.00 0.00 54.58 52.82 1dtd n ASN 502 Cb 0.44 -0.30 -0.03 0.00 1.23 0.00 0.00 39.78 41.13 1dtd n ASN 502 CO 0.00 0.00 0.00 0.26 -3.05 0.00 0.00 177.26 174.47 1dtd s TRP 503 N -1.05 3.48 -1.41 1.20 0.52 -0.30 -0.41 118.94 120.98 1dtd s TRP 503 Ca 0.32 0.58 -0.15 0.00 0.02 0.00 0.00 56.10 56.88 1dtd s TRP 503 Cb 0.17 -2.06 0.05 0.00 -1.15 0.00 0.00 33.47 30.48 1dtd s TRP 503 CO 0.23 0.17 2.08 -3.47 0.02 0.00 0.00 176.95 175.98 1dtd n ASP 504 N -1.07 4.20 -3.27 2.95 4.64 -1.26 -4.34 116.55 118.40 1dtd n ASP 504 Ca -0.02 -2.87 -0.06 0.00 -1.38 0.00 0.00 54.79 50.46 1dtd n ASP 504 Cb 0.54 -1.68 -0.04 0.00 -1.04 0.00 0.00 41.12 38.90 1dtd n ASP 504 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 1dtd s ALA 505 N 3.42 -1.53 -1.54 -1.67 0.00 -1.26 -4.81 121.76 114.37 1dtd s ALA 505 Ca 0.49 0.15 -0.02 0.00 0.00 0.00 0.00 51.96 52.58 1dtd s ALA 505 Cb 0.11 -2.30 0.00 0.00 0.00 0.00 0.00 23.12 20.93 1dtd s ALA 505 CO -0.04 -1.94 0.22 0.41 0.00 0.00 0.00 175.76 174.41 1dtd n GLY 506 N 4.96 -0.41 3.62 0.00 0.00 -1.26 -1.28 105.19 110.83 1dtd n GLY 506 Ca 0.06 -0.04 -0.49 0.00 0.00 0.00 0.00 46.02 45.55 1dtd n GLY 506 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1dtd n PHE 507 N -4.17 1.75 -0.67 1.61 7.35 -1.26 -1.87 117.46 120.19 1dtd n PHE 507 Ca -0.18 0.53 0.00 0.00 -0.76 0.00 0.00 57.45 57.04 1dtd n PHE 507 Cb 0.65 -2.39 0.00 0.00 0.35 0.00 0.00 39.48 38.09 1dtd n PHE 507 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1dtd n GLY 508 N 2.57 1.00 0.00 7.13 0.00 -1.26 -4.97 105.19 109.65 1dtd n GLY 508 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 1dtd n GLY 508 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1dtd n GLY 509 N -2.00 -1.23 3.63 -0.02 0.00 -0.78 -4.88 105.19 99.91 1dtd n GLY 509 Ca 0.00 -1.62 -0.43 0.00 0.00 0.00 0.00 46.02 43.97 1dtd n GLY 509 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1dtd n PRO 510 N -0.70 1.65 -0.56 1.61 -0.02 -1.26 -2.79 135.00 132.93 1dtd n PRO 510 Ca 0.00 0.58 0.00 0.00 -2.02 0.00 0.00 63.50 62.06 1dtd n PRO 510 Cb 0.00 -2.06 0.00 0.00 -0.02 0.00 0.00 33.50 31.42 1dtd n PRO 510 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1dtd n GLY 511 N 1.04 0.76 3.14 -1.23 0.00 -1.26 -1.85 105.19 105.78 1dtd n GLY 511 Ca 0.08 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.88 1dtd n GLY 511 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dtd s ALA 512 N -2.69 1.22 0.14 4.61 0.00 -1.12 -4.46 121.76 119.47 1dtd s ALA 512 Ca 0.00 -0.75 0.07 0.00 0.00 0.00 0.00 51.96 51.27 1dtd s ALA 512 Cb 0.00 -0.25 -0.04 0.00 0.00 0.00 0.00 23.12 22.83 1dtd s ALA 512 CO 0.00 0.27 -0.01 0.45 0.00 0.00 0.00 175.76 176.46 1dtd s SER 513 N -0.79 4.80 0.00 0.00 0.15 -0.64 -4.83 113.70 112.41 1dtd s SER 513 Ca 0.04 -0.33 0.24 0.00 0.70 0.00 0.00 55.95 56.60 1dtd s SER 513 Cb -0.07 -1.05 0.48 0.00 -1.71 0.00 0.00 66.02 63.67 1dtd s SER 513 CO 0.01 0.13 1.42 -1.20 1.20 0.00 0.00 173.24 174.79 1dtd n SER 514 N 0.19 2.70 -4.62 5.45 7.64 -1.26 -1.85 113.62 121.87 1dtd n SER 514 Ca -0.11 -1.87 -0.41 0.00 1.01 0.00 0.00 58.87 57.49 1dtd n SER 514 Cb 0.54 -0.08 -0.05 0.00 -1.01 0.00 0.00 64.21 63.60 1dtd n SER 514 CO 0.00 0.00 0.00 0.21 -3.01 0.00 0.00 175.04 172.24 1dtd s ASN 515 N -1.80 6.65 0.59 6.43 2.47 -1.26 -4.94 114.94 123.07 1dtd s ASN 515 Ca 0.33 0.70 0.31 0.00 0.42 0.00 0.00 52.86 54.63 1dtd s ASN 515 Cb 0.21 -2.39 1.82 0.00 -1.45 0.00 0.00 41.25 39.44 1dtd s ASN 515 CO 0.31 -0.53 2.23 -0.65 -3.72 0.00 0.00 177.10 174.74 1dtd h PRO 516 N 8.01 0.00 0.00 0.43 0.11 -1.94 -1.44 132.00 137.17 1dtd h PRO 516 Ca -0.25 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.86 1dtd h PRO 516 Cb 1.10 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.21 1dtd h PRO 516 CO 0.85 0.03 -0.08 0.00 -0.21 0.00 0.00 178.00 178.59 1dtd s SER 518 N -3.29 6.10 0.52 0.00 0.01 -0.54 -4.96 113.70 111.54 1dtd s SER 518 Ca 0.13 1.73 0.32 0.00 1.31 0.00 0.00 55.95 59.43 1dtd s SER 518 Cb 0.18 -2.52 1.21 0.00 0.21 0.00 0.00 66.02 65.09 1dtd s SER 518 CO 0.57 -0.95 1.92 0.44 0.41 0.00 0.00 173.24 175.63 1dtd h ASP 519 N 0.62 0.00 -0.31 2.44 3.45 -1.90 -2.97 116.42 117.75 1dtd h ASP 519 Ca -0.47 0.00 -0.02 0.00 0.43 0.00 0.00 57.03 56.98 1dtd h ASP 519 Cb 1.21 0.00 -0.01 0.00 -0.56 0.00 0.00 39.33 39.97 1dtd h ASP 519 CO 0.59 0.00 0.01 -1.54 -1.57 0.00 0.00 179.24 176.72 1dtd n SER 520 N -3.05 4.03 -4.66 6.45 3.41 -1.26 -4.54 113.62 113.99 1dtd n SER 520 Ca 0.01 -3.06 -0.46 0.00 -0.26 0.00 0.00 58.87 55.10 1dtd n SER 520 Cb 0.33 -0.57 -0.04 0.00 -0.26 0.00 0.00 64.21 63.67 1dtd n SER 520 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1dtd n TYR 521 N -0.43 2.15 0.43 7.33 9.36 -1.12 -1.61 117.16 133.27 1dtd n TYR 521 Ca 0.23 0.36 0.12 0.00 3.32 0.00 0.00 57.90 61.93 1dtd n TYR 521 Cb 0.95 -2.49 0.20 0.00 -0.63 0.00 0.00 39.34 37.36 1dtd n TYR 521 CO 0.00 0.00 0.00 1.12 0.22 0.00 0.00 176.86 178.20 1dtd h HIS 522 N 5.25 0.00 0.00 2.98 2.07 -1.63 0.12 115.15 123.93 1dtd h HIS 522 Ca -0.45 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.07 1dtd h HIS 522 Cb 1.27 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.25 1dtd h HIS 522 CO 0.60 0.00 0.00 0.41 -3.07 0.00 0.00 177.93 175.87 1dtd n GLY 523 N 1.26 0.58 0.17 6.13 0.00 -1.26 -4.30 105.19 107.77 1dtd n GLY 523 Ca 0.03 -1.87 0.02 0.00 0.00 0.00 0.00 46.02 44.20 1dtd n GLY 523 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1dtd h PRO 524 N 0.00 0.00 -2.80 1.61 0.13 -1.98 -3.46 132.00 125.50 1dtd h PRO 524 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1dtd h PRO 524 Cb 0.00 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 31.00 1dtd h PRO 524 CO 0.00 0.47 0.27 -1.54 -0.23 0.00 0.00 178.00 176.97 1dtd s SER 525 N -6.76 -0.53 0.34 1.44 1.04 -1.26 -5.09 113.70 102.87 1dtd s SER 525 Ca -0.02 0.04 -0.29 0.00 0.48 0.00 0.00 55.95 56.17 1dtd s SER 525 Cb 0.13 0.55 -0.12 0.00 0.10 0.00 0.00 66.02 66.68 1dtd s SER 525 CO 0.73 -0.88 1.42 0.00 0.98 0.00 0.00 173.24 175.48 1dtd n ALA 526 N -0.28 1.84 -1.87 5.32 0.00 -1.26 -1.96 120.51 122.29 1dtd n ALA 526 Ca -0.15 0.36 -0.18 0.00 0.00 0.00 0.00 53.44 53.46 1dtd n ALA 526 Cb 0.64 -2.34 -0.05 0.00 0.00 0.00 0.00 19.45 17.69 1dtd n ALA 526 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1dtd n ASN 527 N 1.02 -5.26 0.20 0.00 3.02 0.45 -4.88 115.26 109.81 1dtd n ASN 527 Ca 0.05 0.26 0.05 0.00 -0.03 0.00 0.00 54.58 54.90 1dtd n ASN 527 Cb 0.37 -4.35 0.49 0.00 -0.61 0.00 0.00 39.78 35.67 1dtd n ASN 527 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 1dtd h SER 528 N 0.00 0.04 -3.29 6.41 4.64 -1.64 -3.39 113.55 116.32 1dtd h SER 528 Ca -0.40 -0.01 -0.57 0.00 -0.47 0.00 0.00 61.79 60.35 1dtd h SER 528 Cb 1.25 -0.01 -0.05 0.00 -0.31 0.00 0.00 62.40 63.28 1dtd h SER 528 CO 0.54 0.21 0.45 -1.61 -0.87 0.00 0.00 176.83 175.55 1dtd s GLU 529 N -4.68 4.38 0.53 4.77 0.41 -1.26 -4.93 118.70 117.91 1dtd s GLU 529 Ca -0.04 1.20 0.21 0.00 -0.41 0.00 0.00 54.97 55.93 1dtd s GLU 529 Cb 0.16 -3.54 1.37 0.00 -1.78 0.00 0.00 34.13 30.33 1dtd s GLU 529 CO 0.70 -0.28 2.10 -0.39 -0.49 0.00 0.00 175.26 176.90 1dtd h VAL 530 N 5.10 0.84 -0.38 2.63 -1.51 -1.88 -0.75 116.25 120.30 1dtd h VAL 530 Ca -0.31 0.00 -0.01 0.00 -1.23 0.00 0.00 66.70 65.14 1dtd h VAL 530 Cb 1.15 0.89 -0.02 0.00 -2.13 0.00 0.00 31.29 31.18 1dtd h VAL 530 CO 0.84 0.00 0.18 -0.33 -1.23 0.00 0.00 177.57 177.03 1dtd h GLU 531 N 0.00 0.55 -0.05 5.19 3.07 -1.92 -1.11 114.58 120.30 1dtd h GLU 531 Ca 0.10 -0.08 -0.02 0.00 -0.50 0.00 0.00 59.36 58.86 1dtd h GLU 531 Cb 0.40 -0.10 -0.00 0.00 -0.84 0.00 0.00 28.75 28.21 1dtd h GLU 531 CO -0.00 0.48 -0.04 0.28 -1.40 0.00 0.00 179.01 178.33 1dtd h VAL 532 N 0.47 1.36 -0.94 3.13 2.07 -1.68 -3.00 116.25 117.66 1dtd h VAL 532 Ca 0.13 -1.14 0.09 0.00 0.82 0.00 0.00 66.70 66.60 1dtd h VAL 532 Cb 0.12 2.01 -0.07 0.00 -1.52 0.00 0.00 31.29 31.83 1dtd h VAL 532 CO -0.02 0.31 0.60 0.50 0.02 0.00 0.00 177.57 178.99 1dtd h LYS 533 N -0.31 0.97 -0.87 1.57 3.11 -1.18 -1.61 116.57 118.24 1dtd h LYS 533 Ca 0.01 -0.06 0.03 0.00 -2.81 0.00 0.00 60.65 57.82 1dtd h LYS 533 Cb 0.52 -0.22 -0.05 0.00 -1.00 0.00 0.00 32.23 31.48 1dtd h LYS 533 CO 0.01 0.64 0.56 0.77 -2.81 0.00 0.00 179.45 178.62 1dtd h SER 534 N 0.99 0.94 -0.02 4.20 0.02 -1.19 -0.48 113.55 118.01 1dtd h SER 534 Ca 0.43 -0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 61.36 1dtd h SER 534 Cb 0.33 -0.22 -0.00 0.00 0.14 0.00 0.00 62.40 62.65 1dtd h SER 534 CO -0.18 0.65 -0.02 0.40 -1.14 0.00 0.00 176.83 176.54 1dtd h ILE 535 N 1.10 1.37 -0.47 3.27 2.04 -1.20 -2.54 117.51 121.08 1dtd h ILE 535 Ca 0.34 -1.11 0.07 0.00 1.00 0.00 0.00 64.86 65.16 1dtd h ILE 535 Cb -0.02 2.08 -0.06 0.00 -0.74 0.00 0.00 36.82 38.08 1dtd h ILE 535 CO -0.11 0.29 0.12 0.58 0.00 0.00 0.00 178.15 179.04 1dtd h VAL 536 N -0.41 0.78 -0.78 1.67 2.07 -1.21 -1.13 116.25 117.25 1dtd h VAL 536 Ca 0.00 -0.09 -0.03 0.00 0.82 0.00 0.00 66.70 67.40 1dtd h VAL 536 Cb 0.49 0.49 -0.04 0.00 -1.52 0.00 0.00 31.29 30.71 1dtd h VAL 536 CO 0.00 0.05 0.39 0.44 0.02 0.00 0.00 177.57 178.47 1dtd h ASP 537 N 0.27 1.01 0.05 0.57 3.32 -1.10 -1.39 116.42 119.16 1dtd h ASP 537 Ca 0.23 -0.13 -0.00 0.00 0.02 0.00 0.00 57.03 57.15 1dtd h ASP 537 Cb 0.28 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 39.57 1dtd h ASP 537 CO -0.28 0.85 -0.02 0.15 -1.72 0.00 0.00 179.24 178.22 1dtd h PHE 538 N 1.09 -0.06 -0.34 4.55 3.57 -1.07 -0.63 116.94 124.05 1dtd h PHE 538 Ca 0.27 -0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.79 1dtd h PHE 538 Cb 0.10 0.02 -0.03 0.00 2.79 0.00 0.00 35.95 38.83 1dtd h PHE 538 CO 0.01 0.08 0.16 0.82 -2.23 0.00 0.00 178.31 177.15 1dtd h ILE 539 N -0.20 0.97 -0.56 1.41 1.08 -1.10 0.15 117.51 119.26 1dtd h ILE 539 Ca -0.01 -0.11 -0.11 0.00 -0.39 0.00 0.00 64.86 64.24 1dtd h ILE 539 Cb 0.18 0.61 -0.02 0.00 -3.07 0.00 0.00 36.82 34.52 1dtd h ILE 539 CO 0.01 0.06 -0.07 0.11 -0.69 0.00 0.00 178.15 177.57 1dtd h LYS 540 N 0.33 1.04 -0.42 2.37 1.79 -1.21 -2.47 116.57 118.00 1dtd h LYS 540 Ca 0.14 -0.36 -0.10 0.00 -2.18 0.00 0.00 60.65 58.15 1dtd h LYS 540 Cb 0.06 -0.08 -0.02 0.00 -1.58 0.00 0.00 32.23 30.62 1dtd h LYS 540 CO -0.11 1.05 -0.16 0.77 -1.08 0.00 0.00 179.45 179.93 1dtd h SER 541 N 0.93 0.79 0.67 0.86 0.02 -0.93 -3.23 113.55 112.65 1dtd h SER 541 Ca 0.15 -0.26 -0.03 0.00 -0.84 0.00 0.00 61.79 60.81 1dtd h SER 541 Cb 0.64 -0.21 0.01 0.00 0.14 0.00 0.00 62.40 62.97 1dtd h SER 541 CO 0.04 0.95 -0.32 -0.74 -1.14 0.00 0.00 176.83 175.62 1dtd h HIS 542 N 0.70 -0.83 0.00 3.45 6.17 -0.81 -3.48 115.15 120.35 1dtd h HIS 542 Ca 0.11 -0.02 0.00 0.00 0.71 0.00 0.00 60.37 61.17 1dtd h HIS 542 Cb 0.66 0.28 0.00 0.00 2.52 0.00 0.00 27.41 30.86 1dtd h HIS 542 CO 0.03 -0.52 0.00 0.41 0.71 0.00 0.00 177.93 178.57 1dtd n GLY 543 N -1.46 2.14 0.86 5.26 0.00 -0.94 -4.83 105.19 106.22 1dtd n GLY 543 Ca -0.14 0.00 0.05 0.00 0.00 0.00 0.00 46.02 45.94 1dtd n GLY 543 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1dtd n LYS 544 N -2.00 0.96 -2.49 1.61 5.02 -1.26 -5.03 118.16 114.97 1dtd n LYS 544 Ca 0.00 -2.71 -0.42 0.00 -2.02 0.00 0.00 58.31 53.16 1dtd n LYS 544 Cb 0.00 -1.01 -0.03 0.00 -0.02 0.00 0.00 35.03 33.97 1dtd n LYS 544 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1dtd s VAL 545 N -1.97 4.34 -0.49 -0.18 1.01 -1.26 -1.24 120.40 120.61 1dtd s VAL 545 Ca 0.34 1.65 0.07 0.00 0.00 0.00 0.00 61.98 64.04 1dtd s VAL 545 Cb 0.35 -4.06 -0.04 0.00 0.00 0.00 0.00 36.38 32.64 1dtd s VAL 545 CO -0.09 -0.04 0.41 0.29 0.00 0.00 0.00 175.10 175.67 1dtd n LYS 546 N 5.50 3.53 -3.79 2.72 4.76 0.33 -4.79 118.16 126.42 1dtd n LYS 546 Ca 0.11 -0.25 -0.13 0.00 -2.87 0.00 0.00 58.31 55.18 1dtd n LYS 546 Cb 0.46 -0.90 -0.11 0.00 -1.84 0.00 0.00 35.03 32.63 1dtd n LYS 546 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1dtd s ALA 547 N -1.37 -0.60 -0.14 7.82 0.00 -1.20 -3.87 121.76 122.39 1dtd s ALA 547 Ca 0.04 0.61 -0.02 0.00 0.00 0.00 0.00 51.96 52.59 1dtd s ALA 547 Cb 0.05 -0.34 0.05 0.00 0.00 0.00 0.00 23.12 22.88 1dtd s ALA 547 CO 0.23 -0.13 0.02 0.12 0.00 0.00 0.00 175.76 175.99 1dtd s PHE 548 N -0.08 0.91 -0.09 0.00 2.19 0.14 -1.03 117.98 120.02 1dtd s PHE 548 Ca -0.02 -0.59 0.02 0.00 0.33 0.00 0.00 56.93 56.67 1dtd s PHE 548 Cb -0.02 -0.95 0.01 0.00 -1.31 0.00 0.00 43.02 40.75 1dtd s PHE 548 CO 0.01 -0.50 -0.15 0.42 1.83 0.00 0.00 175.22 176.82 1dtd s ILE 549 N 1.90 1.46 -0.04 3.12 1.01 -0.10 -1.19 121.20 127.35 1dtd s ILE 549 Ca 0.02 -0.64 0.06 0.00 0.00 0.00 0.00 60.65 60.09 1dtd s ILE 549 Cb -0.15 -1.32 -0.01 0.00 0.01 0.00 0.00 42.46 40.99 1dtd s ILE 549 CO -0.07 0.43 -0.23 -0.51 0.00 0.00 0.00 174.94 174.56 1dtd s ILE 550 N 0.83 1.89 -0.22 2.92 2.07 -0.68 -1.25 121.20 126.76 1dtd s ILE 550 Ca -0.10 -0.99 -0.09 0.00 -1.41 0.00 0.00 60.65 58.06 1dtd s ILE 550 Cb -0.16 -1.60 -0.04 0.00 0.13 0.00 0.00 42.46 40.79 1dtd s ILE 550 CO 0.01 0.53 0.11 -0.76 -1.91 0.00 0.00 174.94 172.93 1dtd s LEU 551 N -0.24 3.93 0.25 8.50 1.43 -0.07 -1.58 118.68 130.91 1dtd s LEU 551 Ca -0.00 0.07 0.07 0.00 -1.03 0.00 0.00 54.13 53.24 1dtd s LEU 551 Cb -0.12 -2.03 -0.05 0.00 0.03 0.00 0.00 46.19 44.01 1dtd s LEU 551 CO 0.02 0.10 -0.10 -1.00 0.23 0.00 0.00 176.35 175.60 1dtd s HIS 552 N 0.86 1.85 0.20 0.29 3.76 -0.04 -3.95 115.29 118.27 1dtd s HIS 552 Ca 0.06 -0.64 0.00 0.00 -0.15 0.00 0.00 55.06 54.33 1dtd s HIS 552 Cb -0.13 -0.98 -0.00 0.00 1.11 0.00 0.00 32.58 32.58 1dtd s HIS 552 CO 0.03 0.32 0.00 -1.13 -0.85 0.00 0.00 174.74 173.10 1dtd n SER 553 N -0.50 2.50 -4.79 1.40 3.41 -1.26 -0.45 113.62 113.93 1dtd n SER 553 Ca -0.06 -1.90 -0.24 0.00 -0.26 0.00 0.00 58.87 56.41 1dtd n SER 553 Cb 0.62 0.16 0.08 0.00 -0.26 0.00 0.00 64.21 64.81 1dtd n SER 553 CO 0.00 0.00 0.00 -0.72 -0.16 0.00 0.00 175.04 174.16 1dtd s TYR 554 N -1.76 2.32 0.00 7.33 -0.85 -1.26 -4.87 117.35 118.26 1dtd s TYR 554 Ca 0.00 0.04 0.00 0.00 -0.52 0.00 0.00 57.07 56.59 1dtd s TYR 554 Cb 0.00 -3.06 0.00 0.00 0.38 0.00 0.00 41.96 39.28 1dtd s TYR 554 CO 0.00 -1.45 0.00 0.43 -1.52 0.00 0.00 175.55 173.01 1dtd n SER 555 N -2.78 0.00 -3.09 -0.18 7.64 -0.43 -4.84 113.62 109.94 1dtd n SER 555 Ca 0.11 0.00 -0.09 0.00 1.01 0.00 0.00 58.87 59.90 1dtd n SER 555 Cb 0.60 0.00 0.04 0.00 -1.01 0.00 0.00 64.21 63.85 1dtd n SER 555 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1dtd n GLN 556 N 0.00 -1.83 -4.26 1.43 6.02 -0.51 -4.77 117.38 113.46 1dtd n GLN 556 Ca 0.00 1.03 -0.18 0.00 -0.01 0.00 0.00 57.00 57.84 1dtd n GLN 556 Cb 0.00 -5.57 -0.13 0.00 1.02 0.00 0.00 30.24 25.55 1dtd n GLN 556 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1dtd s LEU 557 N -4.80 2.13 -0.23 1.08 1.43 -0.63 -1.99 118.68 115.68 1dtd s LEU 557 Ca 0.29 -0.36 0.02 0.00 -1.03 0.00 0.00 54.13 53.05 1dtd s LEU 557 Cb -0.04 -0.43 0.05 0.00 0.03 0.00 0.00 46.19 45.80 1dtd s LEU 557 CO 0.70 0.00 -0.11 -0.22 0.23 0.00 0.00 176.35 176.95 1dtd s LEU 558 N -0.89 2.92 0.30 1.79 2.96 -0.08 -0.66 118.68 125.01 1dtd s LEU 558 Ca -0.01 -1.17 0.10 0.00 -0.22 0.00 0.00 54.13 52.84 1dtd s LEU 558 Cb -0.07 -1.43 -0.05 0.00 0.50 0.00 0.00 46.19 45.15 1dtd s LEU 558 CO 0.01 -0.16 -0.07 -0.04 -1.32 0.00 0.00 176.35 174.76 1dtd s MET 559 N 1.22 1.98 0.23 1.98 -1.94 0.29 -2.80 119.30 120.27 1dtd s MET 559 Ca -0.05 -1.68 0.00 0.00 -1.71 0.00 0.00 55.69 52.25 1dtd s MET 559 Cb -0.18 -1.92 -0.04 0.00 2.01 0.00 0.00 34.83 34.69 1dtd s MET 559 CO -0.07 0.27 0.12 -0.59 -0.01 0.00 0.00 175.02 174.74 1dtd s PHE 560 N -2.47 1.36 0.94 -0.03 -0.12 -1.10 -0.84 117.98 115.72 1dtd s PHE 560 Ca 0.32 -1.30 -0.11 0.00 -0.05 0.00 0.00 56.93 55.79 1dtd s PHE 560 Cb -0.03 -0.72 0.17 0.00 -0.63 0.00 0.00 43.02 41.80 1dtd s PHE 560 CO 0.18 -0.51 0.36 -2.30 -0.05 0.00 0.00 175.22 172.90 1dtd n PRO 561 N -0.38 -2.16 -0.87 1.99 -0.02 -1.26 -1.93 135.00 130.38 1dtd n PRO 561 Ca 0.01 -0.64 -0.34 0.00 -2.02 0.00 0.00 63.50 60.51 1dtd n PRO 561 Cb 0.66 -1.41 -0.05 0.00 -0.02 0.00 0.00 33.50 32.68 1dtd n PRO 561 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1dtd n TYR 562 N -4.27 0.67 -0.04 6.00 0.53 -1.26 -4.56 117.16 114.23 1dtd n TYR 562 Ca 0.06 0.59 -0.10 0.00 -1.02 0.00 0.00 57.90 57.43 1dtd n TYR 562 Cb 0.28 -1.16 -0.15 0.00 -1.03 0.00 0.00 39.34 37.29 1dtd n TYR 562 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 1dtd n GLY 563 N 1.54 -0.96 0.12 2.72 0.00 -1.26 -0.76 105.19 106.58 1dtd n GLY 563 Ca 0.14 -0.14 0.13 0.00 0.00 0.00 0.00 46.02 46.15 1dtd n GLY 563 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 173.32 173.42 1dtd h TYR 564 N 0.00 0.00 -3.38 1.61 -0.00 -1.91 -1.15 116.97 112.15 1dtd h TYR 564 Ca -0.37 0.00 -0.09 0.00 -0.00 0.00 0.00 58.73 58.27 1dtd h TYR 564 Cb 2.08 0.00 -0.16 0.00 -0.00 0.00 0.00 36.73 38.65 1dtd h TYR 564 CO 0.00 0.00 -0.25 -1.59 -0.00 0.00 0.00 178.16 176.33 1dtd s LYS 565 N -3.15 0.84 -0.01 0.10 -2.85 -1.26 -4.85 119.74 108.56 1dtd s LYS 565 Ca 0.09 -0.58 0.22 0.00 -1.00 0.00 0.00 55.97 54.70 1dtd s LYS 565 Cb 0.11 0.36 0.65 0.00 -2.06 0.00 0.00 37.83 36.90 1dtd s LYS 565 CO 0.56 -0.28 1.55 0.00 0.10 0.00 0.00 175.35 177.29 1dtd s THR 567 N -1.07 4.05 0.01 0.00 -4.23 -1.26 -4.92 115.64 108.21 1dtd s THR 567 Ca 0.49 0.67 -0.30 0.00 -1.18 0.00 0.00 61.69 61.37 1dtd s THR 567 Cb 0.26 -3.57 -0.03 0.00 1.34 0.00 0.00 72.50 70.50 1dtd s THR 567 CO 0.33 -0.87 1.01 -0.54 -0.54 0.00 0.00 174.62 174.01 1dtd s LYS 568 N -5.19 4.54 0.80 3.99 1.02 -1.26 -4.75 119.74 118.89 1dtd s LYS 568 Ca 0.57 1.47 -0.12 0.00 0.02 0.00 0.00 55.97 57.91 1dtd s LYS 568 Cb -0.12 -3.45 0.07 0.00 -0.52 0.00 0.00 37.83 33.81 1dtd s LYS 568 CO 0.54 -0.08 1.10 -0.48 -0.92 0.00 0.00 175.35 175.51 1dtd s LEU 569 N 1.02 2.58 0.30 3.17 2.34 -1.26 -4.94 118.68 121.88 1dtd s LEU 569 Ca 0.53 1.25 -0.01 0.00 0.06 0.00 0.00 54.13 55.95 1dtd s LEU 569 Cb -0.22 -3.85 0.48 0.00 -0.56 0.00 0.00 46.19 42.03 1dtd s LEU 569 CO 0.28 -1.96 1.95 0.44 -1.06 0.00 0.00 176.35 176.00 1dtd h ASP 570 N -1.08 0.93 -0.77 1.48 3.45 -1.99 -2.60 116.42 115.85 1dtd h ASP 570 Ca -0.47 -0.01 -0.42 0.00 0.43 0.00 0.00 57.03 56.55 1dtd h ASP 570 Cb 1.27 -0.22 -0.24 0.00 -0.56 0.00 0.00 39.33 39.59 1dtd h ASP 570 CO 0.60 0.65 0.54 0.47 -1.57 0.00 0.00 179.24 179.93 1dtd n ASP 571 N -4.44 4.18 -0.06 6.45 8.00 -1.26 -4.69 116.55 124.74 1dtd n ASP 571 Ca 0.11 -3.28 -0.08 0.00 0.71 0.00 0.00 54.79 52.25 1dtd n ASP 571 Cb 0.09 -0.80 -0.01 0.00 -0.02 0.00 0.00 41.12 40.37 1dtd n ASP 571 CO 0.00 0.00 0.00 0.15 -0.39 0.00 0.00 177.20 176.96 1dtd h PHE 572 N 0.94 -0.49 -0.69 1.24 3.04 -1.83 -0.97 116.94 118.18 1dtd h PHE 572 Ca 0.49 0.03 -0.02 0.00 3.98 0.00 0.00 57.97 62.45 1dtd h PHE 572 Cb 2.18 0.25 -0.03 0.00 2.56 0.00 0.00 35.95 40.91 1dtd h PHE 572 CO 1.22 -0.27 0.35 -0.44 -2.02 0.00 0.00 178.31 177.15 1dtd h ASP 573 N -0.18 0.89 -0.22 0.41 5.19 -1.88 -0.67 116.42 119.96 1dtd h ASP 573 Ca 0.14 -0.12 -0.14 0.00 -0.62 0.00 0.00 57.03 56.29 1dtd h ASP 573 Cb 0.40 -0.23 0.00 0.00 0.18 0.00 0.00 39.33 39.68 1dtd h ASP 573 CO -0.36 0.76 -0.41 -0.08 -3.12 0.00 0.00 179.24 176.02 1dtd h GLU 574 N 0.96 0.67 -0.42 3.56 4.81 -1.86 -2.12 114.58 120.18 1dtd h GLU 574 Ca 0.24 -0.43 -0.09 0.00 -0.13 0.00 0.00 59.36 58.95 1dtd h GLU 574 Cb 0.09 0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.50 1dtd h GLU 574 CO -0.03 1.04 -0.12 -0.07 -0.73 0.00 0.00 179.01 179.10 1dtd h LEU 575 N 0.37 0.75 -0.45 1.64 3.38 -1.13 -1.12 115.31 118.75 1dtd h LEU 575 Ca 0.01 -0.22 -0.01 0.00 0.09 0.00 0.00 57.88 57.75 1dtd h LEU 575 Cb 1.02 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.54 1dtd h LEU 575 CO 0.09 0.89 0.26 -1.28 0.09 0.00 0.00 178.44 178.49 1dtd h SER 576 N 0.69 0.55 -0.51 -0.43 0.87 -1.11 -0.15 113.55 113.46 1dtd h SER 576 Ca 0.12 -0.07 -0.06 0.00 -1.23 0.00 0.00 61.79 60.54 1dtd h SER 576 Cb 0.59 -0.14 -0.02 0.00 -0.44 0.00 0.00 62.40 62.39 1dtd h SER 576 CO 0.04 0.46 0.08 1.05 -0.53 0.00 0.00 176.83 177.93 1dtd h GLU 577 N 0.60 0.85 -0.63 2.24 4.11 -1.11 -1.11 114.58 119.52 1dtd h GLU 577 Ca 0.16 -0.23 -0.04 0.00 0.07 0.00 0.00 59.36 59.32 1dtd h GLU 577 Cb 0.02 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.15 1dtd h GLU 577 CO -0.03 0.84 0.24 0.28 0.07 0.00 0.00 179.01 180.40 1dtd h VAL 578 N 0.72 1.24 -0.48 -1.06 2.07 -1.07 -1.52 116.25 116.16 1dtd h VAL 578 Ca 0.15 -0.77 -0.06 0.00 0.82 0.00 0.00 66.70 66.85 1dtd h VAL 578 Cb 0.40 0.55 -0.02 0.00 -1.52 0.00 0.00 31.29 30.71 1dtd h VAL 578 CO 0.01 0.30 0.08 0.00 0.02 0.00 0.00 177.57 177.98 1dtd h ALA 579 N 1.09 0.63 -0.51 1.67 0.00 -0.90 -1.18 119.26 120.08 1dtd h ALA 579 Ca 0.21 -0.23 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 1dtd h ALA 579 Cb 0.23 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 1dtd h ALA 579 CO -0.01 0.36 0.11 1.96 0.00 0.00 0.00 179.25 181.66 1dtd h GLN 580 N 0.66 0.78 -0.48 0.00 4.20 -1.03 -1.47 115.11 117.77 1dtd h GLN 580 Ca 0.15 -0.16 -0.13 0.00 0.06 0.00 0.00 58.65 58.57 1dtd h GLN 580 Cb 0.38 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 28.03 1dtd h GLN 580 CO 0.01 0.71 -0.20 -0.22 -0.67 0.00 0.00 178.83 178.46 1dtd h LYS 581 N 0.75 0.98 -0.58 1.46 3.11 -1.08 -1.55 116.57 119.66 1dtd h LYS 581 Ca 0.16 -0.41 -0.10 0.00 -2.81 0.00 0.00 60.65 57.50 1dtd h LYS 581 Cb 0.30 -0.04 -0.02 0.00 -1.00 0.00 0.00 32.23 31.47 1dtd h LYS 581 CO 0.00 1.08 -0.02 0.00 -2.81 0.00 0.00 179.45 177.70 1dtd h ALA 582 N 0.91 0.86 -0.55 5.00 0.00 -1.02 -1.74 119.26 122.71 1dtd h ALA 582 Ca 0.11 -0.32 -0.09 0.00 0.00 0.00 0.00 54.91 54.62 1dtd h ALA 582 Cb 0.77 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 1dtd h ALA 582 CO 0.06 0.66 -0.00 0.00 0.00 0.00 0.00 179.25 179.97 1dtd h ALA 583 N 1.02 0.96 0.11 0.00 0.00 -1.13 -0.19 119.26 120.03 1dtd h ALA 583 Ca 0.16 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1dtd h ALA 583 Cb 0.57 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 1dtd h ALA 583 CO 0.03 0.63 -0.11 1.96 0.00 0.00 0.00 179.25 181.76 1dtd h GLN 584 N 0.87 -0.24 -0.80 0.00 4.20 -1.10 -1.31 115.11 116.73 1dtd h GLN 584 Ca 0.16 0.02 -0.02 0.00 0.06 0.00 0.00 58.65 58.87 1dtd h GLN 584 Cb 0.52 0.05 -0.04 0.00 0.30 0.00 0.00 27.48 28.31 1dtd h GLN 584 CO 0.03 -0.16 0.42 0.77 -0.67 0.00 0.00 178.83 179.21 1dtd h SER 585 N -0.25 1.02 -0.46 1.46 0.02 -0.93 -2.80 113.55 111.61 1dtd h SER 585 Ca 0.01 -0.11 0.01 0.00 -0.84 0.00 0.00 61.79 60.85 1dtd h SER 585 Cb 0.24 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 62.50 1dtd h SER 585 CO -0.04 0.84 0.30 0.25 -1.14 0.00 0.00 176.83 177.04 1dtd h LEU 586 N 1.12 0.52 -1.13 5.07 6.46 -0.86 -2.86 115.31 123.62 1dtd h LEU 586 Ca 0.28 -0.01 0.06 0.00 -0.12 0.00 0.00 57.88 58.09 1dtd h LEU 586 Cb 0.06 -0.13 -0.06 0.00 -0.73 0.00 0.00 40.66 39.81 1dtd h LEU 586 CO -0.04 0.38 0.59 -1.28 -0.62 0.00 0.00 178.44 177.47 1dtd h SER 587 N 0.62 0.93 -0.07 1.25 0.87 -1.00 -3.12 113.55 113.04 1dtd h SER 587 Ca 0.17 0.00 0.02 0.00 -1.23 0.00 0.00 61.79 60.75 1dtd h SER 587 Cb -0.07 -0.20 -0.00 0.00 -0.44 0.00 0.00 62.40 61.69 1dtd h SER 587 CO -0.04 0.60 0.12 0.08 -0.53 0.00 0.00 176.83 177.06 1dtd h ARG 588 N 1.05 0.00 0.00 2.24 0.11 -1.26 0.73 114.38 117.26 1dtd h ARG 588 Ca 0.39 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 60.47 1dtd h ARG 588 Cb 0.17 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.25 1dtd h ARG 588 CO -0.14 0.00 -0.00 1.25 0.10 0.00 0.00 179.97 181.18 1dtd h LEU 589 N 0.00 -0.00 -2.76 0.08 5.85 -1.71 -3.42 115.31 113.36 1dtd h LEU 589 Ca 0.03 -0.29 0.00 0.00 0.84 0.00 0.00 57.88 58.46 1dtd h LEU 589 Cb 0.27 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.30 1dtd h LEU 589 CO -0.00 0.64 0.00 1.41 -0.34 0.00 0.00 178.44 180.15 1dtd n HIS 590 N -4.73 0.00 -1.03 1.25 8.25 -1.23 -5.01 115.22 112.73 1dtd n HIS 590 Ca -0.03 -0.44 -0.01 0.00 -0.26 0.00 0.00 57.72 56.98 1dtd n HIS 590 Cb 0.14 -0.04 -0.00 0.00 1.12 0.00 0.00 29.99 31.20 1dtd n HIS 590 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1dtd n GLY 591 N -0.44 0.49 3.69 -1.41 0.00 0.25 -5.00 105.19 102.76 1dtd n GLY 591 Ca 0.00 -0.33 -0.42 0.00 0.00 0.00 0.00 46.02 45.26 1dtd n GLY 591 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1dtd s THR 592 N -1.95 4.61 -0.17 2.61 -4.23 -1.25 -4.99 115.64 110.27 1dtd s THR 592 Ca 0.00 1.89 -0.08 0.00 -1.18 0.00 0.00 61.69 62.32 1dtd s THR 592 Cb 0.00 -4.22 -0.04 0.00 1.34 0.00 0.00 72.50 69.58 1dtd s THR 592 CO 0.00 0.02 0.09 -1.59 -0.54 0.00 0.00 174.62 172.60 1dtd s LYS 593 N 1.96 3.92 0.06 3.99 0.00 -1.26 -4.02 119.74 124.39 1dtd s LYS 593 Ca 0.51 -0.28 0.03 0.00 0.00 0.00 0.00 55.97 56.23 1dtd s LYS 593 Cb -0.21 -3.25 -0.04 0.00 0.00 0.00 0.00 37.83 34.34 1dtd s LYS 593 CO 0.20 0.37 0.03 0.71 0.00 0.00 0.00 175.35 176.67 1dtd s TYR 594 N 0.12 3.10 0.09 1.78 1.51 -1.26 -4.89 117.35 117.80 1dtd s TYR 594 Ca 0.07 0.05 0.06 0.00 -1.01 0.00 0.00 57.07 56.23 1dtd s TYR 594 Cb -0.12 -1.61 -0.04 0.00 -0.11 0.00 0.00 41.96 40.09 1dtd s TYR 594 CO 0.00 0.50 -0.05 0.15 -1.11 0.00 0.00 175.55 175.04 1dtd s LYS 595 N -2.16 2.34 0.06 -0.62 1.02 -0.84 -4.95 119.74 114.59 1dtd s LYS 595 Ca 0.26 -0.92 0.07 0.00 0.02 0.00 0.00 55.97 55.40 1dtd s LYS 595 Cb -0.12 -2.43 -0.03 0.00 -0.52 0.00 0.00 37.83 34.74 1dtd s LYS 595 CO 0.18 0.53 -0.20 0.08 -0.92 0.00 0.00 175.35 175.02 1dtd s VAL 596 N -1.25 1.59 0.00 3.17 1.01 -1.26 -0.91 120.40 122.75 1dtd s VAL 596 Ca 0.23 -1.25 0.00 0.00 0.00 0.00 0.00 61.98 60.96 1dtd s VAL 596 Cb -0.11 -1.41 0.00 0.00 0.00 0.00 0.00 36.38 34.86 1dtd s VAL 596 CO 0.16 0.11 0.00 0.61 0.00 0.00 0.00 175.10 175.98 1dtd n GLY 597 N 1.67 -0.55 3.76 4.51 0.00 -1.12 -4.99 105.19 108.48 1dtd n GLY 597 Ca -0.18 -1.28 -0.36 0.00 0.00 0.00 0.00 46.02 44.20 1dtd n GLY 597 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1dtd s PRO 598 N -2.00 3.31 0.15 1.61 0.02 -1.26 -2.73 135.00 134.10 1dtd s PRO 598 Ca 0.00 1.80 -0.21 0.00 0.02 0.00 0.00 61.00 62.62 1dtd s PRO 598 Cb 0.00 -2.12 0.03 0.00 0.02 0.00 0.00 34.50 32.44 1dtd s PRO 598 CO 0.00 -0.93 1.66 0.82 -0.33 0.00 0.00 177.00 178.22 1dtd h ILE 599 N 1.31 0.53 -0.96 2.83 2.04 -1.33 -1.90 117.51 120.02 1dtd h ILE 599 Ca -0.50 0.00 0.16 0.00 1.00 0.00 0.00 64.86 65.52 1dtd h ILE 599 Cb 1.27 0.53 -0.08 0.00 -0.74 0.00 0.00 36.82 37.80 1dtd h ILE 599 CO 0.57 0.00 0.61 0.00 0.00 0.00 0.00 178.15 179.33 1dtd n SER 601 N -4.63 0.52 0.05 0.00 3.41 -0.93 -3.93 113.62 108.11 1dtd n SER 601 Ca 0.20 0.22 0.11 0.00 -0.26 0.00 0.00 58.87 59.14 1dtd n SER 601 Cb 0.49 0.78 -0.07 0.00 -0.26 0.00 0.00 64.21 65.15 1dtd n SER 601 CO 0.00 0.00 0.00 0.55 -0.16 0.00 0.00 175.04 175.43 1dtd n VAL 602 N -2.68 0.32 0.01 -3.33 3.14 -0.76 -4.81 118.33 110.21 1dtd n VAL 602 Ca -0.11 -0.49 0.00 0.00 -2.96 0.00 0.00 64.34 60.78 1dtd n VAL 602 Cb 0.78 -0.13 0.00 0.00 -1.06 0.00 0.00 33.84 33.43 1dtd n VAL 602 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1dtd n ILE 603 N -2.42 0.06 -3.59 1.55 0.13 -0.66 -5.08 119.36 109.34 1dtd n ILE 603 Ca -0.01 0.02 0.02 0.00 -1.10 0.00 0.00 62.75 61.67 1dtd n ILE 603 Cb 0.54 -0.66 -0.01 0.00 -0.84 0.00 0.00 39.64 38.68 1dtd n ILE 603 CO 0.00 0.00 0.00 -0.72 2.80 0.00 0.00 176.55 178.63 1dtd s TYR 604 N -1.07 -0.02 0.28 9.51 -0.85 -1.09 -5.03 117.35 119.08 1dtd s TYR 604 Ca 0.00 -0.01 -0.29 0.00 -0.52 0.00 0.00 57.07 56.25 1dtd s TYR 604 Cb 0.00 0.51 -0.10 0.00 0.38 0.00 0.00 41.96 42.75 1dtd s TYR 604 CO 0.00 -0.07 1.14 -1.14 -1.52 0.00 0.00 175.55 173.97 1dtd s GLN 605 N -2.11 4.58 -0.43 -3.49 0.74 -1.26 -3.85 119.66 113.84 1dtd s GLN 605 Ca 0.14 1.89 0.05 0.00 0.05 0.00 0.00 55.36 57.49 1dtd s GLN 605 Cb 0.05 -3.17 0.17 0.00 1.10 0.00 0.00 33.01 31.16 1dtd s GLN 605 CO -0.05 0.12 0.52 0.00 -0.55 0.00 0.00 175.29 175.33 1dtd s ALA 606 N -1.09 -0.92 0.41 1.58 0.00 -0.44 -4.34 121.76 116.96 1dtd s ALA 606 Ca 0.46 -0.90 -0.25 0.00 0.00 0.00 0.00 51.96 51.28 1dtd s ALA 606 Cb -0.33 -2.29 -0.08 0.00 0.00 0.00 0.00 23.12 20.41 1dtd s ALA 606 CO 0.43 -2.16 1.14 -1.12 0.00 0.00 0.00 175.76 174.06 1dtd s SER 607 N 1.06 6.52 0.00 0.00 0.01 -0.77 -3.67 113.70 116.84 1dtd s SER 607 Ca 0.24 2.27 0.00 0.00 1.31 0.00 0.00 55.95 59.77 1dtd s SER 607 Cb -0.05 -2.61 0.00 0.00 0.21 0.00 0.00 66.02 63.57 1dtd s SER 607 CO -0.07 -0.67 0.00 0.61 0.41 0.00 0.00 173.24 173.51 1dtd n GLY 608 N 0.55 0.62 3.89 3.44 0.00 -0.40 -4.61 105.19 108.68 1dtd n GLY 608 Ca 0.05 -0.75 -0.29 0.00 0.00 0.00 0.00 46.02 45.03 1dtd n GLY 608 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1dtd s GLY 609 N -2.70 1.60 0.10 -0.02 0.00 -1.24 -1.14 107.32 103.91 1dtd s GLY 609 Ca 0.00 -0.29 -0.15 0.00 0.00 0.00 0.00 44.72 44.28 1dtd s GLY 609 CO 0.00 -0.07 1.45 1.48 0.00 0.00 0.00 173.10 175.97 1dtd h SER 610 N 0.00 0.70 1.62 1.64 4.64 -1.90 -2.68 113.55 117.56 1dtd h SER 610 Ca -0.46 -0.43 0.00 0.00 -0.47 0.00 0.00 61.79 60.44 1dtd h SER 610 Cb 1.20 -0.19 0.00 0.00 -0.31 0.00 0.00 62.40 63.09 1dtd h SER 610 CO 0.62 0.97 0.00 0.16 -0.87 0.00 0.00 176.83 177.71 1dtd h ILE 611 N 0.42 0.00 -0.20 0.95 3.07 -1.95 -0.39 117.51 119.42 1dtd h ILE 611 Ca 0.06 -0.76 -0.06 0.00 1.55 0.00 0.00 64.86 65.65 1dtd h ILE 611 Cb 0.73 1.75 -0.00 0.00 -0.27 0.00 0.00 36.82 39.02 1dtd h ILE 611 CO 0.05 0.00 -0.12 0.44 -1.05 0.00 0.00 178.15 177.47 1dtd h ASP 612 N 0.00 0.45 -0.12 2.16 3.32 -1.95 -1.51 116.42 118.78 1dtd h ASP 612 Ca 0.00 -0.43 0.01 0.00 0.02 0.00 0.00 57.03 56.63 1dtd h ASP 612 Cb 0.81 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 40.22 1dtd h ASP 612 CO 0.00 0.78 0.03 -0.25 -1.72 0.00 0.00 179.24 178.08 1dtd h TRP 613 N 0.12 0.05 -0.47 4.55 7.01 -1.12 -1.66 115.95 124.43 1dtd h TRP 613 Ca 0.04 0.01 -0.01 0.00 2.11 0.00 0.00 58.89 61.04 1dtd h TRP 613 Cb 0.62 -0.00 -0.02 0.00 -2.10 0.00 0.00 29.16 27.66 1dtd h TRP 613 CO 0.07 0.02 0.25 0.66 -2.79 0.00 0.00 178.44 176.65 1dtd h SER 614 N 0.08 0.59 0.05 2.65 4.64 -1.04 -1.02 113.55 119.51 1dtd h SER 614 Ca 0.05 -0.10 -0.00 0.00 -0.47 0.00 0.00 61.79 61.27 1dtd h SER 614 Cb 0.04 -0.15 0.00 0.00 -0.31 0.00 0.00 62.40 61.98 1dtd h SER 614 CO -0.07 0.51 -0.03 0.22 -0.87 0.00 0.00 176.83 176.60 1dtd h TYR 615 N 0.62 -0.06 0.00 4.77 3.20 -1.19 -0.30 116.97 124.00 1dtd h TYR 615 Ca 0.16 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.03 1dtd h TYR 615 Cb 0.06 0.02 0.00 0.00 1.54 0.00 0.00 36.73 38.35 1dtd h TYR 615 CO -0.02 -0.02 0.00 -0.44 -1.64 0.00 0.00 178.16 176.05 1dtd h ASP 616 N -0.10 0.00 1.14 -2.11 3.45 -1.22 -0.77 116.42 116.82 1dtd h ASP 616 Ca -0.01 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.45 1dtd h ASP 616 Cb 0.08 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.85 1dtd h ASP 616 CO 0.01 0.00 0.00 0.00 -1.57 0.00 0.00 179.24 177.68 1dtd n TYR 617 N -2.87 0.30 0.00 4.55 4.19 -0.39 -4.89 117.16 118.05 1dtd n TYR 617 Ca -0.01 0.09 0.00 0.00 3.31 0.00 0.00 57.90 61.29 1dtd n TYR 617 Cb 0.15 -0.64 0.00 0.00 0.49 0.00 0.00 39.34 39.34 1dtd n TYR 617 CO 0.00 0.00 0.00 0.41 0.91 0.00 0.00 176.86 178.18 1dtd n GLY 618 N 1.41 1.32 3.36 2.98 0.00 -0.30 -5.07 105.19 108.89 1dtd n GLY 618 Ca 0.06 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.63 1dtd n GLY 618 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1dtd s ILE 619 N -2.00 4.98 0.20 -0.61 1.01 -0.18 -4.93 121.20 119.66 1dtd s ILE 619 Ca 0.00 -1.29 -0.07 0.00 0.00 0.00 0.00 60.65 59.29 1dtd s ILE 619 Cb 0.00 -4.48 0.05 0.00 0.01 0.00 0.00 42.46 38.05 1dtd s ILE 619 CO 0.00 -1.09 1.64 0.50 0.00 0.00 0.00 174.94 175.99 1dtd h LYS 620 N 8.96 0.94 -4.02 2.79 3.64 -1.84 -3.29 116.57 123.74 1dtd h LYS 620 Ca -0.23 -0.33 -0.76 0.00 -1.27 0.00 0.00 60.65 58.05 1dtd h LYS 620 Cb 1.08 -0.07 -0.21 0.00 -0.41 0.00 0.00 32.23 32.62 1dtd h LYS 620 CO 1.05 1.00 1.20 0.66 -2.27 0.00 0.00 179.45 181.09 1dtd n TYR 621 N -4.15 4.38 -3.93 1.91 4.01 -1.25 -4.94 117.16 113.19 1dtd n TYR 621 Ca 0.02 -3.31 -0.35 0.00 -0.16 0.00 0.00 57.90 54.10 1dtd n TYR 621 Cb 0.39 -1.93 -0.14 0.00 -0.31 0.00 0.00 39.34 37.35 1dtd n TYR 621 CO 0.00 0.00 0.00 -1.12 -0.46 0.00 0.00 176.86 175.28 1dtd s SER 622 N 1.58 4.57 0.09 7.72 0.01 -1.26 -0.68 113.70 125.73 1dtd s SER 622 Ca 0.38 -1.00 0.05 0.00 1.31 0.00 0.00 55.95 56.68 1dtd s SER 622 Cb -0.01 -1.69 -0.03 0.00 0.21 0.00 0.00 66.02 64.49 1dtd s SER 622 CO -0.01 -0.18 -0.12 -0.36 0.41 0.00 0.00 173.24 172.98 1dtd s PHE 623 N 1.31 1.16 -0.06 2.43 0.08 -0.33 -4.23 117.98 118.35 1dtd s PHE 623 Ca -0.02 -0.55 0.04 0.00 0.12 0.00 0.00 56.93 56.53 1dtd s PHE 623 Cb -0.18 -0.64 -0.00 0.00 -0.57 0.00 0.00 43.02 41.63 1dtd s PHE 623 CO -0.03 0.05 -0.18 0.00 -0.10 0.00 0.00 175.22 174.96 1dtd s ALA 624 N -1.85 1.64 -0.11 5.36 0.00 -0.02 -1.68 121.76 125.09 1dtd s ALA 624 Ca 0.02 -0.72 -0.05 0.00 0.00 0.00 0.00 51.96 51.22 1dtd s ALA 624 Cb -0.07 -0.58 -0.04 0.00 0.00 0.00 0.00 23.12 22.44 1dtd s ALA 624 CO 0.02 0.26 0.08 -0.06 0.00 0.00 0.00 175.76 176.06 1dtd s PHE 625 N 0.18 3.39 -0.34 0.00 0.40 -0.61 -0.55 117.98 120.45 1dtd s PHE 625 Ca -0.08 0.36 -0.08 0.00 -0.60 0.00 0.00 56.93 56.53 1dtd s PHE 625 Cb -0.13 -1.88 0.03 0.00 0.51 0.00 0.00 43.02 41.54 1dtd s PHE 625 CO 0.04 0.59 0.13 -1.21 0.70 0.00 0.00 175.22 175.47 1dtd s GLU 626 N -0.89 2.79 0.00 0.44 0.41 0.16 -0.86 118.70 120.75 1dtd s GLU 626 Ca 0.14 -1.08 0.00 0.00 -0.41 0.00 0.00 54.97 53.62 1dtd s GLU 626 Cb -0.12 -3.53 0.00 0.00 -1.78 0.00 0.00 34.13 28.71 1dtd s GLU 626 CO 0.03 -0.63 0.00 1.28 -0.49 0.00 0.00 175.26 175.45 1dtd n LEU 627 N 4.88 0.00 -4.62 1.80 4.77 0.40 -1.42 117.00 122.82 1dtd n LEU 627 Ca -0.13 0.00 -0.43 0.00 -0.03 0.00 0.00 56.01 55.43 1dtd n LEU 627 Cb 0.46 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.52 1dtd n LEU 627 CO 0.33 -0.41 1.59 -0.13 -1.33 0.00 0.00 177.39 177.44 1dtd s ARG 628 N -1.79 3.59 0.00 3.23 0.52 -1.26 -2.33 118.95 120.92 1dtd s ARG 628 Ca 0.00 1.93 0.00 0.00 -0.52 0.00 0.00 55.73 57.14 1dtd s ARG 628 Cb 0.00 -4.19 0.00 0.00 0.52 0.00 0.00 34.95 31.28 1dtd s ARG 628 CO 0.00 -1.56 0.00 -0.40 0.02 0.00 0.00 175.30 173.36 1dtd n ASP 629 N 9.53 0.00 -0.97 0.23 5.75 -1.26 -4.59 116.55 125.24 1dtd n ASP 629 Ca 0.23 -0.43 0.08 0.00 -0.01 0.00 0.00 54.79 54.66 1dtd n ASP 629 Cb 0.45 0.00 0.24 0.00 -1.03 0.00 0.00 41.12 40.78 1dtd n ASP 629 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 1dtd n THR 630 N 0.00 1.67 0.00 2.12 -2.24 -1.26 -1.31 114.28 113.26 1dtd n THR 630 Ca 0.00 -1.36 0.00 0.00 -2.27 0.00 0.00 64.05 60.42 1dtd n THR 630 Cb 0.00 0.14 0.00 0.00 -2.10 0.00 0.00 70.33 68.37 1dtd n THR 630 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1dtd n GLY 631 N 0.31 1.33 0.09 3.38 0.00 -1.26 -4.93 105.19 104.11 1dtd n GLY 631 Ca 0.19 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.08 1dtd n GLY 631 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1dtd h ARG 632 N 0.00 -0.13 0.00 1.61 2.43 -2.02 -3.32 114.38 112.96 1dtd h ARG 632 Ca 0.00 0.01 -0.11 0.00 -0.81 0.00 0.00 59.98 59.07 1dtd h ARG 632 Cb 0.00 0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.56 1dtd h ARG 632 CO 0.00 0.02 -1.84 0.66 -1.51 0.00 0.00 179.97 177.30 1dtd n TYR 633 N -5.09 0.00 -1.30 2.20 4.01 -1.26 -5.08 117.16 110.64 1dtd n TYR 633 Ca -0.08 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.66 1dtd n TYR 633 Cb 0.12 -0.51 0.00 0.00 -0.31 0.00 0.00 39.34 38.65 1dtd n TYR 633 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1dtd n GLY 634 N 1.80 3.07 0.26 2.72 0.00 -1.25 -2.13 105.19 109.66 1dtd n GLY 634 Ca -0.11 -0.24 0.14 0.00 0.00 0.00 0.00 46.02 45.80 1dtd n GLY 634 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1dtd h PHE 635 N 0.00 0.00 -0.34 1.61 0.04 -1.92 -3.28 116.94 113.05 1dtd h PHE 635 Ca 0.00 0.00 -0.25 0.00 2.80 0.00 0.00 57.97 60.52 1dtd h PHE 635 Cb 0.00 0.00 -0.09 0.00 2.20 0.00 0.00 35.95 38.06 1dtd h PHE 635 CO 0.00 0.12 0.03 1.28 -0.60 0.00 0.00 178.31 179.13 1dtd n LEU 636 N -3.34 5.78 -4.70 1.54 4.77 -0.91 -4.56 117.00 115.59 1dtd n LEU 636 Ca -0.00 -3.24 -0.42 0.00 -0.03 0.00 0.00 56.01 52.31 1dtd n LEU 636 Cb 0.32 -1.25 -0.03 0.00 -2.33 0.00 0.00 43.42 40.13 1dtd n LEU 636 CO 0.30 1.47 1.42 -0.22 -1.33 0.00 0.00 177.39 179.02 1dtd s LEU 637 N -0.85 4.39 0.49 2.23 2.96 -1.24 -4.88 118.68 121.79 1dtd s LEU 637 Ca 0.44 2.72 -0.22 0.00 -0.22 0.00 0.00 54.13 56.84 1dtd s LEU 637 Cb 0.25 -3.57 -0.08 0.00 0.50 0.00 0.00 46.19 43.29 1dtd s LEU 637 CO -0.05 -0.97 0.99 -2.65 -1.32 0.00 0.00 176.35 172.35 1dtd n PRO 638 N 5.31 1.21 0.25 0.98 -0.02 -1.26 -4.87 135.00 136.60 1dtd n PRO 638 Ca 0.17 0.44 0.11 0.00 -2.02 0.00 0.00 63.50 62.20 1dtd n PRO 638 Cb 0.38 -2.11 0.67 0.00 -0.02 0.00 0.00 33.50 32.43 1dtd n PRO 638 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1dtd h ALA 639 N 1.15 1.40 0.00 3.55 0.00 -1.91 -0.84 119.26 122.60 1dtd h ALA 639 Ca -0.46 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.32 1dtd h ALA 639 Cb 1.35 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 19.11 1dtd h ALA 639 CO 0.54 0.17 -0.02 0.07 0.00 0.00 0.00 179.25 180.02 1dtd h ARG 640 N 0.00 0.00 -0.01 0.00 0.11 -1.89 -1.46 114.38 111.12 1dtd h ARG 640 Ca -0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1dtd h ARG 640 Cb 0.33 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.41 1dtd h ARG 640 CO 0.02 0.02 -0.21 1.04 0.10 0.00 0.00 179.97 180.94 1dtd n GLN 641 N -3.19 1.19 0.14 0.08 6.02 -0.32 -4.50 117.38 116.80 1dtd n GLN 641 Ca -0.02 -0.77 -0.14 0.00 -0.01 0.00 0.00 57.00 56.06 1dtd n GLN 641 Cb 0.18 -1.48 -0.07 0.00 1.02 0.00 0.00 30.24 29.88 1dtd n GLN 641 CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 177.06 176.87 1dtd h ILE 642 N 1.88 0.21 -0.61 5.09 2.04 -1.35 -2.34 117.51 122.43 1dtd h ILE 642 Ca 0.00 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.82 1dtd h ILE 642 Cb 0.57 0.21 -0.03 0.00 -0.74 0.00 0.00 36.82 36.84 1dtd h ILE 642 CO 0.00 0.00 0.24 -0.07 0.00 0.00 0.00 178.15 178.32 1dtd h LEU 643 N -0.65 0.85 -1.05 1.44 3.38 -1.79 -0.22 115.31 117.26 1dtd h LEU 643 Ca 0.01 -0.18 -0.04 0.00 0.09 0.00 0.00 57.88 57.77 1dtd h LEU 643 Cb 0.66 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 41.16 1dtd h LEU 643 CO -0.19 0.79 0.22 -0.65 0.09 0.00 0.00 178.44 178.70 1dtd h PRO 644 N 0.85 0.90 -0.15 1.13 0.11 -1.83 0.54 132.00 133.55 1dtd h PRO 644 Ca 0.20 -0.15 -0.04 0.00 0.11 0.00 0.00 66.00 66.12 1dtd h PRO 644 Cb 0.22 -0.15 -0.00 0.00 0.11 0.00 0.00 31.00 31.17 1dtd h PRO 644 CO -0.02 0.75 -0.05 1.15 -0.21 0.00 0.00 178.00 179.62 1dtd h THR 645 N 0.88 1.30 -0.59 -1.15 2.02 -1.06 -2.62 112.91 111.69 1dtd h THR 645 Ca 0.20 -1.05 -0.06 0.00 0.77 0.00 0.00 66.41 66.27 1dtd h THR 645 Cb 0.21 1.68 -0.02 0.00 -1.74 0.00 0.00 68.15 68.27 1dtd h THR 645 CO -0.01 0.31 0.13 0.00 0.37 0.00 0.00 175.52 176.32 1dtd h ALA 646 N 0.69 0.78 -0.15 6.16 0.00 -0.56 -1.74 119.26 124.44 1dtd h ALA 646 Ca 0.04 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.71 1dtd h ALA 646 Cb 0.50 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1dtd h ALA 646 CO 0.02 0.50 0.09 0.93 0.00 0.00 0.00 179.25 180.78 1dtd h GLU 647 N 0.86 0.21 -0.12 0.00 5.08 -0.90 -1.30 114.58 118.40 1dtd h GLU 647 Ca 0.18 -0.02 -0.14 0.00 -1.00 0.00 0.00 59.36 58.39 1dtd h GLU 647 Cb 0.36 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.56 1dtd h GLU 647 CO 0.00 0.18 -0.52 1.05 -1.00 0.00 0.00 179.01 178.73 1dtd h GLU 648 N 0.17 0.34 -0.58 2.33 4.11 -1.43 -2.98 114.58 116.54 1dtd h GLU 648 Ca 0.05 -0.20 -0.04 0.00 0.07 0.00 0.00 59.36 59.25 1dtd h GLU 648 Cb 0.03 0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.27 1dtd h GLU 648 CO -0.01 0.78 0.21 1.15 0.07 0.00 0.00 179.01 181.21 1dtd h THR 649 N 0.27 1.22 -0.96 -1.06 2.02 -1.05 -2.56 112.91 110.79 1dtd h THR 649 Ca 0.01 -0.70 0.11 0.00 0.77 0.00 0.00 66.41 66.60 1dtd h THR 649 Cb 1.00 0.54 -0.07 0.00 -1.74 0.00 0.00 68.15 67.88 1dtd h THR 649 CO 0.09 0.27 0.61 -0.25 0.37 0.00 0.00 175.52 176.61 1dtd h TRP 650 N 0.84 1.06 -0.66 3.16 -0.00 -1.08 0.54 115.95 119.81 1dtd h TRP 650 Ca 0.20 0.03 -0.07 0.00 -0.00 0.00 0.00 58.89 59.04 1dtd h TRP 650 Cb 0.20 -0.34 -0.03 0.00 -0.00 0.00 0.00 29.16 28.99 1dtd h TRP 650 CO 0.01 0.45 0.13 -0.07 -0.00 0.00 0.00 178.44 178.97 1dtd h LEU 651 N 0.95 1.02 0.19 0.65 3.38 -1.49 0.76 115.31 120.77 1dtd h LEU 651 Ca 0.46 -0.23 -0.01 0.00 0.09 0.00 0.00 57.88 58.19 1dtd h LEU 651 Cb 0.45 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.93 1dtd h LEU 651 CO -0.22 1.00 -0.09 1.23 0.09 0.00 0.00 178.44 180.45 1dtd h GLY 652 N 1.06 -0.27 0.06 0.83 0.00 -1.27 -2.50 103.07 100.98 1dtd h GLY 652 Ca 0.21 0.10 0.11 0.00 0.00 0.00 0.00 47.33 47.74 1dtd h GLY 652 CO 0.01 -0.10 -0.04 1.41 0.00 0.00 0.00 176.54 177.82 1dtd h LEU 653 N -0.55 -0.31 -0.90 3.11 3.38 -0.79 -2.61 115.31 116.64 1dtd h LEU 653 Ca -0.03 0.14 0.02 0.00 0.09 0.00 0.00 57.88 58.10 1dtd h LEU 653 Cb 0.42 0.26 -0.05 0.00 0.09 0.00 0.00 40.66 41.37 1dtd h LEU 653 CO 0.04 -0.11 0.59 0.50 0.09 0.00 0.00 178.44 179.55 1dtd h LYS 654 N 0.08 1.14 -0.57 1.13 3.64 -0.82 -1.34 116.57 119.83 1dtd h LYS 654 Ca 0.27 -0.07 0.05 0.00 -1.27 0.00 0.00 60.65 59.62 1dtd h LYS 654 Cb 0.41 -0.26 -0.05 0.00 -0.41 0.00 0.00 32.23 31.93 1dtd h LYS 654 CO -0.48 0.76 0.31 0.00 -2.27 0.00 0.00 179.45 177.77 1dtd h ALA 655 N 1.35 0.74 -0.25 5.00 0.00 -1.26 0.87 119.26 125.71 1dtd h ALA 655 Ca 0.34 0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.23 1dtd h ALA 655 Cb -0.08 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1dtd h ALA 655 CO -0.09 -0.02 0.02 0.82 0.00 0.00 0.00 179.25 179.97 1dtd h ILE 656 N 0.59 1.25 -0.34 0.00 2.04 -1.06 -2.81 117.51 117.17 1dtd h ILE 656 Ca 0.25 -0.85 -0.07 0.00 1.00 0.00 0.00 64.86 65.19 1dtd h ILE 656 Cb 0.14 1.31 -0.02 0.00 -0.74 0.00 0.00 36.82 37.51 1dtd h ILE 656 CO -0.16 0.27 -0.08 0.24 0.00 0.00 0.00 178.15 178.42 1dtd h MET 657 N 0.23 0.56 -0.69 2.37 2.86 -0.90 -1.46 114.93 117.90 1dtd h MET 657 Ca 0.07 -0.15 0.04 0.00 -2.06 0.00 0.00 59.70 57.60 1dtd h MET 657 Cb 0.38 -0.06 -0.05 0.00 0.06 0.00 0.00 31.60 31.93 1dtd h MET 657 CO 0.01 0.65 0.42 0.93 1.06 0.00 0.00 176.91 179.97 1dtd h GLU 658 N 0.52 0.77 -0.47 1.72 5.08 -0.81 0.06 114.58 121.46 1dtd h GLU 658 Ca 0.10 -0.05 -0.06 0.00 -1.00 0.00 0.00 59.36 58.35 1dtd h GLU 658 Cb 0.46 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.51 1dtd h GLU 658 CO 0.02 0.51 0.04 1.25 -1.00 0.00 0.00 179.01 179.83 1dtd h HIS 659 N 0.79 0.78 -0.29 4.33 2.76 -1.09 -0.42 115.15 122.01 1dtd h HIS 659 Ca 0.29 -0.09 -0.08 0.00 -2.20 0.00 0.00 60.37 58.29 1dtd h HIS 659 Cb 0.09 -0.22 -0.01 0.00 1.55 0.00 0.00 27.41 28.82 1dtd h HIS 659 CO -0.05 0.71 -0.12 0.28 -1.30 0.00 0.00 177.93 177.44 1dtd h VAL 660 N 0.71 1.29 -0.63 5.26 2.07 -0.75 -1.56 116.25 122.65 1dtd h VAL 660 Ca 0.15 -1.20 0.08 0.00 0.82 0.00 0.00 66.70 66.55 1dtd h VAL 660 Cb 0.38 1.47 -0.07 0.00 -1.52 0.00 0.00 31.29 31.54 1dtd h VAL 660 CO 0.01 0.38 0.28 -0.09 0.02 0.00 0.00 177.57 178.17 1dtd h ARG 661 N 0.34 0.48 0.00 1.57 2.43 -0.56 -2.79 114.38 115.86 1dtd h ARG 661 Ca 0.07 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.21 1dtd h ARG 661 Cb 0.63 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 30.08 1dtd h ARG 661 CO 0.04 0.32 -0.06 -0.25 -1.51 0.00 0.00 179.97 178.51 1dtd n ASP 662 N -4.93 0.66 -3.33 -3.80 8.00 -0.21 -4.35 116.55 108.61 1dtd n ASP 662 Ca 0.09 0.51 -0.26 0.00 0.71 0.00 0.00 54.79 55.84 1dtd n ASP 662 Cb 0.25 -0.65 -0.07 0.00 -0.02 0.00 0.00 41.12 40.62 1dtd n ASP 662 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 1dtd n HIS 663 N -2.11 2.64 -1.68 1.24 8.25 -0.62 -5.08 115.22 117.86 1dtd n HIS 663 Ca 0.06 -4.00 -0.36 0.00 -0.26 0.00 0.00 57.72 53.16 1dtd n HIS 663 Cb 0.41 -0.50 0.07 0.00 1.12 0.00 0.00 29.99 31.10 1dtd n HIS 663 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 1dtd s PRO 664 N -2.24 2.47 0.00 -0.41 0.04 -1.26 -4.90 135.00 128.71 1dtd s PRO 664 Ca 0.39 1.96 0.00 0.00 0.04 0.00 0.00 61.00 63.39 1dtd s PRO 664 Cb 0.17 -1.85 0.00 0.00 0.04 0.00 0.00 34.50 32.86 1dtd s PRO 664 CO -0.04 -1.63 0.00 2.48 0.04 0.00 0.00 177.00 177.84