#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i59 n HIS 354 N 0.00 2.29 -2.24 1.43 8.25 -1.26 -5.08 115.22 118.60 1i59 n HIS 354 Ca 0.00 -3.92 -0.38 0.00 -0.26 0.00 0.00 57.72 53.17 1i59 n HIS 354 Cb 0.00 -0.46 -0.01 0.00 1.12 0.00 0.00 29.99 30.64 1i59 n HIS 354 CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 1i59 s MET 355 N -2.90 3.85 -0.17 -0.41 -1.94 -1.26 -1.03 119.30 115.43 1i59 s MET 355 Ca 0.44 1.83 -0.16 0.00 -1.71 0.00 0.00 55.69 56.09 1i59 s MET 355 Cb 0.30 -2.51 0.05 0.00 2.01 0.00 0.00 34.83 34.67 1i59 s MET 355 CO -0.11 -0.49 0.46 0.54 -0.01 0.00 0.00 175.02 175.42 1i59 s VAL 356 N -1.48 -0.00 0.29 -6.03 0.11 -0.45 -4.82 120.40 108.01 1i59 s VAL 356 Ca 0.61 0.00 -0.29 0.00 -2.93 0.00 0.00 61.98 59.38 1i59 s VAL 356 Cb -0.30 -0.65 -0.13 0.00 -1.53 0.00 0.00 36.38 33.77 1i59 s VAL 356 CO 0.37 0.00 1.19 -0.81 -3.33 0.00 0.00 175.10 172.52 1i59 n PRO 357 N 2.91 1.74 0.00 1.54 -0.04 -1.26 -2.25 135.00 137.63 1i59 n PRO 357 Ca -0.14 0.61 0.06 0.00 -0.04 0.00 0.00 63.50 63.99 1i59 n PRO 357 Cb 0.57 -2.12 0.32 0.00 -0.04 0.00 0.00 33.50 32.23 1i59 n PRO 357 CO 0.00 0.00 0.00 1.51 -0.04 0.00 0.00 175.50 176.97 1i59 n ILE 358 N 0.63 0.45 0.26 0.52 3.06 0.40 -2.16 119.36 122.51 1i59 n ILE 358 Ca 0.08 0.11 0.12 0.00 -2.50 0.00 0.00 62.75 60.57 1i59 n ILE 358 Cb 0.33 -0.92 0.68 0.00 0.54 0.00 0.00 39.64 40.27 1i59 n ILE 358 CO 0.00 0.00 0.00 0.77 -2.50 0.00 0.00 176.55 174.82 1i59 h SER 359 N 0.00 0.00 0.22 9.51 4.64 -1.71 -0.97 113.55 125.24 1i59 h SER 359 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1i59 h SER 359 Cb 0.07 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.16 1i59 h SER 359 CO 0.00 0.14 0.00 -0.26 -0.87 0.00 0.00 176.83 175.84 1i59 h PHE 360 N 0.00 0.00 0.00 4.77 -1.00 -1.75 -1.15 116.94 117.81 1i59 h PHE 360 Ca -0.00 0.00 -0.06 0.00 2.81 0.00 0.00 57.97 60.72 1i59 h PHE 360 Cb 0.39 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.94 1i59 h PHE 360 CO 0.00 0.00 -1.31 1.55 -1.61 0.00 0.00 178.31 176.94 1i59 n VAL 361 N -2.68 0.23 0.03 -0.55 3.14 -0.60 -4.69 118.33 113.21 1i59 n VAL 361 Ca -0.01 -0.18 -0.14 0.00 -2.96 0.00 0.00 64.34 61.05 1i59 n VAL 361 Cb 0.11 -0.44 -0.03 0.00 -1.06 0.00 0.00 33.84 32.42 1i59 n VAL 361 CO 0.00 0.00 0.00 -0.26 -6.46 0.00 0.00 176.83 170.11 1i59 h PHE 362 N 0.00 0.76 -0.56 1.45 -1.00 -0.98 -3.32 116.94 113.29 1i59 h PHE 362 Ca -0.09 -0.36 0.16 0.00 2.81 0.00 0.00 57.97 60.49 1i59 h PHE 362 Cb 0.94 -0.11 -0.02 0.00 3.61 0.00 0.00 35.95 40.38 1i59 h PHE 362 CO 0.00 1.16 0.54 -2.95 -1.61 0.00 0.00 178.31 175.45 1i59 h ASN 363 N 0.35 0.00 0.51 2.17 7.08 -1.48 -1.34 115.58 122.87 1i59 h ASN 363 Ca -0.06 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.16 1i59 h ASN 363 Cb 1.44 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.68 1i59 h ASN 363 CO 0.15 0.00 -0.15 -2.11 -2.08 0.00 0.00 177.43 173.24 1i59 n ARG 364 N -3.80 0.44 0.07 4.14 -4.01 -1.25 -4.34 116.66 107.91 1i59 n ARG 364 Ca 0.11 -0.15 -0.21 0.00 -1.04 0.00 0.00 57.85 56.56 1i59 n ARG 364 Cb 0.76 -1.50 -0.13 0.00 -3.04 0.00 0.00 32.46 28.55 1i59 n ARG 364 CO 0.00 0.00 0.00 0.74 -3.04 0.00 0.00 177.63 175.33 1i59 h PHE 365 N 0.36 0.84 -0.82 2.89 0.05 -1.46 -3.28 116.94 115.53 1i59 h PHE 365 Ca 0.00 -0.54 0.19 0.00 3.82 0.00 0.00 57.97 61.45 1i59 h PHE 365 Cb 0.41 -0.07 -0.15 0.00 2.00 0.00 0.00 35.95 38.14 1i59 h PHE 365 CO 0.00 1.38 -0.02 -1.35 -0.18 0.00 0.00 178.31 178.15 1i59 h PRO 366 N 0.07 0.07 -0.25 1.51 0.11 -1.76 0.29 132.00 132.04 1i59 h PRO 366 Ca -0.16 -0.00 -0.15 0.00 0.11 0.00 0.00 66.00 65.79 1i59 h PRO 366 Cb 1.75 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.84 1i59 h PRO 366 CO 0.20 0.05 -0.47 -0.09 -0.21 0.00 0.00 178.00 177.48 1i59 h ARG 367 N 0.07 0.65 -0.50 1.05 9.65 -1.87 -2.21 114.38 121.23 1i59 h ARG 367 Ca 0.45 -0.37 -0.07 0.00 -1.10 0.00 0.00 59.98 58.89 1i59 h ARG 367 Cb 0.82 0.03 -0.02 0.00 -1.39 0.00 0.00 29.97 29.41 1i59 h ARG 367 CO -0.75 0.98 0.04 0.52 2.80 0.00 0.00 179.97 183.55 1i59 h MET 368 N 0.52 0.86 -0.46 0.20 2.86 -0.94 -1.90 114.93 116.06 1i59 h MET 368 Ca 0.03 -0.26 -0.02 0.00 -2.06 0.00 0.00 59.70 57.39 1i59 h MET 368 Cb 1.01 -0.09 -0.02 0.00 0.06 0.00 0.00 31.60 32.56 1i59 h MET 368 CO 0.09 0.88 0.19 0.28 1.06 0.00 0.00 176.91 179.42 1i59 h VAL 369 N 0.73 1.20 -0.18 -2.22 2.07 -0.51 -1.29 116.25 116.06 1i59 h VAL 369 Ca 0.15 -0.62 -0.00 0.00 0.82 0.00 0.00 66.70 67.05 1i59 h VAL 369 Cb 0.47 0.75 -0.01 0.00 -1.52 0.00 0.00 31.29 30.97 1i59 h VAL 369 CO 0.02 0.23 0.10 -0.09 0.02 0.00 0.00 177.57 177.85 1i59 h ARG 370 N 0.61 0.25 -0.67 1.57 9.65 -1.29 -0.15 114.38 124.35 1i59 h ARG 370 Ca 0.16 -0.03 -0.05 0.00 -1.10 0.00 0.00 59.98 58.96 1i59 h ARG 370 Cb 0.18 -0.05 -0.03 0.00 -1.39 0.00 0.00 29.97 28.68 1i59 h ARG 370 CO -0.01 0.25 0.22 -0.44 2.80 0.00 0.00 179.97 182.79 1i59 h ASP 371 N 0.19 0.93 -0.42 -3.80 3.32 -1.25 -1.82 116.42 113.57 1i59 h ASP 371 Ca 0.06 -0.15 -0.08 0.00 0.02 0.00 0.00 57.03 56.88 1i59 h ASP 371 Cb 0.07 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.36 1i59 h ASP 371 CO -0.01 0.86 -0.04 -0.07 -1.72 0.00 0.00 179.24 178.26 1i59 h LEU 372 N 0.98 0.76 -0.52 1.55 3.38 -0.99 -1.88 115.31 118.59 1i59 h LEU 372 Ca 0.22 -0.33 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 1i59 h LEU 372 Cb 0.25 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 1i59 h LEU 372 CO -0.01 0.91 0.30 0.00 0.09 0.00 0.00 178.44 179.73 1i59 h ALA 373 N 0.87 0.66 -0.43 1.53 0.00 -0.74 -0.84 119.26 120.32 1i59 h ALA 373 Ca 0.11 -0.08 -0.08 0.00 0.00 0.00 0.00 54.91 54.87 1i59 h ALA 373 Cb 0.55 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 1i59 h ALA 373 CO 0.03 0.17 -0.05 -0.22 0.00 0.00 0.00 179.25 179.18 1i59 h LYS 374 N 0.69 0.72 -0.25 0.00 3.64 -1.28 0.73 116.57 120.83 1i59 h LYS 374 Ca 0.18 -0.20 -0.11 0.00 -1.27 0.00 0.00 60.65 59.25 1i59 h LYS 374 Cb 0.02 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 31.75 1i59 h LYS 374 CO -0.03 0.77 -0.31 -0.22 -2.27 0.00 0.00 179.45 177.39 1i59 h LYS 375 N 0.67 0.51 -0.43 1.90 3.64 -0.96 -3.09 116.57 118.81 1i59 h LYS 375 Ca 0.13 -0.21 0.00 0.00 -1.27 0.00 0.00 60.65 59.29 1i59 h LYS 375 Cb 0.48 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.29 1i59 h LYS 375 CO 0.02 0.76 0.00 -1.33 -2.27 0.00 0.00 179.45 176.63 1i59 n MET 376 N -4.09 2.49 -3.54 1.90 2.81 -0.35 -4.97 117.12 111.37 1i59 n MET 376 Ca -0.01 -2.27 -0.21 0.00 -1.81 0.00 0.00 57.70 53.41 1i59 n MET 376 Cb 0.44 -1.52 0.08 0.00 -0.71 0.00 0.00 33.22 31.52 1i59 n MET 376 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 1i59 n ASN 377 N 1.45 -3.86 -4.29 7.83 3.02 -0.03 -5.01 115.26 114.36 1i59 n ASN 377 Ca 0.20 -0.61 -0.30 0.00 -0.03 0.00 0.00 54.58 53.84 1i59 n ASN 377 Cb 0.59 -4.96 -0.16 0.00 -0.61 0.00 0.00 39.78 34.65 1i59 n ASN 377 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1i59 s LYS 378 N -5.85 1.90 -0.35 3.52 -0.14 0.05 -4.67 119.74 114.20 1i59 s LYS 378 Ca 0.27 -0.92 -0.10 0.00 -1.36 0.00 0.00 55.97 53.87 1i59 s LYS 378 Cb -0.12 -1.89 0.02 0.00 -1.68 0.00 0.00 37.83 34.16 1i59 s LYS 378 CO 0.74 0.51 0.17 -1.21 -0.76 0.00 0.00 175.35 174.80 1i59 s GLU 379 N -0.73 2.92 -0.02 1.68 2.02 -1.26 -4.32 118.70 118.99 1i59 s GLU 379 Ca 0.10 -1.01 0.05 0.00 0.02 0.00 0.00 54.97 54.13 1i59 s GLU 379 Cb -0.09 -3.62 -0.01 0.00 0.10 0.00 0.00 34.13 30.50 1i59 s GLU 379 CO -0.00 -0.62 -0.16 0.14 0.02 0.00 0.00 175.26 174.64 1i59 s VAL 380 N 1.54 1.29 -0.39 2.63 -7.23 -1.26 -1.59 120.40 115.39 1i59 s VAL 380 Ca 0.02 -0.69 -0.15 0.00 -1.81 0.00 0.00 61.98 59.35 1i59 s VAL 380 Cb -0.19 -1.09 0.01 0.00 0.56 0.00 0.00 36.38 35.68 1i59 s VAL 380 CO 0.06 0.37 0.33 0.21 -0.31 0.00 0.00 175.10 175.75 1i59 s ASN 381 N -0.29 6.13 -0.18 4.85 2.47 0.11 -4.94 114.94 123.09 1i59 s ASN 381 Ca 0.04 -0.64 -0.15 0.00 0.42 0.00 0.00 52.86 52.53 1i59 s ASN 381 Cb -0.07 -2.18 -0.04 0.00 -1.45 0.00 0.00 41.25 37.51 1i59 s ASN 381 CO -0.00 -0.42 0.36 0.12 -3.72 0.00 0.00 177.10 173.45 1i59 s PHE 382 N 1.84 3.42 -0.07 0.43 5.36 -1.26 -1.49 117.98 126.21 1i59 s PHE 382 Ca 0.08 0.63 0.04 0.00 -0.96 0.00 0.00 56.93 56.72 1i59 s PHE 382 Cb -0.18 -2.46 0.00 0.00 -0.34 0.00 0.00 43.02 40.05 1i59 s PHE 382 CO 0.11 0.10 -0.19 0.42 -1.46 0.00 0.00 175.22 174.20 1i59 s ILE 383 N 0.91 1.65 -0.08 3.12 1.01 0.08 -4.98 121.20 122.92 1i59 s ILE 383 Ca 0.19 -0.81 0.05 0.00 0.00 0.00 0.00 60.65 60.07 1i59 s ILE 383 Cb -0.14 -1.43 -0.01 0.00 0.01 0.00 0.00 42.46 40.89 1i59 s ILE 383 CO 0.07 0.47 -0.24 -0.04 0.00 0.00 0.00 174.94 175.20 1i59 s MET 384 N 0.23 2.76 0.13 2.79 -1.94 -1.26 -0.63 119.30 121.38 1i59 s MET 384 Ca -0.11 -0.88 0.06 0.00 -1.71 0.00 0.00 55.69 53.06 1i59 s MET 384 Cb -0.15 -2.24 -0.04 0.00 2.01 0.00 0.00 34.83 34.41 1i59 s MET 384 CO 0.05 0.32 -0.15 1.03 -0.01 0.00 0.00 175.02 176.26 1i59 s ARG 385 N 0.01 1.06 -1.46 2.03 0.52 0.13 -4.83 118.95 116.41 1i59 s ARG 385 Ca -0.08 -1.27 -0.08 0.00 -0.52 0.00 0.00 55.73 53.78 1i59 s ARG 385 Cb -0.15 -0.96 0.03 0.00 0.52 0.00 0.00 34.95 34.38 1i59 s ARG 385 CO 0.05 0.19 0.87 0.41 0.02 0.00 0.00 175.30 176.84 1i59 n GLY 386 N 0.49 -0.53 0.00 -3.53 0.00 -1.26 -2.13 105.19 98.23 1i59 n GLY 386 Ca -0.15 0.18 0.07 0.00 0.00 0.00 0.00 46.02 46.13 1i59 n GLY 386 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1i59 n GLU 387 N -4.47 0.25 -0.01 1.61 4.71 -1.26 -1.53 120.64 119.94 1i59 n GLU 387 Ca -0.04 0.13 0.13 0.00 -0.01 0.00 0.00 57.16 57.37 1i59 n GLU 387 Cb 0.58 -1.50 0.28 0.00 -1.01 0.00 0.00 31.44 29.79 1i59 n GLU 387 CO 0.00 0.00 0.00 -0.40 0.09 0.00 0.00 177.13 176.82 1i59 n ASP 388 N -1.24 2.37 -4.65 1.62 5.68 -1.26 -2.19 116.55 116.89 1i59 n ASP 388 Ca 0.08 -1.79 -0.42 0.00 -0.50 0.00 0.00 54.79 52.15 1i59 n ASP 388 Cb 0.10 -0.01 -0.03 0.00 -1.14 0.00 0.00 41.12 40.05 1i59 n ASP 388 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 1i59 s THR 389 N -1.98 3.44 0.25 2.12 2.01 -0.58 -4.68 115.64 116.21 1i59 s THR 389 Ca 0.32 0.52 -0.28 0.00 0.31 0.00 0.00 61.69 62.56 1i59 s THR 389 Cb 0.20 -3.36 -0.09 0.00 0.01 0.00 0.00 72.50 69.26 1i59 s THR 389 CO 0.31 -0.08 0.92 -1.61 -0.69 0.00 0.00 174.62 173.47 1i59 s GLU 390 N 4.37 4.76 0.15 4.92 0.41 -1.26 -0.46 118.70 131.59 1i59 s GLU 390 Ca 0.78 1.41 -0.21 0.00 -0.41 0.00 0.00 54.97 56.54 1i59 s GLU 390 Cb -0.34 -3.18 0.06 0.00 -1.78 0.00 0.00 34.13 28.88 1i59 s GLU 390 CO 0.33 0.48 0.54 -0.48 -0.49 0.00 0.00 175.26 175.63 1i59 s LEU 391 N -1.35 -0.24 0.02 1.80 2.34 -0.96 -4.88 118.68 115.41 1i59 s LEU 391 Ca 0.42 -0.13 -0.36 0.00 0.06 0.00 0.00 54.13 54.12 1i59 s LEU 391 Cb -0.24 2.35 -0.15 0.00 -0.56 0.00 0.00 46.19 47.59 1i59 s LEU 391 CO 0.30 -0.95 1.52 -0.67 -1.06 0.00 0.00 176.35 175.49 1i59 n ASP 392 N -0.33 2.29 -0.33 1.48 2.03 -1.26 -1.34 116.55 119.08 1i59 n ASP 392 Ca -0.16 1.09 0.20 0.00 0.52 0.00 0.00 54.79 56.44 1i59 n ASP 392 Cb 0.64 -1.25 0.42 0.00 -0.72 0.00 0.00 41.12 40.21 1i59 n ASP 392 CO 0.00 0.00 0.00 0.08 -1.92 0.00 0.00 177.20 175.36 1i59 h ARG 393 N 5.80 0.38 -0.22 -0.67 0.11 -1.40 0.89 114.38 119.27 1i59 h ARG 393 Ca -0.47 -0.02 0.04 0.00 0.10 0.00 0.00 59.98 59.63 1i59 h ARG 393 Cb 1.31 -0.09 -0.04 0.00 1.11 0.00 0.00 29.97 32.27 1i59 h ARG 393 CO 0.85 0.25 -0.01 1.15 0.10 0.00 0.00 179.97 182.32 1i59 h THR 394 N 0.39 0.84 -0.84 0.08 2.02 -1.88 -1.04 112.91 112.48 1i59 h THR 394 Ca 0.68 -0.02 -0.00 0.00 0.77 0.00 0.00 66.41 67.83 1i59 h THR 394 Cb 1.44 0.77 -0.04 0.00 -1.74 0.00 0.00 68.15 68.58 1i59 h THR 394 CO -0.57 0.01 0.51 -0.26 0.37 0.00 0.00 175.52 175.58 1i59 h PHE 395 N 0.06 1.11 -0.56 3.16 0.05 -1.20 -1.76 116.94 117.79 1i59 h PHE 395 Ca 0.10 -0.00 0.04 0.00 3.82 0.00 0.00 57.97 61.93 1i59 h PHE 395 Cb 0.14 -0.36 -0.04 0.00 2.00 0.00 0.00 35.95 37.68 1i59 h PHE 395 CO -0.19 0.74 0.31 0.28 -0.18 0.00 0.00 178.31 179.27 1i59 h VAL 396 N 1.16 1.00 -0.44 -0.55 2.07 -0.68 0.11 116.25 118.91 1i59 h VAL 396 Ca 0.30 -0.21 -0.11 0.00 0.82 0.00 0.00 66.70 67.50 1i59 h VAL 396 Cb -0.05 0.34 -0.02 0.00 -1.52 0.00 0.00 31.29 30.04 1i59 h VAL 396 CO -0.06 0.11 -0.16 -0.33 0.02 0.00 0.00 177.57 177.15 1i59 h GLU 397 N 0.61 0.84 0.00 1.57 4.39 -0.76 -3.29 114.58 117.94 1i59 h GLU 397 Ca 0.24 -0.32 -0.08 0.00 0.34 0.00 0.00 59.36 59.54 1i59 h GLU 397 Cb 0.10 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 28.68 1i59 h GLU 397 CO -0.14 0.95 -0.77 0.93 -1.16 0.00 0.00 179.01 178.82 1i59 h GLU 398 N 0.74 0.00 0.00 2.33 4.39 -0.88 -3.36 114.58 117.80 1i59 h GLU 398 Ca 0.11 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.81 1i59 h GLU 398 Cb 0.68 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.33 1i59 h GLU 398 CO 0.05 0.26 0.00 1.51 -1.16 0.00 0.00 179.01 179.67 1i59 n ILE 399 N -3.00 0.40 0.15 3.13 0.13 0.33 -4.06 119.36 116.44 1i59 n ILE 399 Ca -0.01 -0.12 -0.14 0.00 -1.10 0.00 0.00 62.75 61.38 1i59 n ILE 399 Cb 0.69 -0.61 -0.06 0.00 -0.84 0.00 0.00 39.64 38.82 1i59 n ILE 399 CO 0.00 0.00 0.00 1.23 2.80 0.00 0.00 176.55 180.58 1i59 h GLY 400 N 4.47 -0.62 0.41 4.50 0.00 -1.72 -1.79 103.07 108.33 1i59 h GLY 400 Ca 0.00 0.35 0.04 0.00 0.00 0.00 0.00 47.33 47.72 1i59 h GLY 400 CO 0.00 -0.25 -0.21 -2.09 0.00 0.00 0.00 176.54 173.99 1i59 h GLU 401 N -0.57 -0.28 -0.23 4.80 4.81 -1.87 -1.29 114.58 119.96 1i59 h GLU 401 Ca 0.01 0.02 0.04 0.00 -0.13 0.00 0.00 59.36 59.30 1i59 h GLU 401 Cb 0.56 0.06 -0.04 0.00 0.63 0.00 0.00 28.75 29.97 1i59 h GLU 401 CO -0.13 -0.19 0.00 -1.35 -0.73 0.00 0.00 179.01 176.62 1i59 h PRO 402 N -0.29 0.07 -0.89 0.92 0.11 -1.75 -1.80 132.00 128.37 1i59 h PRO 402 Ca 0.08 -0.00 0.06 0.00 0.11 0.00 0.00 66.00 66.25 1i59 h PRO 402 Cb 0.41 -0.02 -0.06 0.00 0.11 0.00 0.00 31.00 31.44 1i59 h PRO 402 CO -0.25 0.05 0.56 -0.07 -0.21 0.00 0.00 178.00 178.08 1i59 h LEU 403 N 0.07 0.89 -0.72 2.35 3.38 -1.09 -0.88 115.31 119.32 1i59 h LEU 403 Ca 0.11 0.01 0.03 0.00 0.09 0.00 0.00 57.88 58.12 1i59 h LEU 403 Cb 0.14 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 40.67 1i59 h LEU 403 CO -0.18 0.57 0.46 0.25 0.09 0.00 0.00 178.44 179.63 1i59 h LEU 404 N 1.03 0.76 -1.07 1.67 5.85 -0.70 0.42 115.31 123.27 1i59 h LEU 404 Ca 0.38 -0.00 0.01 0.00 0.84 0.00 0.00 57.88 59.11 1i59 h LEU 404 Cb 0.15 -0.17 -0.05 0.00 0.37 0.00 0.00 40.66 40.97 1i59 h LEU 404 CO -0.17 0.52 0.63 0.45 -0.34 0.00 0.00 178.44 179.53 1i59 h HIS 405 N 0.90 1.19 -0.24 1.25 3.86 -0.36 0.22 115.15 121.97 1i59 h HIS 405 Ca 0.29 0.03 -0.20 0.00 -1.16 0.00 0.00 60.37 59.32 1i59 h HIS 405 Cb 0.01 -0.40 0.00 0.00 1.06 0.00 0.00 27.41 28.08 1i59 h HIS 405 CO -0.04 0.75 -0.64 -0.07 0.86 0.00 0.00 177.93 178.79 1i59 h LEU 406 N 1.29 0.98 -0.36 2.43 3.38 -0.45 -1.63 115.31 120.94 1i59 h LEU 406 Ca 0.35 -0.57 -0.03 0.00 0.09 0.00 0.00 57.88 57.72 1i59 h LEU 406 Cb -0.15 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.30 1i59 h LEU 406 CO -0.07 1.37 0.11 -0.07 0.09 0.00 0.00 178.44 179.87 1i59 h LEU 407 N 0.63 0.52 -0.75 1.67 3.38 -0.67 -1.79 115.31 118.30 1i59 h LEU 407 Ca -0.01 -0.20 -0.00 0.00 0.09 0.00 0.00 57.88 57.75 1i59 h LEU 407 Cb 1.26 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 41.84 1i59 h LEU 407 CO 0.14 0.58 0.45 -0.09 0.09 0.00 0.00 178.44 179.61 1i59 h ARG 408 N 0.43 1.02 -0.76 1.13 2.43 -0.95 -1.74 114.38 115.93 1i59 h ARG 408 Ca 0.12 -0.09 0.05 0.00 -0.81 0.00 0.00 59.98 59.25 1i59 h ARG 408 Cb 0.25 -0.21 -0.06 0.00 -0.42 0.00 0.00 29.97 29.53 1i59 h ARG 408 CO -0.00 0.72 0.46 -0.91 -1.51 0.00 0.00 179.97 178.73 1i59 h ASN 409 N 1.02 0.72 -0.59 -3.80 2.35 -0.98 0.13 115.58 114.44 1i59 h ASN 409 Ca 0.27 0.02 -0.05 0.00 -0.55 0.00 0.00 56.30 55.99 1i59 h ASN 409 Cb -0.04 -0.13 -0.02 0.00 0.05 0.00 0.00 38.32 38.18 1i59 h ASN 409 CO -0.05 0.47 0.17 0.00 -1.65 0.00 0.00 177.43 176.37 1i59 h ALA 410 N 1.36 0.77 0.00 -0.83 0.00 -0.75 0.38 119.26 120.20 1i59 h ALA 410 Ca 0.33 -0.21 -0.12 0.00 0.00 0.00 0.00 54.91 54.91 1i59 h ALA 410 Cb 0.14 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 1i59 h ALA 410 CO -0.16 0.45 -0.56 0.82 0.00 0.00 0.00 179.25 179.81 1i59 h ILE 411 N 0.84 1.32 0.00 0.00 2.04 -0.78 0.37 117.51 121.30 1i59 h ILE 411 Ca 0.19 -1.96 0.00 0.00 1.00 0.00 0.00 64.86 64.09 1i59 h ILE 411 Cb 0.31 2.08 0.00 0.00 -0.74 0.00 0.00 36.82 38.47 1i59 h ILE 411 CO -0.00 0.54 -0.04 -0.78 0.00 0.00 0.00 178.15 177.87 1i59 h ASP 412 N 0.00 0.00 0.88 1.72 -0.00 -0.82 -3.41 116.42 114.79 1i59 h ASP 412 Ca -0.01 0.00 -0.23 0.00 -0.00 0.00 0.00 57.03 56.79 1i59 h ASP 412 Cb 1.03 0.00 -0.02 0.00 -0.00 0.00 0.00 39.33 40.34 1i59 h ASP 412 CO 0.07 0.08 -1.09 0.45 -0.00 0.00 0.00 179.24 178.76 1i59 h HIS 413 N -0.13 0.13 0.00 0.28 3.86 -1.09 -3.43 115.15 114.77 1i59 h HIS 413 Ca 0.00 -0.10 0.00 0.00 -1.16 0.00 0.00 60.37 59.11 1i59 h HIS 413 Cb 0.04 -0.01 0.00 0.00 1.06 0.00 0.00 27.41 28.50 1i59 h HIS 413 CO -0.02 1.08 0.00 0.41 0.86 0.00 0.00 177.93 180.26 1i59 n GLY 414 N 1.41 0.26 3.68 2.45 0.00 -0.83 -4.68 105.19 107.48 1i59 n GLY 414 Ca -0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.57 1i59 n GLY 414 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1i59 s ILE 415 N -0.53 2.67 0.41 -0.61 -1.09 0.12 -1.27 121.20 120.89 1i59 s ILE 415 Ca 0.00 0.05 -0.07 0.00 -2.23 0.00 0.00 60.65 58.40 1i59 s ILE 415 Cb 0.00 -3.03 -0.05 0.00 -1.58 0.00 0.00 42.46 37.80 1i59 s ILE 415 CO 0.00 -0.00 0.73 -1.61 -1.23 0.00 0.00 174.94 172.83 1i59 s GLU 416 N 3.18 3.66 0.59 2.79 8.01 -1.26 -4.75 118.70 130.92 1i59 s GLU 416 Ca 0.83 0.27 -0.20 0.00 0.01 0.00 0.00 54.97 55.88 1i59 s GLU 416 Cb -0.45 -2.44 -0.04 0.00 -4.31 0.00 0.00 34.13 26.88 1i59 s GLU 416 CO 0.38 -0.04 1.15 -2.30 0.01 0.00 0.00 175.26 174.46 1i59 n PRO 417 N -1.56 1.20 -0.27 0.39 -0.02 -1.26 -4.65 135.00 128.82 1i59 n PRO 417 Ca 0.01 0.45 0.08 0.00 -2.02 0.00 0.00 63.50 62.02 1i59 n PRO 417 Cb 0.54 -2.36 0.23 0.00 -0.02 0.00 0.00 33.50 31.89 1i59 n PRO 417 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 1i59 h LYS 418 N 0.83 0.36 -0.63 -0.52 3.64 -1.83 0.14 116.57 118.56 1i59 h LYS 418 Ca -0.49 -0.02 0.06 0.00 -1.27 0.00 0.00 60.65 58.92 1i59 h LYS 418 Cb 1.34 -0.08 -0.04 0.00 -0.41 0.00 0.00 32.23 33.04 1i59 h LYS 418 CO 0.53 0.24 0.42 1.05 -2.27 0.00 0.00 179.45 179.42 1i59 h GLU 419 N 0.38 0.63 0.07 1.90 -0.00 -1.89 -0.80 114.58 114.86 1i59 h GLU 419 Ca 0.47 -0.04 -0.26 0.00 -0.00 0.00 0.00 59.36 59.53 1i59 h GLU 419 Cb 0.81 -0.14 0.02 0.00 -0.00 0.00 0.00 28.75 29.44 1i59 h GLU 419 CO -0.49 0.41 -1.07 1.49 -0.00 0.00 0.00 179.01 179.36 1i59 h GLU 420 N 0.65 0.61 -0.80 1.06 4.81 -1.11 -2.58 114.58 117.21 1i59 h GLU 420 Ca 0.27 -0.74 0.00 0.00 -0.13 0.00 0.00 59.36 58.76 1i59 h GLU 420 Cb 0.23 0.23 -0.04 0.00 0.63 0.00 0.00 28.75 29.81 1i59 h GLU 420 CO -0.08 1.32 0.52 0.00 -0.73 0.00 0.00 179.01 180.04 1i59 h ARG 421 N 0.22 1.07 0.34 1.92 3.08 -0.75 -0.28 114.38 119.98 1i59 h ARG 421 Ca -0.15 -0.08 -0.01 0.00 0.07 0.00 0.00 59.98 59.81 1i59 h ARG 421 Cb 1.75 -0.23 -0.01 0.00 0.08 0.00 0.00 29.97 31.55 1i59 h ARG 421 CO 0.21 0.72 -0.24 0.82 -1.07 0.00 0.00 179.97 180.41 1i59 h ILE 422 N 1.09 0.49 -0.63 2.04 2.04 -1.18 -1.42 117.51 119.95 1i59 h ILE 422 Ca 0.29 0.00 0.13 0.00 1.00 0.00 0.00 64.86 66.28 1i59 h ILE 422 Cb -0.10 0.49 -0.04 0.00 -0.74 0.00 0.00 36.82 36.44 1i59 h ILE 422 CO -0.06 0.00 0.43 0.00 0.00 0.00 0.00 178.15 178.52 1i59 h ALA 423 N 0.03 2.19 0.00 1.87 0.00 -1.08 -0.50 119.26 121.77 1i59 h ALA 423 Ca -0.03 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1i59 h ALA 423 Cb 0.49 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.24 1i59 h ALA 423 CO 0.01 -0.36 -0.09 1.63 0.00 0.00 0.00 179.25 180.45 1i59 n LYS 424 N -4.45 0.07 -2.41 0.00 5.02 -0.15 -4.95 118.16 111.29 1i59 n LYS 424 Ca 0.11 0.05 -0.00 0.00 -2.02 0.00 0.00 58.31 56.45 1i59 n LYS 424 Cb 0.50 -1.57 0.00 0.00 -0.02 0.00 0.00 35.03 33.94 1i59 n LYS 424 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1i59 n GLY 425 N 1.45 0.85 3.45 0.72 0.00 -0.20 -5.07 105.19 106.40 1i59 n GLY 425 Ca 0.06 -0.63 -0.22 0.00 0.00 0.00 0.00 46.02 45.23 1i59 n GLY 425 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1i59 s LYS 426 N -4.82 1.61 0.27 1.61 1.02 -0.66 -5.05 119.74 113.72 1i59 s LYS 426 Ca 0.00 -1.83 -0.30 0.00 0.02 0.00 0.00 55.97 53.86 1i59 s LYS 426 Cb -0.00 -1.19 -0.13 0.00 -0.52 0.00 0.00 37.83 36.00 1i59 s LYS 426 CO 0.01 0.01 1.46 -2.30 -0.92 0.00 0.00 175.35 173.61 1i59 n PRO 427 N -0.63 2.29 -0.11 -1.68 -0.02 -1.26 -4.32 135.00 129.27 1i59 n PRO 427 Ca -0.05 0.81 -0.06 0.00 -2.02 0.00 0.00 63.50 62.19 1i59 n PRO 427 Cb 0.64 -2.51 0.01 0.00 -0.02 0.00 0.00 33.50 31.62 1i59 n PRO 427 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1i59 h PRO 428 N 4.20 -0.13 -6.32 0.52 0.11 -1.89 -3.42 132.00 125.06 1i59 h PRO 428 Ca -0.46 0.01 -0.55 0.00 0.11 0.00 0.00 66.00 65.11 1i59 h PRO 428 Cb 1.26 0.03 -0.04 0.00 0.11 0.00 0.00 31.00 32.36 1i59 h PRO 428 CO 0.75 -0.09 0.12 0.42 -0.21 0.00 0.00 178.00 179.00 1i59 s ILE 429 N -6.13 4.66 0.48 4.15 1.09 -1.26 -4.42 121.20 119.75 1i59 s ILE 429 Ca -0.14 1.55 -0.15 0.00 -1.10 0.00 0.00 60.65 60.81 1i59 s ILE 429 Cb 0.14 -4.07 -0.08 0.00 -1.06 0.00 0.00 42.46 37.39 1i59 s ILE 429 CO 0.70 0.44 0.92 -0.83 -0.10 0.00 0.00 174.94 176.06 1i59 s GLY 430 N -0.49 2.05 -0.10 6.18 0.00 -0.62 -4.88 107.32 109.45 1i59 s GLY 430 Ca 0.36 0.07 0.02 0.00 0.00 0.00 0.00 44.72 45.17 1i59 s GLY 430 CO 0.23 0.32 -0.19 -1.59 0.00 0.00 0.00 173.10 171.87 1i59 s THR 431 N -2.53 2.56 -0.11 0.90 2.01 -1.26 0.09 115.64 117.31 1i59 s THR 431 Ca 0.57 -0.85 0.01 0.00 0.31 0.00 0.00 61.69 61.72 1i59 s THR 431 Cb -0.10 -2.02 0.02 0.00 0.01 0.00 0.00 72.50 70.41 1i59 s THR 431 CO 0.30 0.55 -0.12 -0.22 -0.69 0.00 0.00 174.62 174.45 1i59 s LEU 432 N 0.21 1.50 -0.13 4.42 2.96 -0.56 -2.52 118.68 124.56 1i59 s LEU 432 Ca -0.12 -0.36 0.03 0.00 -0.22 0.00 0.00 54.13 53.46 1i59 s LEU 432 Cb -0.16 -0.95 0.01 0.00 0.50 0.00 0.00 46.19 45.58 1i59 s LEU 432 CO 0.06 -0.04 -0.22 -0.63 -1.32 0.00 0.00 176.35 174.20 1i59 s ILE 433 N 1.26 2.10 -0.22 6.68 1.01 0.10 -0.74 121.20 131.39 1i59 s ILE 433 Ca -0.02 -0.98 -0.01 0.00 0.00 0.00 0.00 60.65 59.63 1i59 s ILE 433 Cb -0.14 -1.82 0.02 0.00 0.01 0.00 0.00 42.46 40.52 1i59 s ILE 433 CO -0.04 0.55 -0.11 -0.22 0.00 0.00 0.00 174.94 175.12 1i59 s LEU 434 N 0.63 2.75 0.09 2.97 2.96 0.19 -1.19 118.68 127.08 1i59 s LEU 434 Ca -0.12 -0.69 0.01 0.00 -0.22 0.00 0.00 54.13 53.11 1i59 s LEU 434 Cb -0.16 -1.61 -0.04 0.00 0.50 0.00 0.00 46.19 44.87 1i59 s LEU 434 CO 0.02 -0.06 -0.04 -0.94 -1.32 0.00 0.00 176.35 174.02 1i59 s SER 435 N 1.34 0.87 0.01 3.68 1.04 -0.66 -0.69 113.70 119.28 1i59 s SER 435 Ca 0.03 -1.04 0.01 0.00 0.48 0.00 0.00 55.95 55.43 1i59 s SER 435 Cb -0.15 0.15 -0.01 0.00 0.10 0.00 0.00 66.02 66.11 1i59 s SER 435 CO -0.07 -0.54 -0.04 0.00 0.98 0.00 0.00 173.24 173.56 1i59 s ALA 436 N -3.76 0.31 0.25 5.32 0.00 -0.90 -1.18 121.76 121.80 1i59 s ALA 436 Ca 0.13 -0.26 -0.20 0.00 0.00 0.00 0.00 51.96 51.63 1i59 s ALA 436 Cb 0.06 -0.04 0.02 0.00 0.00 0.00 0.00 23.12 23.17 1i59 s ALA 436 CO -0.05 0.04 0.65 -0.98 0.00 0.00 0.00 175.76 175.43 1i59 s ARG 437 N -0.38 1.66 -0.14 0.00 1.70 -0.32 -4.20 118.95 117.27 1i59 s ARG 437 Ca -0.01 -0.96 -0.07 0.00 -0.47 0.00 0.00 55.73 54.21 1i59 s ARG 437 Cb -0.03 0.58 -0.04 0.00 -0.57 0.00 0.00 34.95 34.89 1i59 s ARG 437 CO -0.00 -0.74 0.13 -1.01 -1.08 0.00 0.00 175.30 172.59 1i59 s HIS 438 N -3.91 3.52 -0.36 5.89 3.76 -1.26 -0.04 115.29 122.88 1i59 s HIS 438 Ca 0.11 0.45 0.00 0.00 -0.15 0.00 0.00 55.06 55.47 1i59 s HIS 438 Cb -0.04 -1.99 0.14 0.00 1.11 0.00 0.00 32.58 31.79 1i59 s HIS 438 CO 0.04 0.59 0.21 -2.00 -0.85 0.00 0.00 174.74 172.73 1i59 s GLU 439 N -0.63 0.64 6.51 1.40 2.12 -0.22 -4.93 118.70 123.59 1i59 s GLU 439 Ca 0.13 -1.37 0.00 0.00 0.36 0.00 0.00 54.97 54.09 1i59 s GLU 439 Cb -0.12 -1.47 0.00 0.00 0.26 0.00 0.00 34.13 32.80 1i59 s GLU 439 CO 0.02 -1.18 0.00 0.41 -0.54 0.00 0.00 175.26 173.97 1i59 n GLY 440 N 4.08 2.13 1.86 -1.50 0.00 -1.26 -2.44 105.19 108.05 1i59 n GLY 440 Ca 0.10 -0.43 -0.17 0.00 0.00 0.00 0.00 46.02 45.51 1i59 n GLY 440 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1i59 n ASN 441 N 4.64 4.39 -4.02 1.61 2.04 -1.26 -4.87 115.26 117.78 1i59 n ASN 441 Ca 0.00 -3.11 -0.12 0.00 -0.44 0.00 0.00 54.58 50.91 1i59 n ASN 441 Cb 0.00 -0.80 -0.12 0.00 -2.53 0.00 0.00 39.78 36.33 1i59 n ASN 441 CO 0.00 0.00 0.00 0.20 -0.44 0.00 0.00 177.26 177.02 1i59 s ASN 442 N -0.49 0.62 -0.19 0.53 0.02 -1.02 -2.12 114.94 112.29 1i59 s ASN 442 Ca 0.38 -0.48 -0.09 0.00 -1.02 0.00 0.00 52.86 51.65 1i59 s ASN 442 Cb 0.32 0.05 -0.05 0.00 0.02 0.00 0.00 41.25 41.59 1i59 s ASN 442 CO 0.05 -0.21 0.12 -0.69 0.02 0.00 0.00 177.10 176.40 1i59 s VAL 443 N -1.26 5.36 -0.17 1.60 1.01 -0.10 -1.06 120.40 125.78 1i59 s VAL 443 Ca -0.11 0.17 -0.01 0.00 0.00 0.00 0.00 61.98 62.03 1i59 s VAL 443 Cb -0.09 -3.43 -0.01 0.00 0.00 0.00 0.00 36.38 32.85 1i59 s VAL 443 CO -0.00 0.47 -0.12 -0.69 0.00 0.00 0.00 175.10 174.76 1i59 s VAL 444 N 0.17 2.92 -0.10 2.92 1.01 0.93 -0.67 120.40 127.58 1i59 s VAL 444 Ca 0.09 -0.67 0.01 0.00 0.00 0.00 0.00 61.98 61.40 1i59 s VAL 444 Cb -0.11 -2.26 -0.02 0.00 0.00 0.00 0.00 36.38 33.99 1i59 s VAL 444 CO -0.01 0.49 -0.13 -0.63 0.00 0.00 0.00 175.10 174.82 1i59 s ILE 445 N 0.92 3.06 -0.01 2.22 1.01 0.28 -1.17 121.20 127.51 1i59 s ILE 445 Ca -0.02 -0.68 0.04 0.00 0.00 0.00 0.00 60.65 59.99 1i59 s ILE 445 Cb -0.15 -2.25 -0.01 0.00 0.01 0.00 0.00 42.46 40.06 1i59 s ILE 445 CO -0.01 0.55 -0.13 -1.61 0.00 0.00 0.00 174.94 173.73 1i59 s GLU 446 N -0.01 1.08 -0.26 2.79 2.02 -0.33 0.08 118.70 124.08 1i59 s GLU 446 Ca -0.04 -0.49 0.03 0.00 0.02 0.00 0.00 54.97 54.49 1i59 s GLU 446 Cb -0.14 -1.05 0.06 0.00 0.10 0.00 0.00 34.13 33.10 1i59 s GLU 446 CO 0.04 0.29 -0.10 0.08 0.02 0.00 0.00 175.26 175.59 1i59 s VAL 447 N -0.34 2.13 -0.01 2.63 1.01 -0.23 -1.66 120.40 123.94 1i59 s VAL 447 Ca 0.05 -1.64 0.06 0.00 0.00 0.00 0.00 61.98 60.45 1i59 s VAL 447 Cb -0.05 -2.27 -0.02 0.00 0.00 0.00 0.00 36.38 34.05 1i59 s VAL 447 CO -0.00 -0.06 -0.19 -0.70 0.00 0.00 0.00 175.10 174.15 1i59 s GLU 448 N 1.11 1.51 0.12 2.72 2.12 -0.33 -1.18 118.70 124.77 1i59 s GLU 448 Ca -0.08 -0.71 0.04 0.00 0.36 0.00 0.00 54.97 54.58 1i59 s GLU 448 Cb -0.20 -1.48 -0.04 0.00 0.26 0.00 0.00 34.13 32.67 1i59 s GLU 448 CO -0.05 0.40 -0.10 0.16 -0.54 0.00 0.00 175.26 175.13 1i59 s ASP 449 N -0.54 1.63 -0.52 -1.70 1.47 -0.46 0.02 116.67 116.58 1i59 s ASP 449 Ca 0.07 -0.94 0.02 0.00 1.18 0.00 0.00 52.55 52.88 1i59 s ASP 449 Cb -0.07 0.00 0.44 0.00 -0.34 0.00 0.00 42.92 42.95 1i59 s ASP 449 CO -0.00 -0.31 1.63 -0.90 0.68 0.00 0.00 175.17 176.26 1i59 n ASP 450 N 0.09 6.36 -2.82 2.11 3.85 -1.05 -2.13 116.55 122.96 1i59 n ASP 450 Ca -0.13 -3.77 0.00 0.00 -0.71 0.00 0.00 54.79 50.18 1i59 n ASP 450 Cb 0.60 -0.69 0.00 0.00 -1.35 0.00 0.00 41.12 39.67 1i59 n ASP 450 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1i59 n GLY 451 N -0.77 0.24 0.20 6.12 0.00 -1.26 -4.57 105.19 105.16 1i59 n GLY 451 Ca 0.53 -1.58 0.14 0.00 0.00 0.00 0.00 46.02 45.11 1i59 n GLY 451 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1i59 h ARG 452 N 0.00 0.00 0.00 1.61 0.11 -1.46 -2.83 114.38 111.82 1i59 h ARG 452 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1i59 h ARG 452 Cb 0.00 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.08 1i59 h ARG 452 CO 0.00 0.00 0.00 0.41 0.10 0.00 0.00 179.97 180.48 1i59 n GLY 453 N 0.34 -1.78 3.71 0.08 0.00 -1.26 0.77 105.19 107.05 1i59 n GLY 453 Ca 0.02 -1.46 -0.42 0.00 0.00 0.00 0.00 46.02 44.17 1i59 n GLY 453 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1i59 s ILE 454 N -3.33 2.41 -0.74 -0.61 1.01 -1.26 -4.82 121.20 113.86 1i59 s ILE 454 Ca 0.00 0.21 -0.26 0.00 0.00 0.00 0.00 60.65 60.59 1i59 s ILE 454 Cb 0.00 -3.13 0.01 0.00 0.01 0.00 0.00 42.46 39.35 1i59 s ILE 454 CO 0.00 0.01 1.53 -0.62 0.00 0.00 0.00 174.94 175.86 1i59 s ASP 455 N 1.57 5.85 0.33 3.58 3.68 -1.26 -4.77 116.67 125.66 1i59 s ASP 455 Ca 0.74 -0.34 0.14 0.00 2.13 0.00 0.00 52.55 55.22 1i59 s ASP 455 Cb -0.46 -2.55 0.58 0.00 -1.45 0.00 0.00 42.92 39.03 1i59 s ASP 455 CO 0.33 -2.03 1.72 0.11 0.13 0.00 0.00 175.17 175.42 1i59 h LYS 456 N 11.62 0.00 -0.30 4.34 1.57 -2.00 -2.81 116.57 128.99 1i59 h LYS 456 Ca -0.19 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.45 1i59 h LYS 456 Cb 1.08 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.38 1i59 h LYS 456 CO 1.27 0.47 -0.36 1.49 -0.57 0.00 0.00 179.45 181.76 1i59 h GLU 457 N 0.00 0.69 -0.55 3.15 4.57 -1.99 -1.28 114.58 119.16 1i59 h GLU 457 Ca -0.00 -0.33 0.01 0.00 -1.18 0.00 0.00 59.36 57.85 1i59 h GLU 457 Cb 0.89 -0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 29.45 1i59 h GLU 457 CO 0.06 0.94 0.36 -0.22 -1.18 0.00 0.00 179.01 178.97 1i59 h LYS 458 N 0.57 0.70 -0.08 1.92 3.64 -1.92 0.49 116.57 121.89 1i59 h LYS 458 Ca 0.06 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.39 1i59 h LYS 458 Cb 0.88 -0.16 -0.00 0.00 -0.41 0.00 0.00 32.23 32.54 1i59 h LYS 458 CO 0.08 0.46 0.05 0.82 -2.27 0.00 0.00 179.45 178.59 1i59 h ILE 459 N 0.72 1.08 -0.36 2.00 2.04 -1.22 -1.40 117.51 120.38 1i59 h ILE 459 Ca 0.21 -0.22 0.05 0.00 1.00 0.00 0.00 64.86 65.90 1i59 h ILE 459 Cb -0.05 1.08 -0.05 0.00 -0.74 0.00 0.00 36.82 37.06 1i59 h ILE 459 CO -0.06 0.07 0.08 0.40 0.00 0.00 0.00 178.15 178.63 1i59 h ILE 460 N 0.05 0.83 -0.96 -0.67 2.04 -0.76 -0.45 117.51 117.59 1i59 h ILE 460 Ca 0.03 -0.07 0.03 0.00 1.00 0.00 0.00 64.86 65.85 1i59 h ILE 460 Cb 0.07 0.61 -0.05 0.00 -0.74 0.00 0.00 36.82 36.71 1i59 h ILE 460 CO -0.00 0.04 0.63 0.03 0.00 0.00 0.00 178.15 178.84 1i59 h ARG 461 N 0.20 1.19 -0.56 2.37 3.08 -0.73 -0.77 114.38 119.16 1i59 h ARG 461 Ca 0.17 -0.07 -0.08 0.00 0.07 0.00 0.00 59.98 60.07 1i59 h ARG 461 Cb 0.19 -0.27 -0.02 0.00 0.08 0.00 0.00 29.97 29.95 1i59 h ARG 461 CO -0.22 0.79 0.06 0.87 -1.07 0.00 0.00 179.97 180.40 1i59 h LYS 462 N 1.22 0.95 -0.58 0.04 1.57 -0.47 -0.28 116.57 119.03 1i59 h LYS 462 Ca 0.38 -0.27 -0.06 0.00 -1.87 0.00 0.00 60.65 58.82 1i59 h LYS 462 Cb -0.02 -0.10 -0.03 0.00 0.08 0.00 0.00 32.23 32.16 1i59 h LYS 462 CO -0.12 0.93 0.11 0.00 -0.57 0.00 0.00 179.45 179.81 1i59 h ALA 463 N 0.99 1.11 -0.24 3.86 0.00 -0.43 -0.72 119.26 123.83 1i59 h ALA 463 Ca 0.17 -0.23 -0.07 0.00 0.00 0.00 0.00 54.91 54.77 1i59 h ALA 463 Cb 0.46 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1i59 h ALA 463 CO 0.02 0.59 -0.13 0.82 0.00 0.00 0.00 179.25 180.55 1i59 h ILE 464 N 0.88 1.30 -0.03 0.00 2.04 -0.94 -0.68 117.51 120.08 1i59 h ILE 464 Ca 0.18 -1.22 -0.01 0.00 1.00 0.00 0.00 64.86 64.81 1i59 h ILE 464 Cb 0.36 1.59 -0.00 0.00 -0.74 0.00 0.00 36.82 38.02 1i59 h ILE 464 CO 0.00 0.38 -0.03 -0.08 0.00 0.00 0.00 178.15 178.42 1i59 h GLU 465 N 0.23 0.05 -0.08 2.37 4.81 -0.66 -1.21 114.58 120.09 1i59 h GLU 465 Ca 0.05 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.28 1i59 h GLU 465 Cb 0.64 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.01 1i59 h GLU 465 CO 0.04 0.08 0.00 1.63 -0.73 0.00 0.00 179.01 180.03 1i59 n LYS 466 N -4.47 1.67 -1.13 1.92 5.02 -0.31 -4.94 118.16 115.91 1i59 n LYS 466 Ca -0.02 -0.99 -0.05 0.00 -2.02 0.00 0.00 58.31 55.23 1i59 n LYS 466 Cb 0.13 -1.44 -0.02 0.00 -0.02 0.00 0.00 35.03 33.68 1i59 n LYS 466 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1i59 n GLY 467 N 1.15 0.72 0.11 0.72 0.00 -0.46 -4.91 105.19 102.52 1i59 n GLY 467 Ca 0.18 -0.50 -0.03 0.00 0.00 0.00 0.00 46.02 45.67 1i59 n GLY 467 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1i59 h LEU 468 N 0.00 0.00 -7.79 0.99 -0.00 -1.36 -3.46 115.31 103.69 1i59 h LEU 468 Ca -0.10 0.00 -0.08 0.00 -0.00 0.00 0.00 57.88 57.70 1i59 h LEU 468 Cb 0.41 0.00 -0.13 0.00 -0.00 0.00 0.00 40.66 40.93 1i59 h LEU 468 CO 0.14 0.76 -0.30 0.27 -0.00 0.00 0.00 178.44 179.31 1i59 s ILE 469 N -3.18 0.11 0.45 1.22 -4.36 -1.22 -5.03 121.20 109.19 1i59 s ILE 469 Ca 0.00 -1.11 0.07 0.00 -0.26 0.00 0.00 60.65 59.35 1i59 s ILE 469 Cb 0.11 -1.42 0.07 0.00 1.25 0.00 0.00 42.46 42.47 1i59 s ILE 469 CO 0.78 -0.51 0.58 -0.90 0.24 0.00 0.00 174.94 175.13 1i59 n ASP 470 N -0.13 1.77 -0.03 4.36 3.85 -1.26 -4.22 116.55 120.89 1i59 n ASP 470 Ca -0.13 -2.25 -0.13 0.00 -0.71 0.00 0.00 54.79 51.57 1i59 n ASP 470 Cb 0.63 -0.28 -0.08 0.00 -1.35 0.00 0.00 41.12 40.04 1i59 n ASP 470 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 177.20 176.11 1i59 h GLU 471 N 0.00 0.15 -0.70 0.11 4.22 -1.99 -2.19 114.58 114.19 1i59 h GLU 471 Ca -0.22 -0.06 0.13 0.00 0.08 0.00 0.00 59.36 59.29 1i59 h GLU 471 Cb 0.98 -0.01 -0.09 0.00 0.50 0.00 0.00 28.75 30.13 1i59 h GLU 471 CO 0.32 0.51 0.23 1.03 -2.18 0.00 0.00 179.01 178.93 1i59 h SER 472 N -0.21 0.17 -0.48 1.04 0.87 -2.00 -0.50 113.55 112.44 1i59 h SER 472 Ca 0.02 0.11 -0.11 0.00 -1.23 0.00 0.00 61.79 60.58 1i59 h SER 472 Cb 0.46 0.12 -0.02 0.00 -0.44 0.00 0.00 62.40 62.52 1i59 h SER 472 CO 0.01 0.07 -0.12 0.50 -0.53 0.00 0.00 176.83 176.76 1i59 h LYS 473 N 0.37 0.96 -0.48 2.24 1.63 -1.96 -2.90 116.57 116.43 1i59 h LYS 473 Ca 0.38 -0.35 0.05 0.00 -0.85 0.00 0.00 60.65 59.88 1i59 h LYS 473 Cb 0.57 -0.06 -0.03 0.00 -0.60 0.00 0.00 32.23 32.11 1i59 h LYS 473 CO -0.41 1.02 0.32 0.00 -3.45 0.00 0.00 179.45 176.93 1i59 h ALA 474 N 1.00 1.86 0.00 5.00 0.00 -0.45 -1.29 119.26 125.39 1i59 h ALA 474 Ca 0.13 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 1i59 h ALA 474 Cb 0.66 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.33 1i59 h ALA 474 CO 0.05 0.06 -0.02 0.00 0.00 0.00 0.00 179.25 179.34 1i59 h ALA 475 N 1.73 1.01 -0.01 0.00 0.00 -1.15 -2.98 119.26 117.86 1i59 h ALA 475 Ca 0.20 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1i59 h ALA 475 Cb 0.22 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1i59 h ALA 475 CO -0.05 0.02 -0.54 0.25 0.00 0.00 0.00 179.25 178.93 1i59 n THR 476 N -3.12 0.00 -2.12 0.00 -2.24 -0.50 -4.98 114.28 101.31 1i59 n THR 476 Ca -0.00 -0.18 -0.38 0.00 -2.27 0.00 0.00 64.05 61.22 1i59 n THR 476 Cb 0.28 1.03 -0.00 0.00 -2.10 0.00 0.00 70.33 69.53 1i59 n THR 476 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1i59 s LEU 477 N -2.60 4.10 0.52 3.22 1.43 -1.13 -5.03 118.68 119.18 1i59 s LEU 477 Ca 0.17 2.51 -0.04 0.00 -1.03 0.00 0.00 54.13 55.74 1i59 s LEU 477 Cb 0.18 -4.07 -0.01 0.00 0.03 0.00 0.00 46.19 42.32 1i59 s LEU 477 CO 0.63 -0.93 0.79 -0.94 0.23 0.00 0.00 176.35 176.13 1i59 s SER 478 N -1.02 5.84 0.21 2.29 1.04 -1.26 -4.90 113.70 115.89 1i59 s SER 478 Ca 0.61 0.63 -0.09 0.00 0.48 0.00 0.00 55.95 57.57 1i59 s SER 478 Cb -0.34 -1.79 0.24 0.00 0.10 0.00 0.00 66.02 64.22 1i59 s SER 478 CO 0.43 -0.82 1.80 0.44 0.98 0.00 0.00 173.24 176.07 1i59 h ASP 479 N 0.12 0.53 -0.74 7.02 3.45 -1.99 -0.71 116.42 124.09 1i59 h ASP 479 Ca -0.46 0.03 -0.01 0.00 0.43 0.00 0.00 57.03 57.02 1i59 h ASP 479 Cb 1.24 -0.07 -0.04 0.00 -0.56 0.00 0.00 39.33 39.90 1i59 h ASP 479 CO 0.60 0.34 0.41 1.56 -1.57 0.00 0.00 179.24 180.58 1i59 h GLN 480 N 0.67 1.05 -0.71 3.56 4.20 -1.94 0.04 115.11 121.98 1i59 h GLN 480 Ca 0.30 -0.12 -0.06 0.00 0.06 0.00 0.00 58.65 58.83 1i59 h GLN 480 Cb 0.19 -0.21 -0.03 0.00 0.30 0.00 0.00 27.48 27.73 1i59 h GLN 480 CO -0.18 0.77 0.20 1.49 -0.67 0.00 0.00 178.83 180.43 1i59 h GLU 481 N 1.05 1.11 0.09 1.46 4.81 -1.69 -1.69 114.58 119.74 1i59 h GLU 481 Ca 0.27 -0.25 -0.00 0.00 -0.13 0.00 0.00 59.36 59.24 1i59 h GLU 481 Cb 0.03 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 29.25 1i59 h GLU 481 CO -0.04 0.97 -0.04 0.82 -0.73 0.00 0.00 179.01 179.98 1i59 h ILE 482 N 1.05 1.10 -0.12 2.32 2.04 -0.42 -3.17 117.51 120.31 1i59 h ILE 482 Ca 0.23 -0.73 0.01 0.00 1.00 0.00 0.00 64.86 65.36 1i59 h ILE 482 Cb 0.34 1.56 -0.01 0.00 -0.74 0.00 0.00 36.82 37.97 1i59 h ILE 482 CO -0.00 0.18 0.08 -0.07 0.00 0.00 0.00 178.15 178.33 1i59 h LEU 483 N -0.46 0.11 0.00 1.44 3.38 -0.92 -2.25 115.31 116.60 1i59 h LEU 483 Ca -0.01 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1i59 h LEU 483 Cb 0.39 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.11 1i59 h LEU 483 CO 0.02 0.08 0.00 0.59 0.09 0.00 0.00 178.44 179.22 1i59 n ASN 484 N -4.52 0.00 0.26 -0.43 3.02 -0.64 -1.56 115.26 111.38 1i59 n ASN 484 Ca -0.01 0.45 0.14 0.00 -0.03 0.00 0.00 54.58 55.14 1i59 n ASN 484 Cb 0.10 -0.47 0.68 0.00 -0.61 0.00 0.00 39.78 39.48 1i59 n ASN 484 CO 0.00 0.00 0.00 -0.26 -2.62 0.00 0.00 177.26 174.38 1i59 h PHE 485 N 0.00 0.00 0.00 3.10 -1.00 -1.52 -1.72 116.94 115.79 1i59 h PHE 485 Ca 0.00 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 1i59 h PHE 485 Cb 0.17 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.73 1i59 h PHE 485 CO 0.00 0.10 0.00 1.28 -1.61 0.00 0.00 178.31 178.08 1i59 n LEU 486 N -3.34 0.59 0.00 1.54 4.32 -0.60 -1.76 117.00 117.75 1i59 n LEU 486 Ca -0.01 0.69 0.10 0.00 -0.02 0.00 0.00 56.01 56.78 1i59 n LEU 486 Cb 0.30 -0.67 -0.06 0.00 -1.62 0.00 0.00 43.42 41.38 1i59 n LEU 486 CO 0.29 -0.70 0.02 0.49 -1.22 0.00 0.00 177.39 176.27 1i59 n PHE 487 N -2.20 0.01 -2.12 -1.77 0.99 -0.65 -4.50 117.46 107.21 1i59 n PHE 487 Ca 0.01 0.00 -0.43 0.00 -0.00 0.00 0.00 57.45 57.03 1i59 n PHE 487 Cb 0.14 -0.06 -0.03 0.00 -1.00 0.00 0.00 39.48 38.53 1i59 n PHE 487 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.76 176.84 1i59 s VAL 488 N -3.02 3.74 0.19 -4.37 1.01 -0.72 -4.85 120.40 112.38 1i59 s VAL 488 Ca 0.08 0.87 -0.33 0.00 0.00 0.00 0.00 61.98 62.60 1i59 s VAL 488 Cb 0.16 -3.65 -0.13 0.00 0.00 0.00 0.00 36.38 32.76 1i59 s VAL 488 CO 0.84 -0.18 1.56 -0.81 0.00 0.00 0.00 175.10 176.52 1i59 n PRO 489 N 7.30 2.25 0.00 2.72 -0.04 -1.26 -1.23 135.00 144.74 1i59 n PRO 489 Ca 0.17 0.81 0.00 0.00 -0.04 0.00 0.00 63.50 64.44 1i59 n PRO 489 Cb 0.44 -2.57 0.00 0.00 -0.04 0.00 0.00 33.50 31.33 1i59 n PRO 489 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1i59 n GLY 490 N 3.14 2.03 0.10 0.55 0.00 -1.26 -4.92 105.19 104.83 1i59 n GLY 490 Ca 0.15 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.04 1i59 n GLY 490 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1i59 h PHE 491 N 0.00 -0.15 -3.51 1.61 3.57 -1.47 -3.43 116.94 113.57 1i59 h PHE 491 Ca 0.00 -0.00 -0.53 0.00 3.53 0.00 0.00 57.97 60.97 1i59 h PHE 491 Cb 0.00 0.05 -0.03 0.00 2.79 0.00 0.00 35.95 38.76 1i59 h PHE 491 CO 0.00 -0.09 0.07 -1.12 -2.23 0.00 0.00 178.31 174.94 1i59 s SER 492 N -5.06 7.03 0.51 0.41 0.01 -1.26 -5.06 113.70 110.27 1i59 s SER 492 Ca -0.14 1.36 -0.20 0.00 1.31 0.00 0.00 55.95 58.28 1i59 s SER 492 Cb 0.06 -2.40 -0.07 0.00 0.21 0.00 0.00 66.02 63.82 1i59 s SER 492 CO 0.65 0.06 1.09 -0.89 0.41 0.00 0.00 173.24 174.56 1i59 s THR 493 N -1.48 3.46 0.02 1.44 2.01 -1.26 -5.06 115.64 114.77 1i59 s THR 493 Ca 0.41 0.93 -0.02 0.00 0.31 0.00 0.00 61.69 63.33 1i59 s THR 493 Cb -0.17 -3.39 -0.01 0.00 0.01 0.00 0.00 72.50 68.94 1i59 s THR 493 CO 0.21 -0.18 0.02 2.29 -0.69 0.00 0.00 174.62 176.27 1i59 n LYS 494 N -1.04 0.00 0.00 4.92 0.00 -1.26 -5.03 118.16 115.74 1i59 n LYS 494 Ca 0.10 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.41 1i59 n LYS 494 Cb 0.51 -0.07 0.00 0.00 -0.00 0.00 0.00 35.03 35.47 1i59 n LYS 494 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.40 180.29 1i59 n ARG 503 N 0.08 0.00 -0.01 -1.58 -4.01 -1.26 -5.05 116.66 104.84 1i59 n ARG 503 Ca 0.01 0.00 0.00 0.00 -1.04 0.00 0.00 57.85 56.82 1i59 n ARG 503 Cb 0.02 -3.70 0.00 0.00 -3.04 0.00 0.00 32.46 25.75 1i59 n ARG 503 CO 0.00 0.00 0.00 0.41 -3.04 0.00 0.00 177.63 175.00 1i59 n GLY 504 N -1.41 -0.98 0.00 2.89 0.00 -1.26 -5.01 105.19 99.42 1i59 n GLY 504 Ca 0.00 -1.16 0.00 0.00 0.00 0.00 0.00 46.02 44.86 1i59 n GLY 504 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1i59 n VAL 505 N 1.14 0.00 0.00 1.61 0.24 -1.26 -4.84 118.33 115.21 1i59 n VAL 505 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 1i59 n VAL 505 Cb 0.00 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.37 1i59 n VAL 505 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1i59 n GLY 506 N 0.00 -0.31 0.29 7.63 0.00 -1.26 -4.45 105.19 107.09 1i59 n GLY 506 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.03 1i59 n GLY 506 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 1i59 h MET 507 N 0.00 0.60 -0.22 1.61 2.07 -1.96 -0.38 114.93 116.65 1i59 h MET 507 Ca 0.00 -0.08 -0.03 0.00 -2.07 0.00 0.00 59.70 57.52 1i59 h MET 507 Cb 0.00 -0.11 -0.01 0.00 -1.87 0.00 0.00 31.60 29.61 1i59 h MET 507 CO 0.00 0.51 0.04 -0.44 1.07 0.00 0.00 176.91 178.09 1i59 h ASP 508 N 0.60 0.35 -0.18 1.22 3.45 -1.87 -1.11 116.42 118.88 1i59 h ASP 508 Ca 0.14 -0.26 -0.12 0.00 0.43 0.00 0.00 57.03 57.23 1i59 h ASP 508 Cb 0.15 -0.09 -0.01 0.00 -0.56 0.00 0.00 39.33 38.81 1i59 h ASP 508 CO -0.01 0.52 -0.28 0.58 -1.57 0.00 0.00 179.24 178.48 1i59 h VAL 509 N 0.17 1.28 -0.32 -1.35 2.07 -1.70 -1.96 116.25 114.43 1i59 h VAL 509 Ca 0.07 -1.39 -0.04 0.00 0.82 0.00 0.00 66.70 66.16 1i59 h VAL 509 Cb 0.32 1.33 -0.01 0.00 -1.52 0.00 0.00 31.29 31.41 1i59 h VAL 509 CO 0.00 0.45 0.05 0.58 0.02 0.00 0.00 177.57 178.67 1i59 h VAL 510 N 0.57 1.24 -0.53 2.57 2.07 -0.94 -1.69 116.25 119.54 1i59 h VAL 510 Ca 0.07 -0.82 -0.12 0.00 0.82 0.00 0.00 66.70 66.65 1i59 h VAL 510 Cb 0.77 1.16 -0.02 0.00 -1.52 0.00 0.00 31.29 31.68 1i59 h VAL 510 CO 0.06 0.27 -0.14 0.50 0.02 0.00 0.00 177.57 178.29 1i59 h LYS 511 N 0.35 1.03 -0.43 1.57 3.64 -1.14 -1.71 116.57 119.88 1i59 h LYS 511 Ca 0.10 -0.40 -0.10 0.00 -1.27 0.00 0.00 60.65 58.98 1i59 h LYS 511 Cb 0.35 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.10 1i59 h LYS 511 CO 0.01 1.09 -0.12 -0.91 -2.27 0.00 0.00 179.45 177.25 1i59 h ASN 512 N 0.90 0.85 -0.32 4.20 -0.26 -1.30 0.88 115.58 120.54 1i59 h ASN 512 Ca 0.13 -0.37 -0.06 0.00 -0.56 0.00 0.00 56.30 55.44 1i59 h ASN 512 Cb 0.71 -0.23 -0.01 0.00 -1.06 0.00 0.00 38.32 37.73 1i59 h ASN 512 CO 0.05 1.02 -0.05 0.58 -1.06 0.00 0.00 177.43 177.98 1i59 h VAL 513 N 0.66 1.27 -0.59 2.81 2.07 -1.30 -1.66 116.25 119.51 1i59 h VAL 513 Ca 0.11 -1.06 -0.01 0.00 0.82 0.00 0.00 66.70 66.55 1i59 h VAL 513 Cb 0.66 1.32 -0.03 0.00 -1.52 0.00 0.00 31.29 31.72 1i59 h VAL 513 CO 0.05 0.34 0.32 0.58 0.02 0.00 0.00 177.57 178.88 1i59 h VAL 514 N 0.37 1.19 0.00 2.57 2.07 -1.20 -2.28 116.25 118.98 1i59 h VAL 514 Ca 0.08 -0.49 -0.02 0.00 0.82 0.00 0.00 66.70 67.09 1i59 h VAL 514 Cb 0.52 0.44 -0.00 0.00 -1.52 0.00 0.00 31.29 30.73 1i59 h VAL 514 CO 0.03 0.21 -0.11 -0.33 0.02 0.00 0.00 177.57 177.39 1i59 h GLU 515 N 0.80 0.00 0.00 1.57 5.08 -0.73 0.23 114.58 121.53 1i59 h GLU 515 Ca 0.21 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.57 1i59 h GLU 515 Cb 0.05 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.30 1i59 h GLU 515 CO -0.03 0.11 0.00 0.66 -1.00 0.00 0.00 179.01 178.74 1i59 h SER 516 N 0.00 0.00 -0.69 1.42 4.64 -0.70 -0.69 113.55 117.52 1i59 h SER 516 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1i59 h SER 516 Cb 0.68 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.77 1i59 h SER 516 CO 0.01 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 176.15 1i59 n LEU 517 N -2.51 4.35 -2.51 5.97 4.77 -0.72 -4.91 117.00 121.45 1i59 n LEU 517 Ca 0.02 -2.21 -0.20 0.00 -0.03 0.00 0.00 56.01 53.58 1i59 n LEU 517 Cb 0.29 -0.53 0.01 0.00 -2.33 0.00 0.00 43.42 40.86 1i59 n LEU 517 CO 0.24 0.91 -0.15 0.59 -1.33 0.00 0.00 177.39 177.65 1i59 n ASN 518 N 1.40 -5.76 -4.19 -1.43 3.02 -0.27 -4.60 115.26 103.44 1i59 n ASN 518 Ca 0.25 -0.13 -0.14 0.00 -0.03 0.00 0.00 54.58 54.53 1i59 n ASN 518 Cb 0.75 -4.70 0.05 0.00 -0.61 0.00 0.00 39.78 35.27 1i59 n ASN 518 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1i59 n GLY 519 N -1.22 1.95 3.03 7.41 0.00 -0.01 -4.45 105.19 111.90 1i59 n GLY 519 Ca -0.18 -2.20 -0.09 0.00 0.00 0.00 0.00 46.02 43.55 1i59 n GLY 519 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1i59 s SER 520 N -3.68 0.30 -0.00 1.61 0.15 -0.34 -4.23 113.70 107.51 1i59 s SER 520 Ca 0.45 -0.64 0.01 0.00 0.70 0.00 0.00 55.95 56.48 1i59 s SER 520 Cb -0.04 0.14 -0.00 0.00 -1.71 0.00 0.00 66.02 64.41 1i59 s SER 520 CO 0.29 -0.41 -0.04 -0.51 1.20 0.00 0.00 173.24 173.78 1i59 s ILE 521 N -2.26 0.29 0.09 6.45 2.07 -1.26 -0.33 121.20 126.24 1i59 s ILE 521 Ca -0.08 -0.16 0.03 0.00 -1.41 0.00 0.00 60.65 59.02 1i59 s ILE 521 Cb -0.04 -0.25 -0.04 0.00 0.13 0.00 0.00 42.46 42.27 1i59 s ILE 521 CO -0.04 0.08 -0.08 -0.94 -1.91 0.00 0.00 174.94 172.05 1i59 s SER 522 N -0.09 1.19 0.05 4.50 1.04 -0.31 -4.99 113.70 115.10 1i59 s SER 522 Ca 0.01 -0.84 0.07 0.00 0.48 0.00 0.00 55.95 55.68 1i59 s SER 522 Cb -0.01 0.05 -0.03 0.00 0.10 0.00 0.00 66.02 66.13 1i59 s SER 522 CO -0.00 -0.34 -0.20 -0.63 0.98 0.00 0.00 173.24 173.05 1i59 s ILE 523 N -2.73 1.64 -0.05 -1.02 1.01 -1.26 -1.07 121.20 117.72 1i59 s ILE 523 Ca 0.05 -1.24 -0.03 0.00 0.00 0.00 0.00 60.65 59.42 1i59 s ILE 523 Cb -0.01 -1.44 0.02 0.00 0.01 0.00 0.00 42.46 41.04 1i59 s ILE 523 CO -0.02 0.15 0.12 -0.70 0.00 0.00 0.00 174.94 174.49 1i59 s GLU 524 N -1.29 0.11 -0.06 2.79 2.12 -0.41 -5.00 118.70 116.96 1i59 s GLU 524 Ca 0.07 0.23 -0.29 0.00 0.36 0.00 0.00 54.97 55.34 1i59 s GLU 524 Cb -0.09 -0.04 0.07 0.00 0.26 0.00 0.00 34.13 34.33 1i59 s GLU 524 CO 0.02 -0.08 0.66 0.45 -0.54 0.00 0.00 175.26 175.77 1i59 s SER 525 N 0.51 -0.63 -0.03 -1.70 0.15 -1.26 -0.20 113.70 110.53 1i59 s SER 525 Ca -0.04 0.72 -0.00 0.00 0.70 0.00 0.00 55.95 57.34 1i59 s SER 525 Cb -0.05 0.59 0.03 0.00 -1.71 0.00 0.00 66.02 64.87 1i59 s SER 525 CO -0.02 -0.57 0.01 -1.61 1.20 0.00 0.00 173.24 172.24 1i59 s GLU 526 N -1.09 0.29 -0.03 5.44 0.41 -0.65 -4.93 118.70 118.13 1i59 s GLU 526 Ca -0.10 0.11 -0.39 0.00 -0.41 0.00 0.00 54.97 54.18 1i59 s GLU 526 Cb -0.01 -0.53 -0.18 0.00 -1.78 0.00 0.00 34.13 31.63 1i59 s GLU 526 CO 0.09 -0.17 1.35 1.17 -0.49 0.00 0.00 175.26 177.21 1i59 n LYS 527 N 4.36 0.77 -0.53 1.61 4.81 -1.26 -0.36 118.16 127.57 1i59 n LYS 527 Ca -0.22 0.28 0.00 0.00 -0.87 0.00 0.00 58.31 57.50 1i59 n LYS 527 Cb 0.50 -1.88 0.00 0.00 0.02 0.00 0.00 35.03 33.67 1i59 n LYS 527 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1i59 n ASP 528 N 2.81 0.00 -0.11 3.14 8.00 0.23 -4.70 116.55 125.92 1i59 n ASP 528 Ca 0.21 0.00 -0.14 0.00 0.71 0.00 0.00 54.79 55.57 1i59 n ASP 528 Cb 0.13 -2.14 -0.13 0.00 -0.02 0.00 0.00 41.12 38.97 1i59 n ASP 528 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1i59 n LYS 529 N -2.00 0.71 0.00 -1.24 4.01 0.51 -4.68 118.16 115.47 1i59 n LYS 529 Ca 0.00 0.08 0.00 0.00 -0.51 0.00 0.00 58.31 57.88 1i59 n LYS 529 Cb 0.00 -1.50 0.00 0.00 -0.51 0.00 0.00 35.03 33.02 1i59 n LYS 529 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1i59 n GLY 530 N 2.09 0.94 2.96 0.72 0.00 -0.77 -4.08 105.19 107.06 1i59 n GLY 530 Ca -0.39 -1.99 -0.14 0.00 0.00 0.00 0.00 46.02 43.50 1i59 n GLY 530 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1i59 s THR 531 N -1.37 0.32 -0.11 2.61 2.01 -0.90 -1.64 115.64 116.56 1i59 s THR 531 Ca 0.00 -0.34 -0.01 0.00 0.31 0.00 0.00 61.69 61.66 1i59 s THR 531 Cb 0.00 -0.31 0.03 0.00 0.01 0.00 0.00 72.50 72.23 1i59 s THR 531 CO 0.00 -0.02 -0.05 -0.75 -0.69 0.00 0.00 174.62 173.12 1i59 s LYS 532 N -0.38 1.23 -0.16 4.92 2.20 0.71 -1.35 119.74 126.91 1i59 s LYS 532 Ca -0.01 -0.19 -0.06 0.00 -0.36 0.00 0.00 55.97 55.34 1i59 s LYS 532 Cb -0.03 -1.49 -0.04 0.00 -1.51 0.00 0.00 37.83 34.76 1i59 s LYS 532 CO -0.00 -0.31 0.05 0.08 -0.36 0.00 0.00 175.35 174.81 1i59 s VAL 533 N 1.78 4.73 -0.10 4.02 1.01 -0.33 -1.29 120.40 130.22 1i59 s VAL 533 Ca 0.04 -0.06 0.04 0.00 0.00 0.00 0.00 61.98 62.00 1i59 s VAL 533 Cb -0.13 -3.10 -0.01 0.00 0.00 0.00 0.00 36.38 33.14 1i59 s VAL 533 CO -0.07 0.50 -0.22 -0.89 0.00 0.00 0.00 175.10 174.41 1i59 s THR 534 N 0.08 2.27 -0.12 3.92 2.01 -0.23 -1.07 115.64 122.51 1i59 s THR 534 Ca 0.05 -0.95 0.03 0.00 0.31 0.00 0.00 61.69 61.13 1i59 s THR 534 Cb -0.12 -1.88 0.00 0.00 0.01 0.00 0.00 72.50 70.51 1i59 s THR 534 CO 0.01 0.56 -0.23 -0.63 -0.69 0.00 0.00 174.62 173.64 1i59 s ILE 535 N 0.21 2.11 -0.21 1.82 1.01 0.11 -1.16 121.20 125.10 1i59 s ILE 535 Ca -0.14 -0.99 -0.03 0.00 0.00 0.00 0.00 60.65 59.49 1i59 s ILE 535 Cb -0.17 -1.82 -0.01 0.00 0.01 0.00 0.00 42.46 40.48 1i59 s ILE 535 CO 0.07 0.55 -0.05 -0.13 0.00 0.00 0.00 174.94 175.38 1i59 s ARG 536 N 0.52 3.39 0.02 2.79 0.52 0.55 -0.56 118.95 126.18 1i59 s ARG 536 Ca -0.14 -0.62 0.05 0.00 -0.52 0.00 0.00 55.73 54.49 1i59 s ARG 536 Cb -0.17 -2.97 -0.03 0.00 0.52 0.00 0.00 34.95 32.30 1i59 s ARG 536 CO 0.05 -0.14 -0.13 -0.51 0.02 0.00 0.00 175.30 174.60 1i59 s LEU 537 N 1.32 2.88 0.60 2.53 1.43 0.15 -1.19 118.68 126.39 1i59 s LEU 537 Ca 0.04 -0.29 -0.15 0.00 -1.03 0.00 0.00 54.13 52.70 1i59 s LEU 537 Cb -0.14 -1.67 -0.04 0.00 0.03 0.00 0.00 46.19 44.37 1i59 s LEU 537 CO -0.02 0.27 1.04 -2.16 0.23 0.00 0.00 176.35 175.71 1i59 s PRO 538 N -1.42 3.38 0.30 1.29 0.04 -1.26 -0.93 135.00 136.40 1i59 s PRO 538 Ca 0.16 1.09 -0.23 0.00 0.04 0.00 0.00 61.00 62.06 1i59 s PRO 538 Cb -0.11 -2.05 -0.09 0.00 0.04 0.00 0.00 34.50 32.29 1i59 s PRO 538 CO 0.06 -0.75 0.87 -1.17 0.04 0.00 0.00 177.00 176.05 1i59 s LEU 539 N -4.64 4.29 0.00 -3.56 1.98 -0.90 -4.76 118.68 111.08 1i59 s LEU 539 Ca 0.61 1.67 0.09 0.00 -2.89 0.00 0.00 54.13 53.61 1i59 s LEU 539 Cb -0.14 -3.94 0.07 0.00 0.66 0.00 0.00 46.19 42.84 1i59 s LEU 539 CO 0.40 -0.07 0.78 0.35 -1.89 0.00 0.00 176.35 175.92