#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i59 s HIS 354 N 0.00 2.82 0.18 1.43 4.02 -1.26 -5.08 115.29 117.41 1i59 s HIS 354 Ca 0.00 -2.50 -0.22 0.00 1.02 0.00 0.00 55.06 53.36 1i59 s HIS 354 Cb 0.00 -2.39 -0.08 0.00 -1.02 0.00 0.00 32.58 29.09 1i59 s HIS 354 CO 0.00 -0.90 0.72 -1.64 1.02 0.00 0.00 174.74 173.95 1i59 s MET 355 N 1.05 4.36 0.02 1.40 1.00 -1.26 -0.18 119.30 125.69 1i59 s MET 355 Ca 0.11 0.96 -0.03 0.00 0.00 0.00 0.00 55.69 56.74 1i59 s MET 355 Cb -0.19 -3.07 -0.01 0.00 0.00 0.00 0.00 34.83 31.56 1i59 s MET 355 CO -0.13 0.49 0.03 0.14 0.00 0.00 0.00 175.02 175.55 1i59 s VAL 356 N -1.33 0.11 0.54 -6.03 -7.23 -0.83 -4.88 120.40 100.74 1i59 s VAL 356 Ca 0.38 -0.90 -0.22 0.00 -1.81 0.00 0.00 61.98 59.44 1i59 s VAL 356 Cb -0.19 -0.42 -0.05 0.00 0.56 0.00 0.00 36.38 36.27 1i59 s VAL 356 CO 0.23 -0.49 1.30 -2.16 -0.31 0.00 0.00 175.10 173.66 1i59 s PRO 357 N -1.65 3.24 0.00 4.82 0.04 -1.26 -1.79 135.00 138.39 1i59 s PRO 357 Ca -0.14 2.10 0.16 0.00 0.04 0.00 0.00 61.00 63.16 1i59 s PRO 357 Cb -0.08 -2.25 0.78 0.00 0.04 0.00 0.00 34.50 33.00 1i59 s PRO 357 CO -0.01 -1.07 1.47 1.51 0.04 0.00 0.00 177.00 178.94 1i59 n ILE 358 N -0.99 0.62 0.29 0.56 3.06 0.78 -2.71 119.36 120.97 1i59 n ILE 358 Ca 0.10 0.15 0.18 0.00 -2.50 0.00 0.00 62.75 60.69 1i59 n ILE 358 Cb 0.46 -0.89 1.00 0.00 0.54 0.00 0.00 39.64 40.75 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 0.33 9.51 4.64 -1.53 0.49 113.55 127.00 1i59 h SER 359 Ca 0.00 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.29 1i59 h SER 359 Cb 0.18 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.26 1i59 h SER 359 CO 0.00 0.00 -0.15 -0.26 -0.87 0.00 0.00 176.83 175.55 1i59 h PHE 360 N 0.00 0.00 0.07 4.77 0.04 -1.82 0.50 116.94 120.50 1i59 h PHE 360 Ca 0.02 0.00 -0.36 0.00 2.80 0.00 0.00 57.97 60.43 1i59 h PHE 360 Cb 0.19 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 38.30 1i59 h PHE 360 CO 0.00 0.15 -2.09 0.28 -0.60 0.00 0.00 178.31 176.05 1i59 n VAL 361 N -3.81 1.66 0.09 -0.55 0.31 0.15 -4.57 118.33 111.62 1i59 n VAL 361 Ca -0.02 -0.55 -0.07 0.00 -0.01 0.00 0.00 64.34 63.69 1i59 n VAL 361 Cb 0.25 -1.69 0.01 0.00 -0.91 0.00 0.00 33.84 31.51 1i59 n VAL 361 CO 0.00 0.00 0.00 -0.26 -1.32 0.00 0.00 176.83 175.25 1i59 h PHE 362 N -0.12 0.22 -0.96 3.52 -1.00 -0.88 -3.38 116.94 114.33 1i59 h PHE 362 Ca -0.48 -0.12 0.30 0.00 2.81 0.00 0.00 57.97 60.48 1i59 h PHE 362 Cb 1.90 -0.03 -0.15 0.00 3.61 0.00 0.00 35.95 41.28 1i59 h PHE 362 CO 0.06 0.91 0.42 -0.97 -1.61 0.00 0.00 178.31 177.12 1i59 h ASN 363 N 0.08 0.27 1.08 2.17 -0.73 -1.14 -1.42 115.58 115.89 1i59 h ASN 363 Ca -0.03 0.20 0.00 0.00 1.87 0.00 0.00 56.30 58.34 1i59 h ASN 363 Cb 1.45 0.21 0.00 0.00 0.27 0.00 0.00 38.32 40.25 1i59 h ASN 363 CO 0.12 -0.18 -0.00 -2.11 -0.37 0.00 0.00 177.43 174.89 1i59 n ARG 364 N -5.15 0.04 -0.09 6.67 1.85 -1.26 -4.22 116.66 114.50 1i59 n ARG 364 Ca 0.28 0.04 -0.13 0.00 -1.00 0.00 0.00 57.85 57.04 1i59 n ARG 364 Cb 0.89 -1.55 -0.04 0.00 -1.05 0.00 0.00 32.46 30.70 1i59 n ARG 364 CO 0.00 0.00 0.00 0.74 -0.01 0.00 0.00 177.63 178.36 1i59 h PHE 365 N 0.00 0.75 -0.71 2.89 0.05 -1.51 -3.05 116.94 115.36 1i59 h PHE 365 Ca 0.00 -0.21 0.16 0.00 3.82 0.00 0.00 57.97 61.73 1i59 h PHE 365 Cb 0.54 -0.16 -0.12 0.00 2.00 0.00 0.00 35.95 38.21 1i59 h PHE 365 CO 0.00 0.92 0.05 -1.35 -0.18 0.00 0.00 178.31 177.75 1i59 h PRO 366 N 0.37 0.14 -0.46 1.51 0.11 -1.75 0.32 132.00 132.25 1i59 h PRO 366 Ca 0.05 -0.01 -0.11 0.00 0.11 0.00 0.00 66.00 66.04 1i59 h PRO 366 Cb 0.77 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 31.84 1i59 h PRO 366 CO 0.06 0.09 -0.16 -0.09 -0.21 0.00 0.00 178.00 177.69 1i59 h ARG 367 N 0.14 0.92 -0.20 1.05 2.43 -1.84 -1.32 114.38 115.55 1i59 h ARG 367 Ca 0.39 -0.38 -0.10 0.00 -0.81 0.00 0.00 59.98 59.09 1i59 h ARG 367 Cb 0.67 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.17 1i59 h ARG 367 CO -0.59 1.03 -0.29 0.52 -1.51 0.00 0.00 179.97 179.13 1i59 h MET 368 N 0.75 0.40 -0.27 0.20 2.86 -1.04 -1.65 114.93 116.19 1i59 h MET 368 Ca 0.11 -0.16 -0.14 0.00 -2.06 0.00 0.00 59.70 57.45 1i59 h MET 368 Cb 0.72 -0.02 -0.00 0.00 0.06 0.00 0.00 31.60 32.36 1i59 h MET 368 CO 0.06 0.66 -0.37 0.28 1.06 0.00 0.00 176.91 178.59 1i59 h VAL 369 N 0.35 1.30 0.03 -2.22 2.07 -0.34 -1.06 116.25 116.38 1i59 h VAL 369 Ca 0.05 -1.56 0.02 0.00 0.82 0.00 0.00 66.70 66.02 1i59 h VAL 369 Cb 0.69 1.66 -0.03 0.00 -1.52 0.00 0.00 31.29 32.10 1i59 h VAL 369 CO 0.05 0.50 -0.16 -0.09 0.02 0.00 0.00 177.57 177.90 1i59 h ARG 370 N 0.46 -0.27 -0.56 1.57 2.43 -0.98 0.26 114.38 117.29 1i59 h ARG 370 Ca 0.03 0.02 -0.06 0.00 -0.81 0.00 0.00 59.98 59.16 1i59 h ARG 370 Cb 0.96 0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 30.55 1i59 h ARG 370 CO 0.09 -0.18 0.11 -0.44 -1.51 0.00 0.00 179.97 178.05 1i59 h ASP 371 N -0.28 0.88 -0.30 -3.80 3.32 -1.31 -1.90 116.42 113.04 1i59 h ASP 371 Ca 0.04 -0.25 -0.01 0.00 0.02 0.00 0.00 57.03 56.83 1i59 h ASP 371 Cb 0.32 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.63 1i59 h ASP 371 CO -0.13 0.90 0.14 -0.07 -1.72 0.00 0.00 179.24 178.37 1i59 h LEU 372 N 0.82 0.39 -0.84 1.55 4.07 -0.97 -0.11 115.31 120.22 1i59 h LEU 372 Ca 0.17 -0.12 -0.01 0.00 0.08 0.00 0.00 57.88 58.00 1i59 h LEU 372 Cb 0.38 -0.10 -0.04 0.00 1.08 0.00 0.00 40.66 41.98 1i59 h LEU 372 CO 0.01 0.40 0.46 0.00 -1.08 0.00 0.00 178.44 178.23 1i59 h ALA 373 N 1.00 1.07 -0.56 1.53 0.00 -0.87 -1.49 119.26 119.95 1i59 h ALA 373 Ca 0.10 -0.12 -0.09 0.00 0.00 0.00 0.00 54.91 54.80 1i59 h ALA 373 Cb 0.12 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 1i59 h ALA 373 CO -0.01 0.58 -0.02 -0.22 0.00 0.00 0.00 179.25 179.57 1i59 h LYS 374 N 1.16 0.97 -0.43 0.00 3.64 -1.06 0.13 116.57 120.99 1i59 h LYS 374 Ca 0.30 -0.30 -0.11 0.00 -1.27 0.00 0.00 60.65 59.27 1i59 h LYS 374 Cb 0.02 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 31.73 1i59 h LYS 374 CO -0.05 0.97 -0.16 -0.22 -2.27 0.00 0.00 179.45 177.72 1i59 h LYS 375 N 0.89 0.81 -0.65 1.90 1.63 -0.54 -2.80 116.57 117.81 1i59 h LYS 375 Ca 0.16 -0.30 0.00 0.00 -0.85 0.00 0.00 60.65 59.66 1i59 h LYS 375 Cb 0.55 -0.05 0.00 0.00 -0.60 0.00 0.00 32.23 32.12 1i59 h LYS 375 CO 0.03 0.92 0.00 -1.33 -3.45 0.00 0.00 179.45 175.62 1i59 n MET 376 N -4.14 3.64 -3.88 1.90 2.81 -0.60 -4.97 117.12 111.89 1i59 n MET 376 Ca 0.01 -2.68 -0.33 0.00 -1.81 0.00 0.00 57.70 52.89 1i59 n MET 376 Cb 0.40 -1.89 0.01 0.00 -0.71 0.00 0.00 33.22 31.03 1i59 n MET 376 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 1i59 n ASN 377 N 1.01 -3.85 -4.31 7.83 2.85 -0.25 -4.98 115.26 113.55 1i59 n ASN 377 Ca 0.24 -1.03 -0.29 0.00 -0.11 0.00 0.00 54.58 53.40 1i59 n ASN 377 Cb 0.86 -1.39 -0.14 0.00 1.24 0.00 0.00 39.78 40.35 1i59 n ASN 377 CO 0.00 0.00 0.00 -0.54 -2.11 0.00 0.00 177.26 174.61 1i59 s LYS 378 N -6.08 1.65 -0.38 1.20 -0.14 0.30 -4.79 119.74 111.50 1i59 s LYS 378 Ca 0.25 -1.06 -0.18 0.00 -1.36 0.00 0.00 55.97 53.61 1i59 s LYS 378 Cb -0.14 -1.82 0.01 0.00 -1.68 0.00 0.00 37.83 34.20 1i59 s LYS 378 CO 0.83 0.47 0.51 -1.21 -0.76 0.00 0.00 175.35 175.18 1i59 s GLU 379 N -1.25 3.42 -0.05 1.68 8.01 -1.26 -4.46 118.70 124.79 1i59 s GLU 379 Ca 0.10 -0.37 0.01 0.00 0.01 0.00 0.00 54.97 54.73 1i59 s GLU 379 Cb -0.10 -3.87 0.02 0.00 -4.31 0.00 0.00 34.13 25.87 1i59 s GLU 379 CO 0.02 -0.76 -0.05 0.08 0.01 0.00 0.00 175.26 174.56 1i59 s VAL 380 N 2.39 0.64 -0.36 2.63 1.01 -1.26 -1.23 120.40 124.22 1i59 s VAL 380 Ca 0.17 -0.17 -0.13 0.00 0.00 0.00 0.00 61.98 61.86 1i59 s VAL 380 Cb -0.16 -0.66 0.00 0.00 0.00 0.00 0.00 36.38 35.56 1i59 s VAL 380 CO 0.14 0.26 0.25 0.21 0.00 0.00 0.00 175.10 175.96 1i59 s ASN 381 N 1.01 5.98 -0.22 3.32 2.47 -0.22 -4.96 114.94 122.31 1i59 s ASN 381 Ca -0.09 -0.65 -0.17 0.00 0.42 0.00 0.00 52.86 52.38 1i59 s ASN 381 Cb -0.14 -2.12 -0.04 0.00 -1.45 0.00 0.00 41.25 37.51 1i59 s ASN 381 CO -0.00 -0.31 0.44 0.12 -3.72 0.00 0.00 177.10 173.62 1i59 s PHE 382 N 1.68 3.34 -0.17 0.43 5.36 -1.26 -1.64 117.98 125.72 1i59 s PHE 382 Ca 0.05 0.62 0.00 0.00 -0.96 0.00 0.00 56.93 56.64 1i59 s PHE 382 Cb -0.18 -2.59 0.01 0.00 -0.34 0.00 0.00 43.02 39.91 1i59 s PHE 382 CO 0.09 -0.10 -0.16 0.42 -1.46 0.00 0.00 175.22 174.01 1i59 s ILE 383 N 1.65 2.45 -0.14 3.12 1.01 0.55 -4.99 121.20 124.86 1i59 s ILE 383 Ca 0.20 -0.83 -0.01 0.00 0.00 0.00 0.00 60.65 60.02 1i59 s ILE 383 Cb -0.15 -2.04 -0.01 0.00 0.01 0.00 0.00 42.46 40.26 1i59 s ILE 383 CO 0.09 0.52 -0.12 -0.04 0.00 0.00 0.00 174.94 175.39 1i59 s MET 384 N 1.08 3.41 0.03 2.79 -1.94 -1.26 -0.13 119.30 123.29 1i59 s MET 384 Ca -0.00 -0.67 0.05 0.00 -1.71 0.00 0.00 55.69 53.36 1i59 s MET 384 Cb -0.14 -2.68 -0.02 0.00 2.01 0.00 0.00 34.83 33.99 1i59 s MET 384 CO -0.05 0.18 -0.16 1.03 -0.01 0.00 0.00 175.02 176.01 1i59 s ARG 385 N 0.44 1.09 -0.60 2.03 0.52 0.03 -4.85 118.95 117.61 1i59 s ARG 385 Ca -0.09 -0.77 -0.02 0.00 -0.52 0.00 0.00 55.73 54.32 1i59 s ARG 385 Cb -0.16 -1.12 0.00 0.00 0.52 0.00 0.00 34.95 34.20 1i59 s ARG 385 CO 0.05 0.28 0.30 0.41 0.02 0.00 0.00 175.30 176.36 1i59 n GLY 386 N 2.00 0.24 0.31 -3.53 0.00 -1.26 -1.52 105.19 101.43 1i59 n GLY 386 Ca -0.17 -0.39 0.20 0.00 0.00 0.00 0.00 46.02 45.66 1i59 n GLY 386 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1i59 h GLU 387 N -0.68 0.00 0.00 1.61 9.09 -1.88 -1.76 114.58 120.95 1i59 h GLU 387 Ca -0.21 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.20 1i59 h GLU 387 Cb 1.15 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.25 1i59 h GLU 387 CO 0.22 0.01 0.00 -0.25 0.05 0.00 0.00 179.01 179.04 1i59 n ASP 388 N -3.13 0.39 -4.68 3.06 10.43 -1.26 -1.48 116.55 119.88 1i59 n ASP 388 Ca -0.02 0.54 -0.45 0.00 2.57 0.00 0.00 54.79 57.44 1i59 n ASP 388 Cb 0.17 -0.64 -0.04 0.00 1.84 0.00 0.00 41.12 42.45 1i59 n ASP 388 CO 0.00 0.00 0.00 0.41 -1.07 0.00 0.00 177.20 176.54 1i59 n THR 389 N -1.86 0.29 -3.42 -3.53 -1.04 -0.66 -4.55 114.28 99.51 1i59 n THR 389 Ca 0.06 -0.05 -0.29 0.00 -2.04 0.00 0.00 64.05 61.73 1i59 n THR 389 Cb 0.38 -1.90 -0.03 0.00 -1.82 0.00 0.00 70.33 66.96 1i59 n THR 389 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 1i59 s GLU 390 N 2.42 3.62 0.18 -2.82 2.02 -1.26 -0.16 118.70 122.71 1i59 s GLU 390 Ca 0.83 -0.04 -0.13 0.00 0.02 0.00 0.00 54.97 55.65 1i59 s GLU 390 Cb -0.58 -2.69 0.01 0.00 0.10 0.00 0.00 34.13 30.97 1i59 s GLU 390 CO 0.40 0.26 0.39 -0.48 0.02 0.00 0.00 175.26 175.86 1i59 s LEU 391 N -3.43 0.57 0.24 1.80 2.34 -0.74 -4.90 118.68 114.56 1i59 s LEU 391 Ca 0.43 -0.73 -0.31 0.00 0.06 0.00 0.00 54.13 53.58 1i59 s LEU 391 Cb -0.11 1.61 -0.13 0.00 -0.56 0.00 0.00 46.19 47.00 1i59 s LEU 391 CO 0.29 -0.98 1.52 -0.67 -1.06 0.00 0.00 176.35 175.46 1i59 n ASP 392 N -0.28 3.28 0.32 1.48 2.03 -1.26 -1.97 116.55 120.15 1i59 n ASP 392 Ca -0.08 1.13 0.20 0.00 0.52 0.00 0.00 54.79 56.56 1i59 n ASP 392 Cb 0.63 -1.50 1.08 0.00 -0.72 0.00 0.00 41.12 40.61 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 4.90 0.00 -0.01 -0.67 0.11 -0.90 -0.42 114.38 117.39 1i59 h ARG 393 Ca -0.45 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.63 1i59 h ARG 393 Cb 1.25 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.33 1i59 h ARG 393 CO 0.81 0.01 0.00 0.25 0.10 0.00 0.00 179.97 181.14 1i59 n THR 394 N -3.23 0.02 -0.02 0.08 -2.24 -1.26 -3.06 114.28 104.56 1i59 n THR 394 Ca -0.02 -0.04 0.05 0.00 -2.27 0.00 0.00 64.05 61.76 1i59 n THR 394 Cb 0.11 -0.27 -0.15 0.00 -2.10 0.00 0.00 70.33 67.92 1i59 n THR 394 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 1i59 n PHE 395 N -0.73 0.12 0.03 4.78 0.99 -0.17 -4.64 117.46 117.85 1i59 n PHE 395 Ca 0.18 0.04 -0.13 0.00 -0.00 0.00 0.00 57.45 57.54 1i59 n PHE 395 Cb 0.12 -0.69 -0.07 0.00 -1.00 0.00 0.00 39.48 37.84 1i59 n PHE 395 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.76 177.04 1i59 h VAL 396 N 0.00 0.13 -0.43 -4.37 2.07 -1.61 -1.58 116.25 110.47 1i59 h VAL 396 Ca -0.15 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.34 1i59 h VAL 396 Cb 1.35 0.13 -0.02 0.00 -1.52 0.00 0.00 31.29 31.24 1i59 h VAL 396 CO 0.01 0.00 0.14 -0.08 0.02 0.00 0.00 177.57 177.66 1i59 h GLU 397 N -0.55 0.66 -0.08 1.57 4.81 -1.83 -3.17 114.58 116.00 1i59 h GLU 397 Ca 0.06 -0.14 -0.12 0.00 -0.13 0.00 0.00 59.36 59.02 1i59 h GLU 397 Cb 0.65 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.92 1i59 h GLU 397 CO -0.36 0.65 -0.50 0.93 -0.73 0.00 0.00 179.01 179.00 1i59 h GLU 398 N 0.55 0.20 0.00 1.92 5.08 -1.80 -3.23 114.58 117.31 1i59 h GLU 398 Ca 0.14 -0.11 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 1i59 h GLU 398 Cb 0.25 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.51 1i59 h GLU 398 CO -0.01 0.66 -0.32 1.51 -1.00 0.00 0.00 179.01 179.85 1i59 n ILE 399 N -3.95 0.48 0.34 3.13 0.13 -0.60 -4.35 119.36 114.53 1i59 n ILE 399 Ca -0.02 -0.28 -0.17 0.00 -1.10 0.00 0.00 62.75 61.18 1i59 n ILE 399 Cb 0.54 -0.35 -0.09 0.00 -0.84 0.00 0.00 39.64 38.90 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 4.51 -0.88 1.02 4.50 0.00 -1.56 -2.18 103.07 108.50 1i59 h GLY 400 Ca 0.00 0.32 -0.05 0.00 0.00 0.00 0.00 47.33 47.60 1i59 h GLY 400 CO 0.00 -0.32 0.19 0.83 0.00 0.00 0.00 176.54 177.24 1i59 h GLU 401 N -0.89 1.00 -0.86 4.80 4.39 -1.77 -1.14 114.58 120.11 1i59 h GLU 401 Ca -0.09 -0.22 0.04 0.00 0.34 0.00 0.00 59.36 59.44 1i59 h GLU 401 Cb 0.66 -0.14 -0.06 0.00 -0.10 0.00 0.00 28.75 29.11 1i59 h GLU 401 CO 0.14 0.89 0.55 -1.35 -1.16 0.00 0.00 179.01 178.08 1i59 h PRO 402 N 0.93 1.01 -0.50 2.33 0.11 -1.75 -1.25 132.00 132.88 1i59 h PRO 402 Ca 0.21 -0.06 -0.09 0.00 0.11 0.00 0.00 66.00 66.17 1i59 h PRO 402 Cb 0.31 -0.23 -0.02 0.00 0.11 0.00 0.00 31.00 31.18 1i59 h PRO 402 CO -0.00 0.67 -0.03 -0.07 -0.21 0.00 0.00 178.00 178.35 1i59 h LEU 403 N 1.04 0.89 -0.89 2.35 3.38 -1.06 -2.60 115.31 118.42 1i59 h LEU 403 Ca 0.36 -0.32 0.07 0.00 0.09 0.00 0.00 57.88 58.07 1i59 h LEU 403 Cb 0.07 -0.24 -0.07 0.00 0.09 0.00 0.00 40.66 40.51 1i59 h LEU 403 CO -0.14 1.00 0.55 0.25 0.09 0.00 0.00 178.44 180.19 1i59 h LEU 404 N 0.76 0.85 -0.96 1.67 5.85 -0.73 -1.19 115.31 121.56 1i59 h LEU 404 Ca 0.14 0.02 -0.03 0.00 0.84 0.00 0.00 57.88 58.84 1i59 h LEU 404 Cb 0.56 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 41.40 1i59 h LEU 404 CO 0.03 0.53 0.33 -0.74 -0.34 0.00 0.00 178.44 178.25 1i59 h HIS 405 N 0.98 1.08 -0.30 1.25 2.76 -0.94 0.11 115.15 120.09 1i59 h HIS 405 Ca 0.39 -0.06 -0.12 0.00 -2.20 0.00 0.00 60.37 58.39 1i59 h HIS 405 Cb 0.21 -0.33 -0.01 0.00 1.55 0.00 0.00 27.41 28.83 1i59 h HIS 405 CO -0.03 0.80 -0.31 -0.07 -1.30 0.00 0.00 177.93 177.02 1i59 h LEU 406 N 1.06 0.66 -0.41 0.26 3.38 -0.98 -0.33 115.31 118.95 1i59 h LEU 406 Ca 0.25 -0.26 -0.09 0.00 0.09 0.00 0.00 57.88 57.87 1i59 h LEU 406 Cb 0.15 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 1i59 h LEU 406 CO -0.03 0.93 -0.09 -0.07 0.09 0.00 0.00 178.44 179.27 1i59 h LEU 407 N 0.54 0.78 -0.66 1.67 3.38 -0.59 -1.99 115.31 118.45 1i59 h LEU 407 Ca 0.06 -0.36 -0.01 0.00 0.09 0.00 0.00 57.88 57.66 1i59 h LEU 407 Cb 0.81 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 41.31 1i59 h LEU 407 CO 0.07 0.95 0.36 -0.09 0.09 0.00 0.00 178.44 179.82 1i59 h ARG 408 N 0.59 0.92 -0.98 1.13 2.43 -0.56 -1.88 114.38 116.03 1i59 h ARG 408 Ca 0.10 -0.11 0.02 0.00 -0.81 0.00 0.00 59.98 59.18 1i59 h ARG 408 Cb 0.61 -0.18 -0.05 0.00 -0.42 0.00 0.00 29.97 29.93 1i59 h ARG 408 CO 0.04 0.69 0.65 -0.91 -1.51 0.00 0.00 179.97 178.93 1i59 h ASN 409 N 0.90 1.11 -0.25 -3.80 2.35 -0.89 0.16 115.58 115.17 1i59 h ASN 409 Ca 0.23 -0.02 -0.01 0.00 -0.55 0.00 0.00 56.30 55.94 1i59 h ASN 409 Cb 0.04 -0.27 -0.01 0.00 0.05 0.00 0.00 38.32 38.13 1i59 h ASN 409 CO -0.04 0.80 0.10 0.00 -1.65 0.00 0.00 177.43 176.64 1i59 h ALA 410 N 1.37 0.33 -0.28 -0.83 0.00 -0.77 0.20 119.26 119.27 1i59 h ALA 410 Ca 0.37 -0.12 -0.06 0.00 0.00 0.00 0.00 54.91 55.10 1i59 h ALA 410 Cb -0.12 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 1i59 h ALA 410 CO -0.09 -0.08 -0.06 0.82 0.00 0.00 0.00 179.25 179.84 1i59 h ILE 411 N 0.25 1.28 0.18 0.00 2.04 -1.03 0.17 117.51 120.41 1i59 h ILE 411 Ca 0.08 -1.08 -0.01 0.00 1.00 0.00 0.00 64.86 64.86 1i59 h ILE 411 Cb 0.18 1.41 0.00 0.00 -0.74 0.00 0.00 36.82 37.68 1i59 h ILE 411 CO -0.01 0.34 -0.09 -0.78 0.00 0.00 0.00 178.15 177.62 1i59 h ASP 412 N 0.29 -0.20 0.44 1.72 -0.00 -0.63 -3.39 116.42 114.66 1i59 h ASP 412 Ca 0.07 -0.23 -0.21 0.00 -0.00 0.00 0.00 57.03 56.66 1i59 h ASP 412 Cb 0.54 0.05 -0.04 0.00 -0.00 0.00 0.00 39.33 39.88 1i59 h ASP 412 CO 0.03 0.34 -1.73 1.41 -0.00 0.00 0.00 179.24 179.29 1i59 n HIS 413 N -4.92 0.66 0.00 0.28 8.25 0.67 -4.79 115.22 115.36 1i59 n HIS 413 Ca -0.06 0.22 0.00 0.00 -0.26 0.00 0.00 57.72 57.62 1i59 n HIS 413 Cb 0.21 -1.01 0.00 0.00 1.12 0.00 0.00 29.99 30.31 1i59 n HIS 413 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1i59 n GLY 414 N 1.48 0.03 3.68 -1.41 0.00 -0.42 -4.66 105.19 103.89 1i59 n GLY 414 Ca -0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.45 1i59 n GLY 414 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1i59 n ILE 415 N -1.68 0.55 -2.53 -0.61 2.08 0.48 -1.33 119.36 116.32 1i59 n ILE 415 Ca 0.00 -0.10 -0.28 0.00 0.56 0.00 0.00 62.75 62.93 1i59 n ILE 415 Cb 0.00 -2.21 0.00 0.00 -0.75 0.00 0.00 39.64 36.68 1i59 n ILE 415 CO 0.00 0.00 0.00 -1.61 0.56 0.00 0.00 176.55 175.50 1i59 s GLU 416 N 3.52 3.53 0.71 0.38 8.01 -1.26 -4.82 118.70 128.76 1i59 s GLU 416 Ca 0.85 0.26 -0.16 0.00 0.01 0.00 0.00 54.97 55.93 1i59 s GLU 416 Cb -0.46 -2.33 0.02 0.00 -4.31 0.00 0.00 34.13 27.05 1i59 s GLU 416 CO 0.40 -0.27 1.24 -2.14 0.01 0.00 0.00 175.26 174.50 1i59 s PRO 417 N -4.81 2.24 0.26 0.39 0.02 -1.26 -4.66 135.00 127.18 1i59 s PRO 417 Ca 0.49 1.88 -0.04 0.00 0.02 0.00 0.00 61.00 63.35 1i59 s PRO 417 Cb -0.10 -1.83 0.51 0.00 0.02 0.00 0.00 34.50 33.09 1i59 s PRO 417 CO 0.46 -1.79 1.64 -0.22 -0.33 0.00 0.00 177.00 176.76 1i59 h LYS 418 N -0.02 0.14 -0.81 5.54 3.64 -1.87 0.18 116.57 123.37 1i59 h LYS 418 Ca -0.49 -0.01 0.07 0.00 -1.27 0.00 0.00 60.65 58.95 1i59 h LYS 418 Cb 1.31 -0.03 -0.06 0.00 -0.41 0.00 0.00 32.23 33.04 1i59 h LYS 418 CO 0.51 0.09 0.49 0.93 -2.27 0.00 0.00 179.45 179.20 1i59 h GLU 419 N 0.15 0.84 -0.16 1.90 5.08 -1.92 -0.57 114.58 119.89 1i59 h GLU 419 Ca 0.45 -0.05 -0.15 0.00 -1.00 0.00 0.00 59.36 58.61 1i59 h GLU 419 Cb 0.82 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.87 1i59 h GLU 419 CO -0.65 0.56 -0.54 1.49 -1.00 0.00 0.00 179.01 178.87 1i59 h GLU 420 N 0.87 0.47 -0.17 2.33 4.81 -1.33 -1.98 114.58 119.58 1i59 h GLU 420 Ca 0.37 -0.29 -0.14 0.00 -0.13 0.00 0.00 59.36 59.17 1i59 h GLU 420 Cb 0.23 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.63 1i59 h GLU 420 CO -0.19 0.89 -0.48 0.00 -0.73 0.00 0.00 179.01 178.50 1i59 h ARG 421 N 0.37 0.43 -0.38 1.92 3.08 -0.75 -2.00 114.38 117.05 1i59 h ARG 421 Ca 0.01 -0.24 -0.14 0.00 0.07 0.00 0.00 59.98 59.68 1i59 h ARG 421 Cb 1.06 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 31.12 1i59 h ARG 421 CO 0.10 0.82 -0.31 0.82 -1.07 0.00 0.00 179.97 180.33 1i59 h ILE 422 N 0.34 1.28 -0.75 2.04 2.04 -1.00 0.20 117.51 121.67 1i59 h ILE 422 Ca 0.02 -1.46 -0.04 0.00 1.00 0.00 0.00 64.86 64.37 1i59 h ILE 422 Cb 0.97 1.31 -0.03 0.00 -0.74 0.00 0.00 36.82 38.33 1i59 h ILE 422 CO 0.08 0.49 0.29 0.00 0.00 0.00 0.00 178.15 179.01 1i59 h ALA 423 N 0.95 1.10 0.00 1.87 0.00 -1.14 -1.84 119.26 120.21 1i59 h ALA 423 Ca 0.08 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1i59 h ALA 423 Cb 0.86 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.35 1i59 h ALA 423 CO 0.08 0.64 0.00 1.63 0.00 0.00 0.00 179.25 181.59 1i59 n LYS 424 N -4.28 0.50 -2.27 0.00 5.02 -0.77 -4.88 118.16 111.48 1i59 n LYS 424 Ca 0.07 0.03 -0.06 0.00 -2.02 0.00 0.00 58.31 56.33 1i59 n LYS 424 Cb 0.19 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.70 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 0.86 0.22 3.88 0.72 0.00 -0.69 -5.05 105.19 105.13 1i59 n GLY 425 Ca 0.15 -0.59 -0.21 0.00 0.00 0.00 0.00 46.02 45.37 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 -4.53 2.73 0.41 1.61 1.02 0.66 -5.02 119.74 116.61 1i59 s LYS 426 Ca 0.04 -1.31 -0.27 0.00 0.02 0.00 0.00 55.97 54.45 1i59 s LYS 426 Cb -0.02 -2.51 -0.10 0.00 -0.52 0.00 0.00 37.83 34.69 1i59 s LYS 426 CO 0.05 0.02 1.47 -2.14 -0.92 0.00 0.00 175.35 173.82 1i59 s PRO 427 N -4.06 3.93 0.18 -1.68 0.02 -1.26 -4.41 135.00 127.73 1i59 s PRO 427 Ca 0.43 2.53 -0.13 0.00 0.02 0.00 0.00 61.00 63.85 1i59 s PRO 427 Cb -0.06 -2.84 0.18 0.00 0.02 0.00 0.00 34.50 31.80 1i59 s PRO 427 CO 0.28 -0.66 1.71 -1.35 -0.33 0.00 0.00 177.00 176.64 1i59 h PRO 428 N 2.72 0.19 -6.10 5.54 0.11 -1.91 -3.41 132.00 129.14 1i59 h PRO 428 Ca -0.51 -0.01 -0.56 0.00 0.11 0.00 0.00 66.00 65.03 1i59 h PRO 428 Cb 1.25 -0.04 -0.05 0.00 0.11 0.00 0.00 31.00 32.27 1i59 h PRO 428 CO 0.63 0.13 0.09 0.42 -0.21 0.00 0.00 178.00 179.06 1i59 s ILE 429 N -6.15 4.95 0.58 4.15 1.01 -1.26 -4.59 121.20 119.90 1i59 s ILE 429 Ca -0.13 1.46 -0.15 0.00 0.00 0.00 0.00 60.65 61.83 1i59 s ILE 429 Cb 0.15 -4.04 -0.05 0.00 0.01 0.00 0.00 42.46 38.53 1i59 s ILE 429 CO 0.72 0.30 1.02 -0.83 0.00 0.00 0.00 174.94 176.16 1i59 s GLY 430 N 0.45 1.96 -0.12 6.18 0.00 -0.36 -4.88 107.32 110.55 1i59 s GLY 430 Ca 0.37 0.18 0.03 0.00 0.00 0.00 0.00 44.72 45.29 1i59 s GLY 430 CO 0.19 0.47 -0.21 -1.59 0.00 0.00 0.00 173.10 171.96 1i59 s THR 431 N -2.73 2.26 -0.19 0.90 2.01 -1.26 -1.06 115.64 115.57 1i59 s THR 431 Ca 0.59 -0.94 0.01 0.00 0.31 0.00 0.00 61.69 61.66 1i59 s THR 431 Cb -0.12 -1.89 0.03 0.00 0.01 0.00 0.00 72.50 70.53 1i59 s THR 431 CO 0.40 0.55 -0.14 -0.22 -0.69 0.00 0.00 174.62 174.52 1i59 s LEU 432 N 0.45 2.21 -0.16 4.42 0.20 -0.65 -2.66 118.68 122.49 1i59 s LEU 432 Ca -0.15 -0.77 0.00 0.00 0.69 0.00 0.00 54.13 53.90 1i59 s LEU 432 Cb -0.17 -1.33 0.00 0.00 -0.43 0.00 0.00 46.19 44.26 1i59 s LEU 432 CO 0.06 -0.08 -0.15 -0.63 -0.29 0.00 0.00 176.35 175.26 1i59 s ILE 433 N 1.36 2.64 -0.22 6.68 1.01 0.40 -0.33 121.20 132.73 1i59 s ILE 433 Ca 0.01 -0.77 -0.04 0.00 0.00 0.00 0.00 60.65 59.85 1i59 s ILE 433 Cb -0.15 -2.12 -0.01 0.00 0.01 0.00 0.00 42.46 40.19 1i59 s ILE 433 CO -0.10 0.51 -0.03 -0.22 0.00 0.00 0.00 174.94 175.10 1i59 s LEU 434 N 0.93 2.95 0.10 2.97 2.96 0.82 -1.28 118.68 128.12 1i59 s LEU 434 Ca -0.03 -0.40 0.03 0.00 -0.22 0.00 0.00 54.13 53.51 1i59 s LEU 434 Cb -0.15 -1.75 -0.04 0.00 0.50 0.00 0.00 46.19 44.75 1i59 s LEU 434 CO -0.02 -0.03 -0.09 -0.94 -1.32 0.00 0.00 176.35 173.96 1i59 s SER 435 N 1.48 1.35 0.01 3.68 1.04 -0.50 -0.79 113.70 119.97 1i59 s SER 435 Ca 0.06 -0.87 -0.02 0.00 0.48 0.00 0.00 55.95 55.60 1i59 s SER 435 Cb -0.14 0.03 -0.01 0.00 0.10 0.00 0.00 66.02 66.00 1i59 s SER 435 CO -0.03 -0.32 0.03 0.00 0.98 0.00 0.00 173.24 173.90 1i59 s ALA 436 N -2.79 -0.04 0.10 5.32 0.00 -0.58 -1.02 121.76 122.75 1i59 s ALA 436 Ca 0.07 -0.31 -0.26 0.00 0.00 0.00 0.00 51.96 51.46 1i59 s ALA 436 Cb -0.01 0.08 0.08 0.00 0.00 0.00 0.00 23.12 23.28 1i59 s ALA 436 CO -0.01 -0.14 0.97 -0.98 0.00 0.00 0.00 175.76 175.60 1i59 s ARG 437 N -1.08 1.04 -0.20 0.00 1.70 -0.30 -4.24 118.95 115.87 1i59 s ARG 437 Ca -0.12 -0.54 -0.09 0.00 -0.47 0.00 0.00 55.73 54.51 1i59 s ARG 437 Cb -0.07 0.38 -0.05 0.00 -0.57 0.00 0.00 34.95 34.64 1i59 s ARG 437 CO -0.00 -0.47 0.11 -1.01 -1.08 0.00 0.00 175.30 172.85 1i59 s HIS 438 N -3.17 3.33 -0.39 5.89 3.76 -1.26 -0.36 115.29 123.08 1i59 s HIS 438 Ca 0.11 0.20 0.01 0.00 -0.15 0.00 0.00 55.06 55.22 1i59 s HIS 438 Cb -0.01 -2.16 0.13 0.00 1.11 0.00 0.00 32.58 31.66 1i59 s HIS 438 CO -0.01 0.18 0.21 -2.00 -0.85 0.00 0.00 174.74 172.27 1i59 s GLU 439 N 0.54 0.94 5.20 1.40 2.12 -0.17 -4.96 118.70 123.78 1i59 s GLU 439 Ca 0.06 -1.64 0.00 0.00 0.36 0.00 0.00 54.97 53.75 1i59 s GLU 439 Cb -0.12 -1.90 0.00 0.00 0.26 0.00 0.00 34.13 32.36 1i59 s GLU 439 CO 0.00 -1.16 0.00 0.41 -0.54 0.00 0.00 175.26 173.97 1i59 n GLY 440 N 3.88 0.72 1.10 -1.50 0.00 -1.26 -2.93 105.19 105.20 1i59 n GLY 440 Ca 0.08 -0.75 0.02 0.00 0.00 0.00 0.00 46.02 45.38 1i59 n GLY 440 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1i59 n ASN 441 N 5.04 2.98 -4.19 1.61 4.13 -1.26 -4.90 115.26 118.66 1i59 n ASN 441 Ca 0.00 -2.40 -0.14 0.00 1.68 0.00 0.00 54.58 53.72 1i59 n ASN 441 Cb 0.00 -0.58 -0.11 0.00 -1.54 0.00 0.00 39.78 37.55 1i59 n ASN 441 CO 0.00 0.00 0.00 0.20 0.28 0.00 0.00 177.26 177.74 1i59 s ASN 442 N -0.30 1.54 -0.23 6.41 0.01 -1.15 -1.16 114.94 120.06 1i59 s ASN 442 Ca 0.23 -0.86 -0.12 0.00 -0.71 0.00 0.00 52.86 51.39 1i59 s ASN 442 Cb 0.17 0.00 -0.05 0.00 0.41 0.00 0.00 41.25 41.79 1i59 s ASN 442 CO 0.06 -0.28 0.24 -0.69 -1.51 0.00 0.00 177.10 174.92 1i59 s VAL 443 N -2.67 5.31 -0.18 1.60 1.01 0.13 -1.00 120.40 124.60 1i59 s VAL 443 Ca 0.08 0.35 -0.04 0.00 0.00 0.00 0.00 61.98 62.38 1i59 s VAL 443 Cb -0.01 -3.57 -0.02 0.00 0.00 0.00 0.00 36.38 32.77 1i59 s VAL 443 CO 0.00 0.32 -0.04 -0.69 0.00 0.00 0.00 175.10 174.69 1i59 s VAL 444 N 1.10 3.66 -0.09 2.92 1.01 0.52 -0.42 120.40 129.10 1i59 s VAL 444 Ca 0.11 -0.42 0.03 0.00 0.00 0.00 0.00 61.98 61.71 1i59 s VAL 444 Cb -0.14 -2.63 0.00 0.00 0.00 0.00 0.00 36.38 33.62 1i59 s VAL 444 CO 0.05 0.46 -0.20 -0.63 0.00 0.00 0.00 175.10 174.78 1i59 s ILE 445 N 0.83 1.77 0.04 2.22 1.01 0.36 -1.15 121.20 126.30 1i59 s ILE 445 Ca -0.01 -0.85 0.08 0.00 0.00 0.00 0.00 60.65 59.87 1i59 s ILE 445 Cb -0.15 -1.55 -0.03 0.00 0.01 0.00 0.00 42.46 40.75 1i59 s ILE 445 CO 0.02 0.50 -0.23 -1.61 0.00 0.00 0.00 174.94 173.62 1i59 s GLU 446 N 0.46 1.53 -0.20 2.79 2.02 -0.19 -0.51 118.70 124.60 1i59 s GLU 446 Ca -0.17 -0.99 -0.01 0.00 0.02 0.00 0.00 54.97 53.81 1i59 s GLU 446 Cb -0.17 -1.66 0.05 0.00 0.10 0.00 0.00 34.13 32.45 1i59 s GLU 446 CO 0.07 0.43 -0.02 0.08 0.02 0.00 0.00 175.26 175.84 1i59 s VAL 447 N -0.80 1.03 -0.02 2.63 1.01 -0.16 -1.40 120.40 122.69 1i59 s VAL 447 Ca 0.09 -0.79 0.03 0.00 0.00 0.00 0.00 61.98 61.31 1i59 s VAL 447 Cb -0.09 -1.35 -0.00 0.00 0.00 0.00 0.00 36.38 34.94 1i59 s VAL 447 CO 0.02 -0.06 -0.09 -0.70 0.00 0.00 0.00 175.10 174.26 1i59 s GLU 448 N 1.64 0.87 0.16 2.72 2.12 -0.41 -0.45 118.70 125.36 1i59 s GLU 448 Ca -0.02 -0.32 0.06 0.00 0.36 0.00 0.00 54.97 55.06 1i59 s GLU 448 Cb -0.17 -0.83 -0.04 0.00 0.26 0.00 0.00 34.13 33.35 1i59 s GLU 448 CO -0.07 0.15 -0.13 0.16 -0.54 0.00 0.00 175.26 174.82 1i59 s ASP 449 N 0.03 2.19 -0.58 -1.70 -4.77 -0.31 -0.46 116.67 111.07 1i59 s ASP 449 Ca -0.00 -0.94 0.01 0.00 -3.30 0.00 0.00 52.55 48.32 1i59 s ASP 449 Cb -0.07 -0.08 0.43 0.00 -1.09 0.00 0.00 42.92 42.11 1i59 s ASP 449 CO 0.00 -0.19 1.72 -0.90 0.70 0.00 0.00 175.17 176.50 1i59 n ASP 450 N 0.02 6.65 -2.14 2.11 3.85 -1.09 -1.98 116.55 123.98 1i59 n ASP 450 Ca -0.11 -3.78 0.00 0.00 -0.71 0.00 0.00 54.79 50.18 1i59 n ASP 450 Cb 0.59 -0.78 0.00 0.00 -1.35 0.00 0.00 41.12 39.58 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 -0.74 0.46 0.00 6.12 0.00 -1.25 -4.63 105.19 105.15 1i59 n GLY 451 Ca 0.54 -1.69 0.12 0.00 0.00 0.00 0.00 46.02 44.98 1i59 n GLY 451 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1i59 n ARG 452 N 0.00 0.04 0.00 1.61 1.85 -0.44 -2.06 116.66 117.66 1i59 n ARG 452 Ca 0.00 0.08 0.00 0.00 -1.00 0.00 0.00 57.85 56.93 1i59 n ARG 452 Cb 0.00 -1.50 0.00 0.00 -1.05 0.00 0.00 32.46 29.91 1i59 n ARG 452 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1i59 n GLY 453 N 0.97 -1.40 3.74 2.89 0.00 -1.26 0.43 105.19 110.55 1i59 n GLY 453 Ca 0.07 -1.57 -0.41 0.00 0.00 0.00 0.00 46.02 44.10 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 -2.75 3.35 -0.81 -0.61 1.01 -1.26 -4.86 121.20 115.27 1i59 s ILE 454 Ca 0.00 1.12 -0.26 0.00 0.00 0.00 0.00 60.65 61.51 1i59 s ILE 454 Cb 0.00 -3.72 0.03 0.00 0.01 0.00 0.00 42.46 38.78 1i59 s ILE 454 CO 0.00 0.17 1.41 -0.62 0.00 0.00 0.00 174.94 175.90 1i59 s ASP 455 N 0.27 6.13 0.44 3.58 3.68 -1.26 -4.82 116.67 124.70 1i59 s ASP 455 Ca 0.55 -0.67 0.21 0.00 2.13 0.00 0.00 52.55 54.78 1i59 s ASP 455 Cb -0.35 -2.56 1.04 0.00 -1.45 0.00 0.00 42.92 39.60 1i59 s ASP 455 CO 0.38 -1.83 1.91 0.11 0.13 0.00 0.00 175.17 175.86 1i59 h LYS 456 N 10.46 0.00 -0.30 4.34 1.57 -1.99 -2.04 116.57 128.61 1i59 h LYS 456 Ca -0.13 0.00 -0.15 0.00 -1.87 0.00 0.00 60.65 58.50 1i59 h LYS 456 Cb 1.05 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.35 1i59 h LYS 456 CO 1.31 0.25 -0.42 1.49 -0.57 0.00 0.00 179.45 181.51 1i59 h GLU 457 N 0.00 0.73 -0.42 3.15 4.81 -2.00 -1.89 114.58 118.96 1i59 h GLU 457 Ca -0.00 -0.39 -0.13 0.00 -0.13 0.00 0.00 59.36 58.70 1i59 h GLU 457 Cb 0.59 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.97 1i59 h GLU 457 CO 0.03 1.01 -0.27 -0.22 -0.73 0.00 0.00 179.01 178.84 1i59 h LYS 458 N 0.59 0.88 -0.35 1.92 3.11 -1.84 -1.96 116.57 118.93 1i59 h LYS 458 Ca 0.04 -0.39 -0.01 0.00 -2.81 0.00 0.00 60.65 57.48 1i59 h LYS 458 Cb 0.97 -0.02 -0.02 0.00 -1.00 0.00 0.00 32.23 32.16 1i59 h LYS 458 CO 0.09 1.04 0.17 0.82 -2.81 0.00 0.00 179.45 178.77 1i59 h ILE 459 N 0.75 1.16 -0.37 2.00 2.04 -1.20 -1.11 117.51 120.79 1i59 h ILE 459 Ca 0.09 -0.45 0.02 0.00 1.00 0.00 0.00 64.86 65.52 1i59 h ILE 459 Cb 0.82 0.81 -0.02 0.00 -0.74 0.00 0.00 36.82 37.69 1i59 h ILE 459 CO 0.07 0.17 0.21 0.40 0.00 0.00 0.00 178.15 179.00 1i59 h ILE 460 N 0.43 1.04 -0.72 -0.67 2.04 -1.21 0.75 117.51 119.17 1i59 h ILE 460 Ca 0.12 -0.15 0.05 0.00 1.00 0.00 0.00 64.86 65.88 1i59 h ILE 460 Cb 0.11 0.56 -0.05 0.00 -0.74 0.00 0.00 36.82 36.70 1i59 h ILE 460 CO -0.02 0.08 0.43 0.03 0.00 0.00 0.00 178.15 178.67 1i59 h ARG 461 N 0.43 0.78 -0.49 2.37 3.08 -1.05 -0.64 114.38 118.87 1i59 h ARG 461 Ca 0.14 -0.05 -0.05 0.00 0.07 0.00 0.00 59.98 60.10 1i59 h ARG 461 Cb 0.01 -0.18 -0.02 0.00 0.08 0.00 0.00 29.97 29.86 1i59 h ARG 461 CO -0.07 0.52 0.11 0.87 -1.07 0.00 0.00 179.97 180.33 1i59 h LYS 462 N 0.81 0.79 -0.54 0.04 1.57 -0.64 -1.19 116.57 117.41 1i59 h LYS 462 Ca 0.31 -0.20 0.04 0.00 -1.87 0.00 0.00 60.65 58.93 1i59 h LYS 462 Cb 0.12 -0.10 -0.04 0.00 0.08 0.00 0.00 32.23 32.29 1i59 h LYS 462 CO -0.15 0.78 0.31 0.00 -0.57 0.00 0.00 179.45 179.81 1i59 h ALA 463 N 0.98 0.70 -0.47 3.86 0.00 -0.24 0.93 119.26 125.03 1i59 h ALA 463 Ca 0.15 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 55.03 1i59 h ALA 463 Cb 0.35 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 1i59 h ALA 463 CO 0.00 -0.01 0.16 0.82 0.00 0.00 0.00 179.25 180.22 1i59 h ILE 464 N 0.60 1.22 -0.97 0.00 2.04 -0.98 -0.84 117.51 118.57 1i59 h ILE 464 Ca 0.23 -0.73 0.05 0.00 1.00 0.00 0.00 64.86 65.41 1i59 h ILE 464 Cb 0.08 0.81 -0.06 0.00 -0.74 0.00 0.00 36.82 36.92 1i59 h ILE 464 CO -0.13 0.26 0.64 -0.08 0.00 0.00 0.00 178.15 178.84 1i59 h GLU 465 N 0.62 1.16 -0.34 2.37 4.81 -0.46 -1.73 114.58 121.02 1i59 h GLU 465 Ca 0.15 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.31 1i59 h GLU 465 Cb 0.25 -0.26 0.00 0.00 0.63 0.00 0.00 28.75 29.37 1i59 h GLU 465 CO -0.01 0.77 0.00 1.63 -0.73 0.00 0.00 179.01 180.67 1i59 n LYS 466 N -4.46 1.56 -1.56 1.92 5.02 0.25 -4.89 118.16 116.01 1i59 n LYS 466 Ca 0.14 -0.71 -0.16 0.00 -2.02 0.00 0.00 58.31 55.56 1i59 n LYS 466 Cb 0.13 -1.26 -0.06 0.00 -0.02 0.00 0.00 35.03 33.81 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 0.67 1.37 0.15 0.72 0.00 -0.65 -4.88 105.19 102.57 1i59 n GLY 467 Ca 0.07 -0.27 0.07 0.00 0.00 0.00 0.00 46.02 45.88 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 -7.29 0.99 3.38 -1.37 -3.47 115.31 107.54 1i59 h LEU 468 Ca -0.33 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.59 1i59 h LEU 468 Cb 1.06 0.00 -0.13 0.00 0.09 0.00 0.00 40.66 41.67 1i59 h LEU 468 CO 0.47 0.26 -0.01 -0.51 0.09 0.00 0.00 178.44 178.74 1i59 s ILE 469 N -3.11 0.05 0.30 1.22 2.07 -1.23 -5.00 121.20 115.50 1i59 s ILE 469 Ca 0.03 -0.42 -0.00 0.00 -1.41 0.00 0.00 60.65 58.84 1i59 s ILE 469 Cb 0.07 -1.11 -0.04 0.00 0.13 0.00 0.00 42.46 41.52 1i59 s ILE 469 CO 0.74 -0.23 0.50 -0.62 -1.91 0.00 0.00 174.94 173.42 1i59 s ASP 470 N -2.69 6.34 0.35 4.50 -1.08 -1.26 -4.30 116.67 118.53 1i59 s ASP 470 Ca 0.01 0.46 0.09 0.00 -0.52 0.00 0.00 52.55 52.59 1i59 s ASP 470 Cb 0.01 -2.03 0.65 0.00 -1.46 0.00 0.00 42.92 40.09 1i59 s ASP 470 CO -0.11 -0.21 1.83 1.05 0.52 0.00 0.00 175.17 178.25 1i59 h GLU 471 N 1.20 0.21 0.00 4.34 -0.00 -1.99 -2.57 114.58 115.78 1i59 h GLU 471 Ca -0.49 -0.07 -0.03 0.00 -0.00 0.00 0.00 59.36 58.77 1i59 h GLU 471 Cb 1.21 -0.02 -0.00 0.00 -0.00 0.00 0.00 28.75 29.94 1i59 h GLU 471 CO 0.63 0.47 -0.13 0.66 -0.00 0.00 0.00 179.01 180.64 1i59 h SER 472 N 0.19 0.00 0.98 3.06 4.64 -2.05 -2.37 113.55 118.00 1i59 h SER 472 Ca 0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 1i59 h SER 472 Cb 0.57 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.66 1i59 h SER 472 CO 0.04 0.13 -0.73 0.50 -0.87 0.00 0.00 176.83 175.89 1i59 h LYS 473 N 0.00 0.00 -0.15 4.77 3.11 -1.86 -3.38 116.57 119.06 1i59 h LYS 473 Ca -0.00 0.00 -0.14 0.00 -2.81 0.00 0.00 60.65 57.70 1i59 h LYS 473 Cb 0.30 0.00 -0.01 0.00 -1.00 0.00 0.00 32.23 31.52 1i59 h LYS 473 CO 0.02 0.00 -0.49 0.00 -2.81 0.00 0.00 179.45 176.17 1i59 h ALA 474 N 2.29 0.89 -0.70 5.00 0.00 -1.29 -3.28 119.26 122.16 1i59 h ALA 474 Ca 0.00 -0.48 0.10 0.00 0.00 0.00 0.00 54.91 54.53 1i59 h ALA 474 Cb 0.86 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.51 1i59 h ALA 474 CO 0.00 0.66 0.47 0.00 0.00 0.00 0.00 179.25 180.38 1i59 h ALA 475 N 1.17 1.89 -0.21 0.00 0.00 -1.74 -2.76 119.26 117.61 1i59 h ALA 475 Ca 0.01 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1i59 h ALA 475 Cb 0.98 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.64 1i59 h ALA 475 CO 0.08 -0.04 0.00 0.25 0.00 0.00 0.00 179.25 179.55 1i59 n THR 476 N -4.49 0.25 -1.69 0.00 -2.24 -1.24 -4.99 114.28 99.88 1i59 n THR 476 Ca 0.12 -0.60 -0.40 0.00 -2.27 0.00 0.00 64.05 60.89 1i59 n THR 476 Cb 0.35 1.16 0.02 0.00 -2.10 0.00 0.00 70.33 69.76 1i59 n THR 476 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1i59 n LEU 477 N 1.32 4.10 -4.92 3.22 4.77 -1.05 -4.99 117.00 119.46 1i59 n LEU 477 Ca 0.17 1.06 -0.27 0.00 -0.03 0.00 0.00 56.01 56.95 1i59 n LEU 477 Cb 0.58 -1.49 0.05 0.00 -2.33 0.00 0.00 43.42 40.23 1i59 n LEU 477 CO 0.15 -0.79 0.60 -0.94 -1.33 0.00 0.00 177.39 175.09 1i59 s SER 478 N -0.65 5.18 0.24 -1.43 1.04 -1.26 -4.90 113.70 111.92 1i59 s SER 478 Ca 0.64 0.63 -0.06 0.00 0.48 0.00 0.00 55.95 57.64 1i59 s SER 478 Cb -0.49 -1.43 0.25 0.00 0.10 0.00 0.00 66.02 64.45 1i59 s SER 478 CO 0.56 -1.37 1.86 0.44 0.98 0.00 0.00 173.24 175.71 1i59 h ASP 479 N -0.45 1.07 -0.68 7.02 3.32 -1.99 -1.61 116.42 123.10 1i59 h ASP 479 Ca -0.45 -0.10 -0.07 0.00 0.02 0.00 0.00 57.03 56.43 1i59 h ASP 479 Cb 1.29 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 40.53 1i59 h ASP 479 CO 0.61 0.87 0.16 1.56 -1.72 0.00 0.00 179.24 180.72 1i59 h GLN 480 N 1.19 1.11 -0.36 3.56 1.08 -1.95 0.33 115.11 120.07 1i59 h GLN 480 Ca 0.30 -0.27 -0.08 0.00 -1.45 0.00 0.00 58.65 57.15 1i59 h GLN 480 Cb 0.06 -0.15 -0.02 0.00 -0.05 0.00 0.00 27.48 27.33 1i59 h GLN 480 CO -0.04 0.98 -0.11 0.93 -0.95 0.00 0.00 178.83 179.63 1i59 h GLU 481 N 1.05 0.62 0.21 1.46 5.08 -1.82 -1.08 114.58 120.10 1i59 h GLU 481 Ca 0.22 -0.19 -0.01 0.00 -1.00 0.00 0.00 59.36 58.38 1i59 h GLU 481 Cb 0.38 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.57 1i59 h GLU 481 CO 0.00 0.72 -0.10 0.82 -1.00 0.00 0.00 179.01 179.45 1i59 h ILE 482 N 0.57 0.83 -0.10 3.13 2.04 -0.85 -3.15 117.51 119.99 1i59 h ILE 482 Ca 0.10 -0.85 0.03 0.00 1.00 0.00 0.00 64.86 65.14 1i59 h ILE 482 Cb 0.53 1.29 -0.00 0.00 -0.74 0.00 0.00 36.82 37.90 1i59 h ILE 482 CO 0.03 0.17 0.07 -0.07 0.00 0.00 0.00 178.15 178.36 1i59 h LEU 483 N -0.75 0.00 -1.89 1.44 3.38 -0.91 -1.96 115.31 114.61 1i59 h LEU 483 Ca -0.03 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.94 1i59 h LEU 483 Cb 0.50 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.25 1i59 h LEU 483 CO 0.05 0.00 -0.02 0.78 0.09 0.00 0.00 178.44 179.33 1i59 h ASN 484 N 0.00 0.00 0.03 -0.43 4.21 -1.15 -2.32 115.58 115.92 1i59 h ASN 484 Ca 0.05 0.00 -0.01 0.00 1.21 0.00 0.00 56.30 57.55 1i59 h ASN 484 Cb 0.19 0.00 -0.00 0.00 -1.12 0.00 0.00 38.32 37.39 1i59 h ASN 484 CO -0.00 0.02 -0.03 -0.26 -1.29 0.00 0.00 177.43 175.87 1i59 h PHE 485 N 0.00 0.00 -0.10 1.19 0.05 -1.38 -0.94 116.94 115.77 1i59 h PHE 485 Ca -0.00 0.00 0.03 0.00 3.82 0.00 0.00 57.97 61.82 1i59 h PHE 485 Cb 0.37 -0.00 -0.00 0.00 2.00 0.00 0.00 35.95 38.32 1i59 h PHE 485 CO 0.00 0.04 0.12 -0.07 -0.18 0.00 0.00 178.31 178.22 1i59 h LEU 486 N 0.01 0.00 -0.62 1.54 4.07 -1.58 -1.14 115.31 117.58 1i59 h LEU 486 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 1i59 h LEU 486 Cb 0.06 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.80 1i59 h LEU 486 CO 0.00 0.00 -0.21 0.49 -1.08 0.00 0.00 178.44 177.64 1i59 n PHE 487 N -3.78 0.00 -2.33 1.13 0.99 -0.36 -2.22 117.46 110.89 1i59 n PHE 487 Ca -0.00 0.00 -0.42 0.00 -0.00 0.00 0.00 57.45 57.02 1i59 n PHE 487 Cb 0.22 -0.09 -0.03 0.00 -1.00 0.00 0.00 39.48 38.59 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 -2.40 4.01 0.16 -4.37 1.01 -0.43 -4.68 120.40 113.70 1i59 s VAL 488 Ca 0.27 1.32 -0.34 0.00 0.00 0.00 0.00 61.98 63.23 1i59 s VAL 488 Cb 0.20 -3.85 -0.14 0.00 0.00 0.00 0.00 36.38 32.58 1i59 s VAL 488 CO 0.48 -0.04 1.51 -0.81 0.00 0.00 0.00 175.10 176.25 1i59 n PRO 489 N 5.77 1.97 -0.31 2.72 -0.04 -1.26 -1.20 135.00 142.66 1i59 n PRO 489 Ca 0.13 0.71 0.00 0.00 -0.04 0.00 0.00 63.50 64.30 1i59 n PRO 489 Cb 0.45 -2.44 0.00 0.00 -0.04 0.00 0.00 33.50 31.47 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 3.10 1.24 0.07 0.55 0.00 -1.26 -4.94 105.19 103.95 1i59 n GLY 490 Ca 0.16 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.08 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 0.02 -3.62 1.61 3.57 -1.46 -3.41 116.94 113.64 1i59 h PHE 491 Ca 0.00 0.01 -0.51 0.00 3.53 0.00 0.00 57.97 61.00 1i59 h PHE 491 Cb 0.00 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 38.72 1i59 h PHE 491 CO 0.00 0.00 0.26 -1.54 -2.23 0.00 0.00 178.31 174.80 1i59 s SER 492 N -5.22 7.51 0.21 0.41 1.04 -1.26 -4.95 113.70 111.44 1i59 s SER 492 Ca -0.13 1.78 -0.08 0.00 0.48 0.00 0.00 55.95 58.00 1i59 s SER 492 Cb 0.08 -2.55 0.16 0.00 0.10 0.00 0.00 66.02 63.80 1i59 s SER 492 CO 0.67 0.18 1.79 0.74 0.98 0.00 0.00 173.24 177.60 1i59 h THR 493 N 3.27 1.26 -0.85 2.02 2.02 -1.98 -3.49 112.91 115.17 1i59 h THR 493 Ca -0.46 -0.77 0.09 0.00 0.77 0.00 0.00 66.41 66.03 1i59 h THR 493 Cb 1.20 0.29 -0.04 0.00 -1.74 0.00 0.00 68.15 67.86 1i59 h THR 493 CO 0.67 0.32 -0.27 0.29 0.37 0.00 0.00 175.52 176.90 1i59 n LYS 494 N -4.32 -0.80 0.01 6.66 5.02 -1.26 -5.06 118.16 118.42 1i59 n LYS 494 Ca 0.07 0.63 0.00 0.00 -2.02 0.00 0.00 58.31 56.99 1i59 n LYS 494 Cb 0.17 -0.94 0.00 0.00 -0.02 0.00 0.00 35.03 34.24 1i59 n LYS 494 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1i59 n GLU 495 N -2.74 0.00 -1.95 1.97 4.71 -1.26 -5.02 120.64 116.34 1i59 n GLU 495 Ca -0.02 0.00 -0.41 0.00 -0.01 0.00 0.00 57.16 56.72 1i59 n GLU 495 Cb 0.17 0.00 -0.02 0.00 -1.01 0.00 0.00 31.44 30.58 1i59 n GLU 495 CO 0.00 0.00 0.00 -1.59 0.09 0.00 0.00 177.13 175.63 1i59 s LYS 496 N -2.00 4.23 0.12 3.49 0.00 -1.26 -4.82 119.74 119.50 1i59 s LYS 496 Ca 0.00 2.37 0.09 0.00 0.00 0.00 0.00 55.97 58.43 1i59 s LYS 496 Cb 0.00 -3.09 -0.04 0.00 0.00 0.00 0.00 37.83 34.70 1i59 s LYS 496 CO 0.00 -0.47 -0.17 0.08 0.00 0.00 0.00 175.35 174.79 1i59 s VAL 497 N 0.02 2.90 -0.22 1.79 1.01 -1.26 0.12 120.40 124.76 1i59 s VAL 497 Ca 0.60 -1.52 -0.29 0.00 0.00 0.00 0.00 61.98 60.78 1i59 s VAL 497 Cb -0.43 -2.35 -0.01 0.00 0.00 0.00 0.00 36.38 33.59 1i59 s VAL 497 CO 0.44 0.07 1.35 -0.55 0.00 0.00 0.00 175.10 176.41 1i59 s SER 498 N -2.23 6.74 0.00 3.32 0.15 -0.31 -4.87 113.70 116.49 1i59 s SER 498 Ca 0.19 1.50 0.09 0.00 0.70 0.00 0.00 55.95 58.43 1i59 s SER 498 Cb -0.10 -2.54 0.41 0.00 -1.71 0.00 0.00 66.02 62.07 1i59 s SER 498 CO 0.11 -0.97 1.23 -1.84 1.20 0.00 0.00 173.24 172.96 1i59 n GLU 499 N 7.08 0.05 -0.12 5.44 0.00 -1.26 0.03 120.64 131.86 1i59 n GLU 499 Ca 0.15 0.29 -0.24 0.00 0.00 0.00 0.00 57.16 57.36 1i59 n GLU 499 Cb 0.46 -1.50 -0.08 0.00 0.00 0.00 0.00 31.44 30.31 1i59 n GLU 499 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.13 177.41 1i59 n VAL 500 N -1.41 1.52 -0.05 3.84 0.31 -1.26 -4.77 118.33 116.51 1i59 n VAL 500 Ca 0.03 -0.21 -0.18 0.00 -0.01 0.00 0.00 64.34 63.97 1i59 n VAL 500 Cb 0.09 -2.02 -0.13 0.00 -0.91 0.00 0.00 33.84 30.87 1i59 n VAL 500 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 1i59 n SER 501 N -4.33 1.80 0.00 4.52 3.41 -1.18 -5.02 113.62 112.82 1i59 n SER 501 Ca -0.42 0.09 0.00 0.00 -0.26 0.00 0.00 58.87 58.29 1i59 n SER 501 Cb 0.76 -0.49 0.00 0.00 -0.26 0.00 0.00 64.21 64.22 1i59 n SER 501 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1i59 n GLY 502 N 2.03 0.70 3.86 5.00 0.00 0.10 -5.01 105.19 111.87 1i59 n GLY 502 Ca -0.35 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.32 1i59 n GLY 502 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1i59 s ARG 503 N -0.91 3.82 0.72 1.61 3.52 -1.26 -4.68 118.95 121.77 1i59 s ARG 503 Ca 0.00 0.26 -0.16 0.00 -0.13 0.00 0.00 55.73 55.70 1i59 s ARG 503 Cb 0.00 -2.96 0.02 0.00 -1.56 0.00 0.00 34.95 30.45 1i59 s ARG 503 CO 0.00 0.52 1.08 0.41 -0.81 0.00 0.00 175.30 176.50 1i59 n GLY 504 N 0.81 -0.15 3.17 8.12 0.00 -1.26 -1.16 105.19 114.71 1i59 n GLY 504 Ca -0.07 -0.32 -0.30 0.00 0.00 0.00 0.00 46.02 45.32 1i59 n GLY 504 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1i59 s VAL 505 N -1.78 1.84 0.33 1.61 1.01 0.33 -4.77 120.40 118.97 1i59 s VAL 505 Ca 0.75 -0.89 0.07 0.00 0.00 0.00 0.00 61.98 61.91 1i59 s VAL 505 Cb -0.34 -1.61 -0.02 0.00 0.00 0.00 0.00 36.38 34.40 1i59 s VAL 505 CO 0.48 0.51 0.30 0.61 0.00 0.00 0.00 175.10 177.01 1i59 n GLY 506 N 3.67 2.82 0.25 4.51 0.00 -1.26 -4.57 105.19 110.61 1i59 n GLY 506 Ca -0.20 -1.86 0.06 0.00 0.00 0.00 0.00 46.02 44.02 1i59 n GLY 506 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 1i59 h MET 507 N 0.00 0.09 -0.80 1.61 1.85 -1.98 -1.31 114.93 114.39 1i59 h MET 507 Ca -0.24 -0.01 -0.03 0.00 -0.61 0.00 0.00 59.70 58.81 1i59 h MET 507 Cb 1.19 -0.02 -0.04 0.00 0.43 0.00 0.00 31.60 33.17 1i59 h MET 507 CO 0.34 0.15 0.39 0.38 -0.40 0.00 0.00 176.91 177.77 1i59 h ASP 508 N 0.09 1.03 0.11 1.39 -0.00 -1.72 -1.04 116.42 116.28 1i59 h ASP 508 Ca 0.02 -0.11 -0.18 0.00 -0.00 0.00 0.00 57.03 56.76 1i59 h ASP 508 Cb 0.15 -0.26 -0.00 0.00 -0.00 0.00 0.00 39.33 39.22 1i59 h ASP 508 CO 0.01 0.86 -0.68 0.58 -0.00 0.00 0.00 179.24 180.01 1i59 h VAL 509 N 1.13 1.34 -0.46 4.15 2.07 -1.61 -1.75 116.25 121.12 1i59 h VAL 509 Ca 0.28 -1.99 0.02 0.00 0.82 0.00 0.00 66.70 65.82 1i59 h VAL 509 Cb 0.10 1.97 -0.03 0.00 -1.52 0.00 0.00 31.29 31.81 1i59 h VAL 509 CO -0.04 0.61 0.27 0.58 0.02 0.00 0.00 177.57 179.02 1i59 h VAL 510 N 0.37 1.05 -0.46 2.57 2.07 -0.73 0.68 116.25 121.80 1i59 h VAL 510 Ca -0.02 -0.19 -0.05 0.00 0.82 0.00 0.00 66.70 67.26 1i59 h VAL 510 Cb 1.25 0.45 -0.02 0.00 -1.52 0.00 0.00 31.29 31.46 1i59 h VAL 510 CO 0.12 0.10 0.09 0.50 0.02 0.00 0.00 177.57 178.40 1i59 h LYS 511 N 0.55 0.75 -0.51 1.57 3.11 -1.16 -1.00 116.57 119.87 1i59 h LYS 511 Ca 0.18 -0.19 0.02 0.00 -2.81 0.00 0.00 60.65 57.85 1i59 h LYS 511 Cb 0.01 -0.09 -0.03 0.00 -1.00 0.00 0.00 32.23 31.12 1i59 h LYS 511 CO -0.08 0.76 0.31 -0.97 -2.81 0.00 0.00 179.45 176.65 1i59 h ASN 512 N 0.62 0.51 -0.20 4.20 -1.24 -0.77 0.71 115.58 119.41 1i59 h ASN 512 Ca 0.14 0.00 -0.03 0.00 0.71 0.00 0.00 56.30 57.13 1i59 h ASN 512 Cb 0.36 -0.11 -0.01 0.00 0.73 0.00 0.00 38.32 39.30 1i59 h ASN 512 CO 0.01 0.36 0.03 0.58 -1.29 0.00 0.00 177.43 177.11 1i59 h VAL 513 N 0.62 1.23 -0.82 2.57 2.07 -0.73 -1.39 116.25 119.80 1i59 h VAL 513 Ca 0.20 -0.77 0.06 0.00 0.82 0.00 0.00 66.70 67.01 1i59 h VAL 513 Cb 0.00 1.35 -0.06 0.00 -1.52 0.00 0.00 31.29 31.06 1i59 h VAL 513 CO -0.08 0.24 0.50 0.58 0.02 0.00 0.00 177.57 178.83 1i59 h VAL 514 N 0.13 1.04 -0.25 2.57 2.07 -0.91 -0.79 116.25 120.10 1i59 h VAL 514 Ca 0.06 -0.32 -0.06 0.00 0.82 0.00 0.00 66.70 67.20 1i59 h VAL 514 Cb 0.33 0.03 -0.01 0.00 -1.52 0.00 0.00 31.29 30.12 1i59 h VAL 514 CO 0.01 0.17 -0.11 -0.33 0.02 0.00 0.00 177.57 177.33 1i59 h GLU 515 N 0.93 0.41 0.00 1.57 4.39 -0.68 -1.64 114.58 119.55 1i59 h GLU 515 Ca 0.36 -0.10 -0.00 0.00 0.34 0.00 0.00 59.36 59.95 1i59 h GLU 515 Cb 0.15 -0.05 -0.00 0.00 -0.10 0.00 0.00 28.75 28.75 1i59 h GLU 515 CO -0.17 0.52 -0.00 0.77 -1.16 0.00 0.00 179.01 178.98 1i59 h SER 516 N 0.39 0.00 -0.48 1.42 0.02 -0.01 -0.86 113.55 114.03 1i59 h SER 516 Ca 0.08 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.03 1i59 h SER 516 Cb 0.42 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.96 1i59 h SER 516 CO 0.02 0.00 0.00 0.18 -1.14 0.00 0.00 176.83 175.90 1i59 n LEU 517 N -3.09 3.05 -1.24 5.07 4.77 -0.69 -4.92 117.00 119.94 1i59 n LEU 517 Ca -0.01 -1.43 -0.12 0.00 -0.03 0.00 0.00 56.01 54.42 1i59 n LEU 517 Cb 0.22 -0.31 -0.02 0.00 -2.33 0.00 0.00 43.42 40.98 1i59 n LEU 517 CO 0.25 0.72 -0.14 0.59 -1.33 0.00 0.00 177.39 177.47 1i59 n ASN 518 N 1.18 -4.01 -1.92 -1.43 3.02 -0.33 -4.54 115.26 107.23 1i59 n ASN 518 Ca 0.19 0.08 0.00 0.00 -0.03 0.00 0.00 54.58 54.82 1i59 n ASN 518 Cb 0.51 -3.04 0.00 0.00 -0.61 0.00 0.00 39.78 36.64 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 -1.16 3.73 3.15 7.41 0.00 -0.76 -4.54 105.19 113.02 1i59 n GLY 519 Ca -0.14 -2.18 -0.10 0.00 0.00 0.00 0.00 46.02 43.60 1i59 n GLY 519 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1i59 s SER 520 N -0.94 0.50 0.00 1.61 1.04 -0.43 -4.15 113.70 111.34 1i59 s SER 520 Ca 0.00 -1.15 0.00 0.00 0.48 0.00 0.00 55.95 55.28 1i59 s SER 520 Cb 0.00 0.24 -0.00 0.00 0.10 0.00 0.00 66.02 66.36 1i59 s SER 520 CO 0.00 -0.67 -0.02 -0.51 0.98 0.00 0.00 173.24 173.02 1i59 s ILE 521 N -3.95 0.11 0.07 -1.02 2.07 -1.26 -1.11 121.20 116.11 1i59 s ILE 521 Ca 0.20 -0.21 0.03 0.00 -1.41 0.00 0.00 60.65 59.26 1i59 s ILE 521 Cb 0.07 -0.13 -0.03 0.00 0.13 0.00 0.00 42.46 42.50 1i59 s ILE 521 CO -0.01 -0.06 -0.08 -0.94 -1.91 0.00 0.00 174.94 171.94 1i59 s SER 522 N -0.28 1.09 -0.00 4.50 1.04 -0.22 -5.00 113.70 114.83 1i59 s SER 522 Ca -0.02 -0.72 0.06 0.00 0.48 0.00 0.00 55.95 55.74 1i59 s SER 522 Cb -0.02 0.04 -0.02 0.00 0.10 0.00 0.00 66.02 66.12 1i59 s SER 522 CO -0.00 -0.27 -0.18 -0.63 0.98 0.00 0.00 173.24 173.14 1i59 s ILE 523 N -2.15 1.40 -0.02 -1.02 1.01 -1.26 -1.32 121.20 117.84 1i59 s ILE 523 Ca -0.01 -0.81 0.03 0.00 0.00 0.00 0.00 60.65 59.85 1i59 s ILE 523 Cb -0.05 -1.18 -0.00 0.00 0.01 0.00 0.00 42.46 41.24 1i59 s ILE 523 CO -0.01 0.35 -0.10 -0.70 0.00 0.00 0.00 174.94 174.49 1i59 s GLU 524 N -0.54 0.95 -0.27 2.79 2.12 -0.44 -5.01 118.70 118.29 1i59 s GLU 524 Ca 0.07 -0.33 -0.23 0.00 0.36 0.00 0.00 54.97 54.83 1i59 s GLU 524 Cb -0.07 -0.89 0.09 0.00 0.26 0.00 0.00 34.13 33.52 1i59 s GLU 524 CO -0.00 0.15 0.80 0.45 -0.54 0.00 0.00 175.26 176.11 1i59 s SER 525 N 0.07 -0.70 -0.02 -1.70 0.15 -1.26 -0.77 113.70 109.47 1i59 s SER 525 Ca -0.01 1.30 0.02 0.00 0.70 0.00 0.00 55.95 57.96 1i59 s SER 525 Cb -0.07 1.32 0.01 0.00 -1.71 0.00 0.00 66.02 65.56 1i59 s SER 525 CO 0.00 -0.22 -0.07 -0.70 1.20 0.00 0.00 173.24 173.45 1i59 s GLU 526 N 0.55 0.74 0.13 5.44 2.12 -0.93 -4.91 118.70 121.84 1i59 s GLU 526 Ca -0.01 -0.22 -0.35 0.00 0.36 0.00 0.00 54.97 54.75 1i59 s GLU 526 Cb -0.05 -0.72 -0.15 0.00 0.26 0.00 0.00 34.13 33.47 1i59 s GLU 526 CO -0.04 0.07 1.44 1.17 -0.54 0.00 0.00 175.26 177.36 1i59 n LYS 527 N 3.34 1.62 -0.63 4.30 4.81 -1.26 -1.18 118.16 129.16 1i59 n LYS 527 Ca -0.18 0.58 0.00 0.00 -0.87 0.00 0.00 58.31 57.84 1i59 n LYS 527 Cb 0.55 -2.27 0.00 0.00 0.02 0.00 0.00 35.03 33.32 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 2.87 -1.00 -0.12 3.14 8.00 0.17 -4.73 116.55 124.88 1i59 n ASP 528 Ca 0.17 0.00 -0.24 0.00 0.71 0.00 0.00 54.79 55.43 1i59 n ASP 528 Cb 0.24 -2.39 -0.09 0.00 -0.02 0.00 0.00 41.12 38.86 1i59 n ASP 528 CO 0.00 0.00 0.00 1.17 -0.39 0.00 0.00 177.20 177.98 1i59 n LYS 529 N -1.55 0.57 -1.74 -1.24 0.00 -0.33 -4.72 118.16 109.15 1i59 n LYS 529 Ca 0.00 0.31 0.00 0.00 0.00 0.00 0.00 58.31 58.62 1i59 n LYS 529 Cb 0.08 -1.52 0.00 0.00 0.00 0.00 0.00 35.03 33.58 1i59 n LYS 529 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1i59 n GLY 530 N 1.33 0.00 2.89 3.14 0.00 -0.88 -3.75 105.19 107.92 1i59 n GLY 530 Ca -0.42 -1.61 -0.12 0.00 0.00 0.00 0.00 46.02 43.87 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 -2.51 -0.00 -0.11 2.61 2.01 -0.84 -2.20 115.64 114.60 1i59 s THR 531 Ca 0.00 0.02 -0.01 0.00 0.31 0.00 0.00 61.69 62.01 1i59 s THR 531 Cb 0.00 -0.05 0.03 0.00 0.01 0.00 0.00 72.50 72.49 1i59 s THR 531 CO 0.00 0.01 -0.04 -0.75 -0.69 0.00 0.00 174.62 173.14 1i59 s LYS 532 N 0.11 1.20 -0.17 4.92 2.20 0.05 -1.16 119.74 126.90 1i59 s LYS 532 Ca -0.01 -0.19 -0.05 0.00 -0.36 0.00 0.00 55.97 55.36 1i59 s LYS 532 Cb -0.01 -1.49 -0.03 0.00 -1.51 0.00 0.00 37.83 34.79 1i59 s LYS 532 CO -0.00 -0.32 -0.00 0.08 -0.36 0.00 0.00 175.35 174.74 1i59 s VAL 533 N 1.78 4.13 -0.10 4.02 1.01 0.40 -1.33 120.40 130.32 1i59 s VAL 533 Ca 0.04 -0.27 0.04 0.00 0.00 0.00 0.00 61.98 61.79 1i59 s VAL 533 Cb -0.13 -2.84 0.00 0.00 0.00 0.00 0.00 36.38 33.41 1i59 s VAL 533 CO -0.07 0.47 -0.23 -0.89 0.00 0.00 0.00 175.10 174.37 1i59 s THR 534 N 0.50 2.02 -0.09 3.92 2.01 -0.44 -0.99 115.64 122.57 1i59 s THR 534 Ca -0.01 -0.99 0.04 0.00 0.31 0.00 0.00 61.69 61.04 1i59 s THR 534 Cb -0.14 -1.75 -0.00 0.00 0.01 0.00 0.00 72.50 70.62 1i59 s THR 534 CO 0.02 0.55 -0.24 -0.63 -0.69 0.00 0.00 174.62 173.63 1i59 s ILE 535 N 0.38 2.10 -0.18 1.82 1.01 0.33 -1.05 121.20 125.61 1i59 s ILE 535 Ca -0.18 -1.02 0.01 0.00 0.00 0.00 0.00 60.65 59.46 1i59 s ILE 535 Cb -0.18 -1.79 0.02 0.00 0.01 0.00 0.00 42.46 40.52 1i59 s ILE 535 CO 0.08 0.56 -0.20 -0.13 0.00 0.00 0.00 174.94 175.25 1i59 s ARG 536 N 0.20 3.00 0.03 2.79 0.52 -0.27 -0.48 118.95 124.73 1i59 s ARG 536 Ca -0.14 -0.83 0.06 0.00 -0.52 0.00 0.00 55.73 54.29 1i59 s ARG 536 Cb -0.17 -2.56 -0.03 0.00 0.52 0.00 0.00 34.95 32.71 1i59 s ARG 536 CO 0.07 -0.19 -0.14 -0.51 0.02 0.00 0.00 175.30 174.55 1i59 s LEU 537 N 1.24 2.79 0.59 2.53 1.43 0.44 -1.31 118.68 126.40 1i59 s LEU 537 Ca 0.04 -0.34 -0.18 0.00 -1.03 0.00 0.00 54.13 52.62 1i59 s LEU 537 Cb -0.13 -1.62 -0.03 0.00 0.03 0.00 0.00 46.19 44.43 1i59 s LEU 537 CO -0.12 0.26 1.15 -2.16 0.23 0.00 0.00 176.35 175.71 1i59 s PRO 538 N -1.45 3.06 0.14 1.29 0.04 -1.26 0.18 135.00 137.00 1i59 s PRO 538 Ca 0.16 1.63 0.03 0.00 0.04 0.00 0.00 61.00 62.85 1i59 s PRO 538 Cb -0.11 -1.96 -0.10 0.00 0.04 0.00 0.00 34.50 32.37 1i59 s PRO 538 CO 0.06 -1.09 1.31 -0.07 0.04 0.00 0.00 177.00 177.26 1i59 h LEU 539 N 0.77 0.19 -0.11 -3.56 3.38 -1.48 -3.43 115.31 111.07 1i59 h LEU 539 Ca -0.49 -0.18 0.00 0.00 0.09 0.00 0.00 57.88 57.30 1i59 h LEU 539 Cb 1.27 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.96 1i59 h LEU 539 CO 0.55 1.05 0.00 0.35 0.09 0.00 0.00 178.44 180.48